A0A3Q0KQH7_SCHMA Loading...

Pumilio, putative

AlphaFold DB , UniProt , Accession A0A3Q0KQH7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,502 aa.

>A0A3Q0KQH7_SCHMA|A0A3Q0KQH7
MSAEEVARVTPDLTGLLSTSIPPPGFSVVGSTTSLGDLTITTPGPSSINCKSLSIGYPPHWPAALPDLNLSVFQDGASQLPDALCLTDDDALDIAANCANSTGVCLDMQTKENIDDCSSDLPHHFHNLSIIGSSRANQIWAVGAERRISTTPGSDTAGGSNCSSGLLSCFGDSHCSVGSGNFSANGVNYNSAASGEAHSFAGSGVTGDITPLPGQLGHLTASNGTAVPGRLENQHSQENANMAPFDLLSIWEPRQNNSHHVWLPDPSQDPVTANTTVGNCATTGNDCPEEQDNHNHLGLGIDNGAENEVLPWNWDTACGLANTTSWRDLFPECKDSEPINLPYNNSENGINHSNAPEFGAHAPSGLWSSSIHNVTSSMSISASSPLSTQPTILFGSAMGLVSESNDIDTLQHSHRVLQDQSDAYNDVTMPRSNASLFAQPNSTLINPRSTAFRGSSVSNSDLNSMSDTITSNLFPLPSSTAMPNSLLAIPPLFLFGQSAESECSGLITPSANITTLPASSTPLQIPVSFVGGQGSAFGPTFQLSEAHIMNDIYTKYPGILPPPGLCAVSSPSSSNCATPTLPSAAAASATSSVSQLPPGNFEGNPLCESTVVNNNNFPFGYNMPPTSQLNMMDPQSMAMAMTLFMSQGGAANNNNSNNSQIPPPLSQAPQWNHVAFMIMQQLANGMANNPGCVVSSTPNTVIDNITPSANGNNIVDQSRLAAGAFAFFQAQQQLMNAAQQQRHSTALSGGSVVSNNSSNCIAPTVTSSTPLVSPFTSSVVTNPSNYFGGLYSSGSVVGGLNPGNFSIPNGINLLPPVGLLHPEASGSPNSVAGDVSSYSRMPISQPPGALAVSMHISPTSPSGLQRPPLSVSTGFSSATPYPFNFDASMHKNRAFAAAFAAASGVAVTATPPPGMGPNPNLRPTGVNHPALLGTRAPVPPPLMPVVTGRSPGLLSAVHSQTVQQSPNYAAALQSHQNINQRLPAPLLSPLPLTLSGTASSRPSSVVGVNITTSTPLVVTTVSSRSQLLEDFRNSSARFQHMHLSELRDHMVEFARDQHGSRFIQQKLETATTAEKNSVFNEILPHSGKLMTDVFGNYVIQKFFEFGTKEQKELLSQRLQGHVVEFATQMYGCRVIQKALESVPAEAKIHIVGELRPFVTRCVKDQNGNHVIQKCIECVPPSELDFIISAFRGQVVLLSSHPYGCRVIQRILEHCLPEQTRPILDELHKGVEHLVKDQYGNYVIQHVLEHGSNEDKSRIIQNLRGRVCALSSHKFASNVMEKAIANAVPSERAVLIEEILHPISNVNINGDTSSVTTNNISSSLVDMMKDQYANYVVQRMLELADTEQRRVLINRIRPMQNVLRKFNYGKHIIAKLEKYNNVAGNNNTTGKSSSANNNNNNNNNNNTTNNNNTNLSVSNNSSTNHVSKTSNNSNNNNGTGNNNGGCNNTNNSNNGGTPAASKSAGSNSESNGMTTLQQNDSSTNTTATTTTHKSSNDKANHRT
Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M40.5Very low49.6Very low186 Ų186116 Ų11692%0.91666%0.658SS**  0146.10-64.2167.674.800108.8E5M1-E5 VanDerWaalsContact C-OE2 3.25Å; M1-E5 WeakPolarHBondContact CA-OE2 3.49Å; M1-E5 HydrophobicContact CB-CB 4.43Å; M1-E5 VanDerWaalsContact CB-OE2 3.3Å; M1-E5 WeakPolarHBondContact CB-OE2 3.42Å; M1-E5 HydrophobicContact CE-CB 4.28Å
2S49.5Very low49Very low53 Ų53116.1 Ų116.137%0.37166%0.655SS.*  trans-85.8165.2172.579.40000111.4E4 E5S2-E4 PolarHBondContact O-N 3.08Å; S2-E4 PolarHBondContact OG-N 3.26Å; S2-E5 PolarHBondContact N-OE2 3.38Å; S2-E5 PolarHBondContact O-N 2.67Å; S2-E5 PolarHBondContact OG-N 3.31Å
3A45.4Very low47.9Very low87 Ų87117.5 Ų117.572%0.71966%0.659SS**Hα-helixtrans-61.9-25.6172.800000112.8A7A3-A7 PolarHBondContact O-N 2.76Å
4E58Low47.2Very low130 Ų130119.5 Ų119.561%0.60768%0.675SS**Hα-helixtrans-75-24.9176.6-65-179.288.900113.4S2 R8S2-E4 PolarHBondContact O-N 3.08Å; S2-E4 PolarHBondContact OG-N 3.26Å; E4-R8 WeakPolarHBondContact O-CG 3.4Å
5E57.8Low46.4Very low99 Ų99115.7 Ų115.746%0.46367%0.674SS.*Hα-helixtrans-72.2-40.1173.3-70.3176113.100110.8M1 S2 A7 R8 V9M1-E5 VanDerWaalsContact C-OE2 3.25Å; M1-E5 WeakPolarHBondContact CA-OE2 3.49Å; M1-E5 HydrophobicContact CB-CB 4.43Å; M1-E5 VanDerWaalsContact CB-OE2 3.3Å; M1-E5 WeakPolarHBondContact CB-OE2 3.42Å; M1-E5 HydrophobicContact CE-CB 4.28Å; S2-E5 PolarHBondContact N-OE2 3.38Å; S2-E5 PolarHBondContact O-N 2.67Å; S2-E5 PolarHBondContact OG-N 3.31Å; E5-A7 VanDerWaalsContact C-N 3.31Å; E5-A7 PolarHBondContact O-N 2.99Å; E5-R8 PolarHBondContact O-N 3.34Å; E5-V9 WeakPolarHBondContact O-CG2 3.35Å
6V48.7Very low45.4Very low97 Ų97116.7 Ų116.759%0.58867%0.674SS**Hα-helixtrans-62-40.2175.9-177.60000111.1R8V6-R8 PolarHBondContact O-N 3.13Å
7A60.1Low44.6Very low83 Ų83119.3 Ų119.369%0.68668%0.684SS**THydrogen-bonded Turntrans-69.3-11.8-177.100000115.4A3 E5A3-A7 PolarHBondContact O-N 2.76Å; E5-A7 VanDerWaalsContact C-N 3.31Å; E5-A7 PolarHBondContact O-N 2.99Å
8R56.3Low44Very low200 Ų200118.6 Ų118.676%0.75569%0.688SS**THydrogen-bonded Turntrans-102.4-10.4-175.3-69.2-178.7-168.6-141.33.8115.1E4 E5 V6E4-R8 WeakPolarHBondContact O-CG 3.4Å; E5-R8 PolarHBondContact O-N 3.34Å; V6-R8 PolarHBondContact O-N 3.13Å
9V48.7Very low43.5Very low111 Ų111119.4 Ų119.467%0.67370%0.695SS**THydrogen-bonded Turntrans-95.6-21.8-168.2178.50000113.4E5E5-V9 WeakPolarHBondContact O-CG2 3.35Å
10T43.7Very low43.1Very low105 Ų105119.4 Ų119.464%0.64470%0.702SS**  trans-142.9106.4-176.953.20000114.1
11P37Very low43.1Very low125 Ų125121.1 Ų121.181%0.81271%0.707SS**  trans-120.641.2166.240.5-29.6000112.9
12D42.3Very low43Very low117 Ų117117.2 Ų117.263%0.62670%0.695SS**  trans-151.356.2174.2-147.111000113.6I130D12-I130 HydrophobicContact CB-CD1 4.31Å; D12-I130 WeakPolarHBondContact OD2-CD1 3.37Å
13L35.3Very low42.4Very low135 Ų135120.3 Ų120.371%0.70771%0.714SS**  trans-144.830.9173.8-121.5170.9000113.9
14T38.1Very low41.9Very low145 Ų145122.6 Ų122.689%0.8972%0.721SS**SBendtrans-127.378.7170.946.30000109.4
15G34.8Very low40.9Very low63 Ų63120 Ų12065%0.64973%0.729SS**  trans-173.9-23.3-17700000114.5L17G15-L17 VanDerWaalsContact C-N 3.3Å; G15-L17 PolarHBondContact O-N 2.87Å
16L30.8Very low39.7Very low131 Ų131125.2 Ų125.269%0.68675%0.751SS**  trans-81.469.6170.8-73.3178.1000112.1N127L16-N127 WeakPolarHBondContact CD1-ND2 3.37Å
17L30.9Very low39Very low161 Ų161125.6 Ų125.684%0.84376%0.758SS**SBendtrans-169.7125.2155.1-106.5167.5000108.8G15G15-L17 VanDerWaalsContact C-N 3.3Å; G15-L17 PolarHBondContact O-N 2.87Å
18S34.2Very low37.8Very low107 Ų107128.1 Ų128.175%0.74876%0.764SS**SBendtrans63.3131.4-162.381.20000112.9
19T34.8Very low36.8Very low133 Ų133125.1 Ų125.182%0.81677%0.768SS**  cis-136.599.916.941.30000112.8
20S35.3Very low36.2Very low120 Ų120123.6 Ų123.684%0.83978%0.775SS**  trans-91.9111.6164.341.90000110.3
21I42.4Very low35.6Very low156 Ų156123.8 Ų123.880%0.878%0.78SS**PPolyproline II helixtrans-72.2123.8174.3-62.3171.4000108.3
22P39.8Very low35.5Very low104 Ų104124 Ų12468%0.67578%0.779SS**PPolyproline II helixtrans-71.4145176.929.6-34.3000111.1
23P36.1Very low35.2Very low118 Ų118124.8 Ų124.877%0.76679%0.789SS**PPolyproline II helixtrans-65.4152.3175.327.9-34.4000111.6
24P34.7Very low35Very low135 Ų135123.8 Ų123.888%0.87779%0.793SS**SBendtrans-70.6136-175.329.2-35.3000112.1
25G36.6Very low34.9Very low75 Ų75125.2 Ų125.277%0.77379%0.794SS**  trans164.7-37.2167.600000116.3
26F33.7Very low34.9Very low209 Ų209125.3 Ų125.392%0.91780%0.796SS**  trans-110.6130.9-173-90.2-96.2000113.8
27S33.8Very low35.1Very low105 Ų105126.7 Ų126.773%0.73480%0.803SS**  trans-119.3122.9170.6178.20000109
28V35Very low35Very low135 Ų135126.4 Ų126.482%0.81880%0.802SS**  trans-131.3122.6168.1-179.90000107.9
29V35.5Very low35Very low138 Ų138127.6 Ų127.684%0.83681%0.805SS**  trans-95.6126.7-177.4178.60000109
30G35.8Very low34.9Very low79 Ų79128 Ų12881%0.81480%0.801SS**  trans-172.489.3179.900000114.1
31S30.3Very low34.7Very low109 Ų109128.5 Ų128.576%0.76280%0.799SS**  trans-86.8142.6175.8580000112.9
32T35.2Very low34.5Very low129 Ų129127.1 Ų127.179%0.79180%0.798SS**  trans-168.614213618.90000115
33T35Very low34.4Very low134 Ų134128.1 Ų128.182%0.82280%0.804SS**  trans53.6129.5148.254.40000122.5
34S32.4Very low34.1Very low113 Ų113125.5 Ų125.579%0.7980%0.799SS**  trans-116.7139.1161.652.60000112
35L35.7Very low34.4Very low175 Ų175124.9 Ų124.992%0.91680%0.795SS**  trans-114.3158.8150.7-86.775.6000106.4
36G35.4Very low34.4Very low66 Ų66126 Ų12668%0.6879%0.79SS**  cis145.8102.4200000109.6
37D33.4Very low34.5Very low159 Ų159121 Ų12185%0.8578%0.781SS**  trans11.7123.6172.8-56.6-37.6000120.5
38L30Very low34.5Very low155 Ų155124.2 Ų124.281%0.81279%0.789SS**  trans-149.378.7154.5-129.5164.8000112.1I40L38-I40 HydrophobicContact CD2-CD1 4.25Å; L38-I40 HydrophobicContact CD2-CG1 3.87Å
39T34.1Very low34.4Very low132 Ų132124.6 Ų124.681%0.8179%0.786SS**  trans-82.2124.1166.129.50000110.3
40I33.4Very low34.2Very low142 Ų142123.4 Ų123.473%0.72878%0.783SS**  trans-103.8112.5170.7-61.8-179.4000108.9L38 T42L38-I40 HydrophobicContact CD2-CD1 4.25Å; L38-I40 HydrophobicContact CD2-CG1 3.87Å; I40-T42 HydrophobicContact CG2-CG2 4.46Å
41T30.5Very low34Very low130 Ų130129.3 Ų129.380%0.79879%0.786SS**  trans-110.1140.2165.547.20000109.2
42T37.9Very low34.1Very low127 Ų127129.1 Ų129.178%0.77979%0.785SS**  trans-132.9138.3171.848.30000110.1I40I40-T42 HydrophobicContact CG2-CG2 4.46Å
43P38.3Very low33.8Very low126 Ų126130.1 Ų130.182%0.81878%0.784SS**  trans-100.2168.1-162.140.3-38.3000114.2
44G29.6Very low33.5Very low63 Ų63128.2 Ų128.265%0.64978%0.777SS**  trans-70.6173.4154.600000111.5
45P41.4Very low33.3Very low122 Ų122131.3 Ų131.379%0.79278%0.782SS**  -151.7179.967.638.3-17.7000117.1
46S36.9Very low33.1Very low97 Ų97126.7 Ų126.768%0.67878%0.777SS**  trans51.2105.3144.562.90000121.3
47S34.1Very low32.8Very low104 Ų104134.5 Ų134.573%0.72779%0.788SS**  40.3127.5126.564.30000121.6
48I33.6Very low32.8Very low174 Ų174132.3 Ų132.389%0.89278%0.782SS**  -165.6165.4107.9-98.9158.4000109.9
49N33.2Very low33.2Very low142 Ų142130 Ų13076%0.75978%0.777SS**  trans-103.2175.2-167.7-168.211.7000113.1
50C32.3Very low33.3Very low113 Ų113132.8 Ų132.876%0.76478%0.78SS**  trans97.6136.3159.6-63.20000118.6
51K31.5Very low33.1Very low204 Ų204136.4 Ų136.489%0.88779%0.785SS**  trans-85.1156.4-177.7-53.9165.8-180175.70110.7
52S31.4Very low33.5Very low105 Ų105135.7 Ų135.773%0.73478%0.782SS**  143.8155.4111.2-153.90000114.7
53L29.8Very low33.2Very low149 Ų149133.3 Ų133.378%0.7878%0.776SS**  trans68.293159-70.8155.1000120.5
54S28.3Very low33Very low95 Ų95132.5 Ų132.566%0.66478%0.78SS**  63.3129.6105.9-61.40000123.7
55I27.6Very low33.3Very low177 Ų177136.2 Ų136.291%0.90878%0.784SS**  trans77.9117.9148.2-59.6155.5000117.4
56G32.5Very low33.3Very low79 Ų79135.8 Ų135.881%0.81478%0.781SS**  trans170.794.5169.700000115.3
57Y29.8Very low33.1Very low229 Ų229136.3 Ų136.390%0.89878%0.776SS**  trans-87.8169.5166.3-95.9-72.5000110.3
58P33.3Very low32.9Very low113 Ų113139.1 Ų139.173%0.73478%0.782SS**  cis-130.9-128.4-1242.2-20.1000111.9
59P38.3Very low32.9Very low107 Ų107137.1 Ų137.170%0.69577%0.773SS**  trans-122.9-175-148.934.6-9.3000115.7
60H35.6Very low32.8Very low190 Ų190136.4 Ų136.488%0.8877%0.769SS**  trans-167.2151.5139.2-109.8-77.2000113.3
61W29.7Very low32.7Very low219 Ų219136.4 Ų136.483%0.8377%0.77SS**  trans-92.5179.7175.7-99.652.1000111A63W61-A63 HydrophobicContact CE3-CB 4.49Å; W61-A63 HydrophobicContact CZ3-CB 4.44Å
62P37.5Very low32.7Very low114 Ų114132.3 Ų132.374%0.7476%0.762SS**  cis-146.7164.326.243-22.6000121
63A32.7Very low32.6Very low78 Ų78135.2 Ų135.265%0.64576%0.761SS**  trans18.1136.8141.700000124.2W61W61-A63 HydrophobicContact CE3-CB 4.49Å; W61-A63 HydrophobicContact CZ3-CB 4.44Å
64A34.2Very low32.6Very low109 Ų109134.8 Ų134.890%0.90176%0.755SS**  trans-152.893.1135.600000110.4
65L35.9Very low32.6Very low141 Ų141137 Ų13774%0.73876%0.76SS**  trans-97.6155.4167-97.8167.8000108.5
66P40.2Very low32.7Very low112 Ų112132.4 Ų132.473%0.72776%0.756SS**  -149.4179.277.839.3-20.4000115.1
67D33.3Very low32.6Very low109 Ų109133.2 Ų133.258%0.58376%0.755SS**  cis-164150.3-36.7-92.8-32.4000107.9
68L30.9Very low32.5Very low162 Ų162127 Ų12785%0.84875%0.745SS**  -174.3115.3124.9-100.7163.4000109.9
69N32.6Very low32.3Very low133 Ų133130.7 Ų130.771%0.71175%0.753SS**  trans-12.7127.9179.3-68.6-37.9000118.4
70L30.8Very low31.8Very low126 Ų126133 Ų13366%0.6676%0.759SS**  cis59.3110.948.8-68.582.8000115.6
71S30.7Very low31.8Very low114 Ų114128.9 Ų128.980%0.79775%0.749SS**  -156125.2110.1-13.80000107.1
72V30.6Very low31.9Very low117 Ų117125.7 Ų125.771%0.70975%0.748SS**  69.8133.965.9166.50000112.4
73F29.8Very low31.5Very low166 Ų166124.5 Ų124.573%0.72875%0.748SS**  cis-177.9150.3-31.6-132.8-84.2000105.5
74Q29.9Very low31.3Very low140 Ų140128.8 Ų128.865%0.65476%0.759SS**  trans43.6142.6155.1-91.2175.6-88.400124.2
75D29.3Very low31.1Very low142 Ų142128.4 Ų128.476%0.75975%0.748SS**  trans57.5127.7140.9-52.7-20.8000121.3
76G29.6Very low30.8Very low81 Ų81128.8 Ų128.884%0.83575%0.75SS**  trans162.2129.7165.200000114
77A29.8Very low30.4Very low95 Ų95128.4 Ų128.479%0.78575%0.746SS**  trans-88.7136.7-179.300000113.1
78S27.1Very low30.6Very low99 Ų99129.6 Ų129.669%0.69275%0.753SS**  trans24.5111147.560.30000120.3
79Q30Very low30.9Very low191 Ų191128.2 Ų128.289%0.89375%0.746SS**  -172.2164.1126.5-103.4151.8107.900113.2
80L28.4Very low31Very low156 Ų156124.6 Ų124.682%0.81773%0.727SS**  trans-93.2-174.7175-67.287.9000110.4
81P34.2Very low31.2Very low103 Ų103121.5 Ų121.567%0.66972%0.719SS**  cis-132173.9-9.918.67.5000116.2
82D32Very low31.2Very low152 Ų152122.6 Ų122.681%0.81372%0.715SS**  trans21.3133141.6-42.4-30.6000122.5
83A28.8Very low31.3Very low89 Ų89122.5 Ų122.574%0.73671%0.711SS**  163.4160.6101.200000114.9
84L29.9Very low31.3Very low167 Ų167121.1 Ų121.187%0.87471%0.709SS**  trans72.9145.9164.9-54.9174.4000118.9
85C28.6Very low31.2Very low101 Ų101118.8 Ų118.868%0.68272%0.715SS**  cis-171.1172.8-27.8-157.40000110.3
86L31.3Very low31.2Very low149 Ų149116.3 Ų116.378%0.7871%0.714SS**  trans72.9150.9167.8-46.4-179.8000116.8
87T31.4Very low31.2Very low104 Ų104119.6 Ų119.664%0.63871%0.712SS**  cis-179.2150.5-18.634.20000106.1
88D37.5Very low31Very low135 Ų135120.7 Ų120.772%0.72271%0.712SS**  cis-148.5-149.5-14.9-77.2-33.4000105.9
89D36.1Very low31.1Very low132 Ų132120 Ų12071%0.70671%0.713SS**  cis-162.1-173.814.5-166.1-1.3000109.5P913D89-P913 WeakPolarHBondContact O-CG 3.5Å
90D36.4Very low31.1Very low58 Ų58118.5 Ų118.531%0.3171%0.711SS.*  trans-119.1179.8-153.4-83.5-21.1000119.8P913 G914 M915D90-P913 VanDerWaalsContact C-CD 3.48Å; D90-G914 WeakPolarHBondContact CB-O 3.4Å; D90-G914 VanDerWaalsContact CG-O 3.27Å; D90-G914 WeakPolarHBondContact OD1-CA 3.49Å; D90-G914 PolarHBondContact OD1-N 3.18Å; D90-M915 VanDerWaalsContact CG-N 3.28Å; D90-M915 VanDerWaalsContact OD1-CB 3.3Å; D90-M915 WeakPolarHBondContact OD1-CB 3.16Å; D90-M915 WeakPolarHBondContact OD1-CG 3.12Å; D90-M915 PolarHBondContact OD1-N 3.4Å; D90-M915 VanDerWaalsContact OD1-N 3.15Å; D90-M915 VanDerWaalsContact OD2-CB 3.27Å; D90-M915 WeakPolarHBondContact OD2-CB 3.47Å; D90-M915 PolarHBondContact OD2-N 2.92Å; D90-M915 VanDerWaalsContact OD2-N 3.09Å
91A33.4Very low31.2Very low61 Ų61115.8 Ų115.850%0.50471%0.705SS.*  trans129.2119.6148.100000119.2P912 P913A91-P912 WeakPolarHBondContact O-CA 3.41Å; A91-P913 CarbonylContact C-O 3.07Å; A91-P913 PolarHBondContact N-O 2.98Å
92L32.2Very low31Very low136 Ų136117.3 Ų117.371%0.71271%0.713SS**  trans-73.3174.6177.2-97.451.5000115.6P913L92-P913 WeakPolarHBondContact CD1-O 3.43Å; L92-P913 PolarHBondContact N-O 3.35Å
93D32.4Very low30.8Very low116 Ų116113.3 Ų113.362%0.6271%0.708SS**  cis171.5-178.9-36.9-168.913.9000109
94I29.1Very low30.9Very low136 Ų136115.5 Ų115.570%0.69771%0.711SS**  trans82.5107.4154.3-71.7164000120.4
95A28.7Very low30.6Very low92 Ų92113.3 Ų113.376%0.7671%0.708SS**  59.1129.8128.900000126
96A29.2Very low30.7Very low90 Ų90117.2 Ų117.274%0.74472%0.722SS**  93.2147.5129.500000123
97N28.5Very low30.5Very low150 Ų150115.3 Ų115.380%0.80271%0.712SS**  trans80.6101.4161.6-68.2-16.9000122.1
98C26.2Very low30.5Very low117 Ų117119.6 Ų119.679%0.79173%0.728SS**  66.9111.5122.5-64.20000122.9
99A29.8Very low30.1Very low85 Ų85120 Ų12070%0.70273%0.725SS**  82.2126.2125.900000121.6
100N30Very low30Very low160 Ų160120.6 Ų120.686%0.85673%0.734SS**  trans50.6126.7148.4-54.8-7.7000118.2
101S29.9Very low29.6Very low98 Ų98126.4 Ų126.469%0.68576%0.756SS**  -177.8148.261-169.50000113.4
102T29.4Very low29.6Very low136 Ų136132.4 Ų132.483%0.83477%0.774SS**  trans40.4130.2146.6530000122.5
103G28.3Very low29.5Very low68 Ų68132.3 Ų132.370%0.70177%0.774SS**  trans161.7116.4132.800000118.1
104V30.4Very low29.4Very low134 Ų134134.1 Ų134.181%0.81278%0.782SS**  trans53.895.5147.2-170.30000116.4
105C24.3Very low29.4Very low121 Ų121134.7 Ų134.782%0.81879%0.786SS**  58.1107.767.9-56.50000115.9
106L31Very low29.3Very low183 Ų183138.1 Ų138.196%0.95879%0.792SS**  trans-134.6145.5145.6-112.2165.8000108.2
107D26.2Very low29.1Very low109 Ų109140.1 Ų140.158%0.58380%0.799SS**  trans-131.6140.7-156.5175.228.1000110.9Q109D107-Q109 WeakPolarHBondContact OD1-CG 3.46Å; D107-Q109 PolarHBondContact OD2-NE2 3.19Å
108M32.2Very low29.1Very low195 Ų195138.2 Ų138.296%0.96180%0.798SS**  trans-159148.2153.8-116.2178.9-175.400112.2
109Q28.2Very low29.4Very low143 Ų143137.7 Ų137.767%0.66880%0.795SS**  trans-133.5129.9-152.8-52.6167.910.700113.2D107D107-Q109 WeakPolarHBondContact OD1-CG 3.46Å; D107-Q109 PolarHBondContact OD2-NE2 3.19Å
110T33.2Very low29.4Very low145 Ų145140.7 Ų140.789%0.8980%0.799SS**  trans-173.9115.3152.4410000106.6
111K29.7Very low29.4Very low179 Ų179140.7 Ų140.778%0.77880%0.799SS**  cis82.576.415.1-157.2-172.2177.5-179.60117.6
112E32.9Very low29.5Very low187 Ų187141.6 Ų141.687%0.87480%0.802SS**  trans-158.5110.3135.9-105.3163.5-161.300105.9
113N29.9Very low29.5Very low134 Ų134143.8 Ų143.872%0.71780%0.803SS**  62.495.679.2-82.715.3000114.7
114I30.9Very low29.5Very low155 Ų155149.1 Ų149.180%0.79581%0.809SS**  -179.2112.6108.5-86.8152.8000109.2
115D28.2Very low29.4Very low147 Ų147152.5 Ų152.579%0.78681%0.813SS**  trans46.8156.7150.6-51.1-30.7000123.6
116D26.5Very low29.8Very low164 Ų164155.6 Ų155.688%0.87782%0.815SS**  trans56.167.4175.7-71.1-9000118.5
117C26.5Very low29.6Very low133 Ų133152.2 Ų152.290%0.89980%0.798SS**  trans-147.6133.7155.5-92.30000112.7
118S28Very low29.7Very low110 Ų110155.4 Ų155.477%0.76981%0.814SS**  trans-146.9114.4158.158.30000111.8
119S31.3Very low29.6Very low105 Ų105151.4 Ų151.473%0.73481%0.805SS**  trans42.3100.2159.355.40000116.8
120D30.3Very low29.7Very low148 Ų148151 Ų15179%0.79181%0.807SS**  53.8146.356-75-48.5000116.8
121L30.4Very low29.6Very low161 Ų161151.8 Ų151.884%0.84380%0.803SS**  trans76.1130.9175.1-92.665.7000117.7
122P32.1Very low29.6Very low116 Ų116144.6 Ų144.675%0.75378%0.78SS**  -129.6170.2-7035-23.3000114.4
123H29.3Very low29.3Very low183 Ų183139.9 Ų139.985%0.84777%0.768SS**  trans-70.6127.4177.1-71.3-123.5000113.2
124H27.9Very low29.4Very low180 Ų180136 Ų13683%0.83375%0.751SS**  trans-169.890.6136.5-110.171.7000110.1
125F29Very low29.4Very low204 Ų204140.4 Ų140.490%0.89576%0.757SS**  trans175.978.2156.4-91.8-55.7000109.7
126H31.4Very low29.4Very low186 Ų186137.1 Ų137.186%0.86175%0.751SS**  trans-148.388.5171.5-110.950.6000109.5
127N28.5Very low29.7Very low112 Ų112132.6 Ų132.660%0.59973%0.727SS**SBendtrans176.135.2155.4-941.3000112.6L16L16-N127 WeakPolarHBondContact CD1-ND2 3.37Å
128L27.9Very low30Very low177 Ų177135.4 Ų135.493%0.92773%0.727SS**  trans-14089.2169.4-78.1179000109.5
129S28.9Very low30Very low111 Ų111137.6 Ų137.678%0.77673%0.728SS**  trans-138.324.3174.4-169.80000113.3I131S129-I131 PolarHBondContact O-N 2.82Å
130I30.5Very low29.9Very low135 Ų135137.3 Ų137.369%0.69271%0.711SS**  trans-95.875.3169.1-59.7172.9000108.7D12D12-I130 HydrophobicContact CB-CD1 4.31Å; D12-I130 WeakPolarHBondContact OD2-CD1 3.37Å
131I30.9Very low29.8Very low160 Ų160134 Ų13482%0.82171%0.705SS**SBendtrans-172.4125.1153.4-95.9151.3000105S129S129-I131 PolarHBondContact O-N 2.82Å
132G30.1Very low29.6Very low28 Ų28132.9 Ų132.929%0.28970%0.704SS.*  trans-70156.8-165.700000115.3S134G132-S134 PolarHBondContact O-N 2.98Å
133S26.9Very low29.3Very low89 Ų89129 Ų12962%0.62269%0.685SS**SBendtrans-72.724.8-169.5-63.70000116.3R135S133-R135 PolarHBondContact O-N 2.94Å; S133-R135 VanDerWaalsContact O-N 3.09Å
134S32.6Very low29.1Very low51 Ų51122.1 Ų122.136%0.35766%0.659SS.*THydrogen-bonded Turntrans-64.6-14.6-177.3-46.70000114.6G132 E1248 H1249G132-S134 PolarHBondContact O-N 2.98Å; S134-E1248 VanDerWaalsContact CA-OE1 3.32Å; S134-E1248 WeakPolarHBondContact CA-OE1 3.2Å; S134-E1248 VanDerWaalsContact CB-OE2 3.22Å; S134-E1248 WeakPolarHBondContact CB-OE2 3.3Å; S134-E1248 PolarHBondContact OG-OE2 3.1Å; S134-H1249 PolarHBondContact OG-CE1 3.38Å; S134-H1249 PolarHBondContact OG-NE2 3.47Å; S134-H1249 VanDerWaalsContact OG-NE2 3.15Å
135R30.1Very low29.1Very low248 Ų248120.5 Ų120.594%0.93665%0.652SS**THydrogen-bonded Turntrans-102.16.2-171.5-136.8171.5-174.2173.21.5115.2S133S133-R135 PolarHBondContact O-N 2.94Å; S133-R135 VanDerWaalsContact O-N 3.09Å
136A29.5Very low29Very low78 Ų78121.4 Ų121.465%0.64565%0.65SS**SBendtrans-106.815.1-169.500000116.1
137N32.3Very low28.9Very low69 Ų69123.7 Ų123.737%0.36965%0.651SS.*  trans-130.814.5-177.7-96.1-62.6000116.5R1338N137-R1338 PolarHBondContact OD1-NE 3.29Å; N137-R1338 PolarHBondContact OD1-NH2 3.23Å
138Q32.4Very low28.9Very low192 Ų192125.7 Ų125.790%0.89766%0.66SS**SBendtrans-97.468.1161.9-74.5-170.8-1000110.9
139I28.9Very low28.9Very low157 Ų157121.7 Ų121.781%0.80565%0.647SS**SBendtrans-17466.1154.1-94.5147.6000109.4
140W28.1Very low28.6Very low99 Ų99121.4 Ų121.438%0.37564%0.64SS.*  trans-152.233.8157.9-122.296.8000115K1374 K1377W140-K1374 HydrophobicContact CE3-CD 3.93Å; W140-K1374 HydrophobicContact CH2-CD 3.36Å; W140-K1374 HydrophobicContact CZ2-CD 4.15Å; W140-K1374 HydrophobicContact CZ3-CD 3.26Å; W140-K1377 HydrophobicContact CH2-CD 3.59Å; W140-K1377 VanDerWaalsContact CH2-CE 3.49Å; W140-K1377 HydrophobicContact CZ2-CD 3.62Å
141A28.9Very low28.6Very low79 Ų79120.7 Ų120.765%0.65364%0.642SS**  trans-119.749.4171.700000111.9Y1334A141-Y1334 HydrophobicContact CB-CE1 4.38Å
142V26.1Very low28.4Very low137 Ų137118.4 Ų118.483%0.8364%0.638SS**  trans-128.1103.4172-177.50000109.2
143G24.5Very low28.1Very low35 Ų35119.8 Ų119.836%0.36165%0.653SS.*  trans173.196-18000000114.6H1370G143-H1370 PolarHBondContact O-ND1 3.35Å
144A26.5Very low28Very low37 Ų37120.3 Ų120.331%0.30666%0.656SS.*  trans68.4119.6177.400000115.9K1369 H1370A144-K1369 HydrophobicContact CB-CD 4.43Å; A144-K1369 WeakPolarHBondContact O-CE 2.89Å; A144-H1370 PolarHBondContact O-CE1 3.32Å
145E28.1Very low27.6Very low147 Ų147123.2 Ų123.269%0.68767%0.667SS**  cis-63.6148.3-0.7-76.471.6-124.400112.7K1369E145-K1369 VanDerWaalsContact CD-NZ 3.32Å; E145-K1369 IonicContact OE1-NZ 2.68Å; E145-K1369 PolarHBondContact OE1-NZ 3.48Å; E145-K1369 IonicContact OE2-NZ 3.77Å; E145-K1369 PolarHBondContact OE2-NZ 2.78Å
146R25.8Very low27.3Very low223 Ų223113.9 Ų113.984%0.84264%0.638SS**  cis59.964.710.3-77.5-154.5-171.3-161.78.2116.5
147R30.1Very low27.1Very low233 Ų233114 Ų11488%0.87964%0.64SS**  -172.9144.7124.9-95.2149.2-161.8-104.35108.6
148I28.9Very low26.8Very low155 Ų155113.3 Ų113.380%0.79565%0.648SS**  trans57.988.1177.4-51.7175.8000112.1
149S26.6Very low26.5Very low93 Ų93106.7 Ų106.765%0.6563%0.632SS**  cis53.6124.727.9-177.60000113.4
150T23.7Very low26.4Very low104 Ų104103.3 Ų103.364%0.63862%0.622SS**  trans61.5122.4163.746.60000114.5
151T30Very low26.3Very low120 Ų120102.9 Ų102.974%0.73663%0.627SS**  48142.772.872.40000112.9
152P27.5Very low26.2Very low113 Ų113102.5 Ų102.573%0.73462%0.619SS**  cis-117.6-163.119.927-1.2000109.7
153G23.5Very low26.2Very low57 Ų5799 Ų9959%0.58860%0.601SS**  cis67.510836.700000109.6
154S24.5Very low26.4Very low99 Ų99100.8 Ų100.869%0.69261%0.607SS**  trans58.8166.9178.784.40000114.6
155D23.6Very low26.7Very low112 Ų112102.6 Ų102.660%0.59963%0.629SS**  cis-146.5147.115.3-116.6-48000113.5
156T24.1Very low26.9Very low53 Ų53102.8 Ų102.833%0.32563%0.634SS.*  trans69152.1148.162.40000120.1T745 A746T156-T745 VanDerWaalsContact OG1-CA 3.3Å; T156-T745 WeakPolarHBondContact OG1-CA 3.31Å; T156-A746 WeakPolarHBondContact OG1-CA 3.32Å; T156-A746 PolarHBondContact OG1-N 3.02Å
157A25.7Very low27Very low81 Ų8199.3 Ų99.367%0.66963%0.632SS**SBendcis-120152.53.600000112.2
158G26Very low26.9Very low53 Ų5392.9 Ų92.955%0.54662%0.623SS.*  cis168.6139.2-3.500000111.8
159G25.2Very low27Very low54 Ų5490.2 Ų90.256%0.55762%0.617SS**  trans75.9148.8-171.800000112.7
160S26.1Very low26.9Very low85 Ų8594 Ų9459%0.59462%0.622SS**  cis-143.9128.6-11.3-980000108.9G749S160-G749 PolarHBondContact OG-O 2.96Å
161N25.9Very low27.1Very low91 Ų9192 Ų9249%0.48762%0.622SS.*  67.2135.180-65.3-64.1000111.1G749 G750N161-G749 PolarHBondContact ND2-O 3.41Å; N161-G750 WeakPolarHBondContact CB-O 3.36Å; N161-G750 PolarHBondContact ND2-N 3.49Å
162C27.1Very low27Very low71 Ų7192 Ų9248%0.4862%0.617SS.*  cis-163.6-176.712.2-134.80000113.8G750C162-G750 WeakPolarHBondContact CB-O 3.41Å
163S26.6Very low27Very low64 Ų6491.4 Ų91.445%0.44862%0.615SS.*  trans44.6132142-53.10000119S751S163-S751 PolarHBondContact OG-OG 3.39Å
164S29.7Very low27.2Very low71 Ų7194.4 Ų94.450%0.49761%0.614SS.*  cis-155.8117.744.6-57.40000114
165G31.5Very low27.3Very low75 Ų7596.2 Ų96.277%0.77363%0.625SS**  trans65.2-163.1134.200000117.5
166L32.2Very low27.5Very low152 Ų15294.4 Ų94.480%0.79662%0.621SS**  cis-129.5118.9-12.2-89171.3000105.9
167L27.8Very low27.6Very low150 Ų15098.7 Ų98.779%0.78565%0.647SS**  100.1155.388.3-168.683.4000109
168S28.2Very low27.7Very low98 Ų9897.9 Ų97.969%0.68565%0.647SS**  trans64.3120.4153.3172.60000117.5
169C31.1Very low27.8Very low99 Ų99101 Ų10167%0.66966%0.66SS**  cis-151153.8-2.8-104.90000106.1
170F25.8Very low27.9Very low173 Ų173101.6 Ų101.676%0.75967%0.666SS**  41.2121.981.4-68.6-103.5000111.4
171G27.5Very low27.9Very low62 Ų62104.6 Ų104.664%0.63968%0.675SS**  cis78.4165.739.800000109.2
172D27Very low28.1Very low118 Ų118109.2 Ų109.263%0.63169%0.692SS**  trans62.8166.4-168.8-46.3-45000110.3
173S27.4Very low28Very low101 Ų101111.5 Ų111.571%0.70671%0.708SS**  cis-133.9130.917.4-73.50000113.8
174H27.7Very low28.2Very low121 Ų121112 Ų11256%0.5672%0.716SS**  36.6114.5127.3-51.7-71.3000120.1S176H174-S176 WeakPolarHBondContact ND1-CB 2.75Å; H174-S176 PolarHBondContact ND1-OG 3.35Å
175C27.4Very low28.2Very low137 Ų137116.7 Ų116.793%0.92674%0.735SS**  -147101.797.1-82.90000107.1
176S27Very low28.2Very low74 Ų74116.3 Ų116.352%0.51773%0.732SS.*  cis70.2124.922.2-141.50000115.3H174H174-S176 WeakPolarHBondContact ND1-CB 2.75Å; H174-S176 PolarHBondContact ND1-OG 3.35Å
177V26.1Very low28.2Very low143 Ų143115.3 Ų115.387%0.86773%0.732SS**  trans69.5134.7168.5-170.10000116.6
178G28.1Very low28.4Very low64 Ų64114 Ų11466%0.6673%0.725SS**  trans14160.7-170.600000110.3
179S28.5Very low28.6Very low118 Ų118118 Ų11883%0.82573%0.727SS**  55.8105.193.3-55.50000111
180G26.8Very low28.8Very low66 Ų66119.3 Ų119.368%0.6873%0.727SS**  cis122.1161.221.200000109.8
181N27.2Very low29.3Very low148 Ų148115.8 Ų115.879%0.79172%0.724SS**  trans74.9156.3-179-50.8-36.8000117.6
182F28.9Very low29.6Very low189 Ų189117.2 Ų117.283%0.82973%0.73SS**  trans60.4105.2171.1-53.4-66.7000116.7
183S26.3Very low30Very low119 Ų119115.7 Ų115.783%0.83273%0.733SS**  cis85.1159.546-165.90000113.7
184A30.6Very low30.3Very low73 Ų73116.5 Ų116.560%0.60374%0.739SS**  trans72101.4175.800000117.9
185N30.3Very low30.5Very low170 Ų170113.7 Ų113.791%0.90974%0.743SS**  59.6127.7122.7-54.2-17.7000121
186G30.9Very low30.6Very low67 Ų67116.2 Ų116.269%0.69174%0.741SS**  trans171.185.4132.500000118.2
187V32.2Very low30.7Very low132 Ų132116 Ų11680%0.874%0.743SS**  trans51.7109.7134.5179.90000117.3
188N31.3Very low30.8Very low121 Ų121117.6 Ų117.665%0.64774%0.741SS**  61154.585.5-87.1-25.2000114.9
189Y32.5Very low30.7Very low184 Ų184118.1 Ų118.172%0.72274%0.735SS**  cis-146.9175.98.6-104.8-46.8000106.8
190N35.4Very low30.6Very low126 Ų126121.7 Ų121.767%0.67474%0.736SS**  cis-158.3-166.85.3-128.7-36.4000106.3
191S36.4Very low30.6Very low98 Ų98123.2 Ų123.269%0.68574%0.742SS**  cis-171.7171.5-10.5-115.20000104.3
192A34.6Very low30.6Very low93 Ų93119.6 Ų119.677%0.76974%0.74SS**  cis-166.7173.6-23.700000104.6
193A35.1Very low30.5Very low85 Ų85116.9 Ų116.970%0.70274%0.744SS**  cis-148.5144.74.700000106
194S32.6Very low30.6Very low118 Ų118114.3 Ų114.383%0.82574%0.736SS**  cis92.8135.932.778.50000115
195G33.2Very low30.5Very low63 Ų63117 Ų11765%0.64975%0.745SS**  trans129.693-169.900000109.4
196E29.5Very low30.4Very low190 Ų190115.1 Ų115.189%0.88874%0.74SS**  cis66.6145.747.9-46.2-173144.300112.2
197A28.1Very low30.3Very low68 Ų68115.1 Ų115.156%0.56274%0.74SS**  cis-164.91656.600000111.7
198H29.1Very low30.1Very low177 Ų177115.6 Ų115.682%0.81974%0.738SS**  trans60.2159.8140.9-66.5-42.8000120
199S26.1Very low29.9Very low76 Ų76115.9 Ų115.953%0.53174%0.738SS.*  cis-168176.7-9.4-110.20000111
200F26.3Very low29.9Very low193 Ų193112.9 Ų112.985%0.84674%0.739SS**  trans56.6115.6158-62.5-57.7000118.1
201A26.4Very low30Very low98 Ų98111.6 Ų111.681%0.8174%0.738SS**  87.2148.462.800000114.5
202G27.6Very low29.7Very low72 Ų72114.3 Ų114.374%0.74274%0.744SS**  trans109104.6-165.400000109.6
203S27.1Very low29.8Very low132 Ų132115.6 Ų115.692%0.92375%0.745SS**  cis78.8127.744.2-158.80000113.3
204G28.2Very low29.7Very low64 Ų64114.7 Ų114.766%0.6674%0.743SS**  trans135.1104.8-16700000110.4
205V27.9Very low29.6Very low131 Ų131117.3 Ų117.379%0.79474%0.742SS**  cis66.311832.4-177.50000111.4
206T27.6Very low29.3Very low129 Ų129121.5 Ų121.579%0.79175%0.749SS**  cis-163.2154.5-8.418.50000109.2
207G28.4Very low29.4Very low68 Ų68116 Ų11670%0.70174%0.744SS**  trans70.5-177.3153.400000117.1
208D27.9Very low29.5Very low141 Ų141120.5 Ų120.575%0.75475%0.753SS**  cis-160.2171-11.5-131-34.5000111.9
209I28.8Very low29.4Very low127 Ų127118.5 Ų118.565%0.65175%0.748SS**  trans48.6102.2151.7-63.5160.8000116.4
210T32.5Very low29.5Very low121 Ų121120.3 Ų120.374%0.74276%0.755SS**  51.5168.566.581.50000114.9
211P37.1Very low29.6Very low100 Ų100115.3 Ų115.365%0.64975%0.75SS**  cis-132-149.7-37.824.11.2000111
212L28.9Very low29.7Very low154 Ų154115.3 Ų115.381%0.80674%0.744SS**  trans88.4150.8147.3-70.7167.9000119.4
213P38.5Very low29.8Very low121 Ų121119.9 Ų119.979%0.78675%0.751SS**  trans-146.6-155.2-131.845.4-23.5000114.1
214G31Very low30Very low66 Ų66116.6 Ų116.668%0.6874%0.738SS**  trans117.5161.9158.300000113.8
215Q30.7Very low30Very low172 Ų172120.5 Ų120.580%0.80475%0.749SS**  cis-162.5164.3-9.4-131.1-176.30.700109
216L28.3Very low30.1Very low152 Ų152118.3 Ų118.380%0.79675%0.745SS**  trans40.9109.5154.1-64.5158.9000117.4
217G30.8Very low30.2Very low75 Ų75118.6 Ų118.677%0.77375%0.746SS**  121.6-176.869.500000109.4
218H30.5Very low30.6Very low161 Ų161121.3 Ų121.375%0.74575%0.752SS**  cis-168.1148-3.4-168.3-145.4000108.6
219L27.6Very low30.8Very low136 Ų136118.2 Ų118.271%0.71275%0.753SS**  trans67.3157.8169.2-49.5175.4000117.1
220T28.2Very low30.7Very low113 Ų113122.7 Ų122.769%0.69376%0.761SS**  cis-157.5149.7-1922.30000107.1
221A27.4Very low30.5Very low88 Ų88122.5 Ų122.573%0.72776%0.755SS**  48.2140.483.800000115.1
222S28.6Very low30.1Very low98 Ų98124.4 Ų124.469%0.68576%0.756SS**  cis-168161.514.2540000114.9
223N29.3Very low30.1Very low169 Ų169122.6 Ų122.690%0.90475%0.747SS**  trans48.6139.1141.4-60.6-3.2000124.8
224G32.3Very low29.6Very low63 Ų63122.9 Ų122.965%0.64974%0.737SS**  trans148.2107.5152.300000113.6
225T28.8Very low29.5Very low145 Ų145125.5 Ų125.589%0.8973%0.732SS**  60.5131.673.564.80000115.1
226A28.3Very low29.4Very low85 Ų85121.6 Ų121.670%0.70272%0.724SS**  cis-162.7151.4-11.500000108.6
227V30Very low29.3Very low135 Ų135118.9 Ų118.982%0.81871%0.707SS**  55.7137.894.9-1750000115.2
228P37.4Very low29.1Very low126 Ų126120.6 Ų120.682%0.81870%0.695SS**  cis-135.6-171.8-16.940.7-22.6000115.7
229G32.6Very low29Very low75 Ų75119.4 Ų119.477%0.77369%0.694SS**  trans139108.5158.600000113.4
230R26.9Very low29.1Very low221 Ų221117.6 Ų117.683%0.83470%0.699SS**  cis107.5127.918.6-161-152.3171.1179.9-5.8112.1
231L27.7Very low29.1Very low117 Ų117119.7 Ų119.761%0.61371%0.705SS**  trans83.1138.5173.9-48.3177.6000115.1
232E29.4Very low29.1Very low141 Ų141124.1 Ų124.166%0.65971%0.713SS**  cis-162154.3-5.9-123.1171.4135.400112.8
233N27.2Very low29.2Very low115 Ų115123.8 Ų123.862%0.61572%0.717SS**  trans47.2149.4142.1-66.8-14.9000122
234Q28.2Very low29.5Very low127 Ų127120.8 Ų120.859%0.59371%0.706SS**  cis-156.9177.310.8-127.9158.135.300112.7
235H28.7Very low29.1Very low121 Ų121126.9 Ų126.956%0.5672%0.715SS**  trans-34.2148.4179.5-57.8-77.8000117.1
236S28.5Very low29.2Very low91 Ų91127 Ų12764%0.63671%0.71SS**  -170.5-177.457-67.30000111.2
237Q26.8Very low29.2Very low95 Ų95129.7 Ų129.744%0.44471%0.712SS.*  -172160.2-58.7-126.5170.1-3.300106.9V1021Q237-V1021 HydrophobicContact CB-CG1 3.96Å; Q237-V1021 HydrophobicContact CG-CG1 3.55Å; Q237-V1021 VanDerWaalsContact OE1-N 3.13Å
238E27.7Very low28.9Very low110 Ų110129.2 Ų129.251%0.51470%0.704SS.*  trans66.7150.6176.6-58.6-163.3-164.400117.2V1021 S1022E238-V1021 HydrophobicContact CG-CG1 3.56Å; E238-V1021 WeakPolarHBondContact OE1-CA 3.37Å; E238-S1022 PolarHBondContact OE1-N 2.97Å
239N27.5Very low28.4Very low137 Ų137128.1 Ų128.173%0.73370%0.7SS**  cis-158.5121.4-19-113.3-33000109.8
240A28.9Very low28Very low98 Ų98126.6 Ų126.681%0.8167%0.674SS**  trans-169.885.917000000113.7
241N28.8Very low28.1Very low156 Ų156122.3 Ų122.383%0.83466%0.658SS**  trans-103.1119.9168.6-86.8-10.7000111.8
242M27.8Very low28Very low181 Ų181123.8 Ų123.889%0.89266%0.661SS**  45.9132.4124-65.7-170170.100121.9
243A29.7Very low28.1Very low92 Ų92120.8 Ų120.876%0.7665%0.654SS**  trans-82-171.4160.300000110
244P36.1Very low28Very low106 Ų106122.7 Ų122.769%0.68865%0.653SS**  cis-148.3-168.423.946.1-24.6000117.7
245F25Very low28.2Very low191 Ų191123.2 Ų123.284%0.83866%0.655SS**  trans41.8111.2154.6-71.5-68.1000121.9
246D31Very low28.2Very low146 Ų146122.5 Ų122.578%0.78166%0.655SS**  -169.2137.7122.9-96.6-24.2000107.5
247L27.3Very low28.2Very low142 Ų142124.1 Ų124.174%0.74366%0.657SS**  76.4111.456-71.9179000115.8
248L24.7Very low28.4Very low125 Ų125125.4 Ų125.465%0.65468%0.677SS**  trans31.686.9148.3-74.2161.4000119.8
249S26.6Very low28.5Very low104 Ų104127 Ų12773%0.72768%0.684SS**  trans-162.4110.2141.8-83.90000108.5
250I24.7Very low28.5Very low42 Ų42129.3 Ų129.322%0.21569%0.69CS.*  67.948.157.8-44.6173.5000113.7W314 H890 K891I250-W314 HydrophobicContact CB-CH2 4.46Å; I250-W314 HydrophobicContact CB-CZ3 4.24Å; I250-W314 HydrophobicContact CG2-CH2 3.84Å; I250-W314 HydrophobicContact CG2-CZ3 4.02Å; I250-W314 WeakPolarHBondContact O-CZ3 3.37Å; I250-H890 HydrophobicContact CD1-CB 4Å; I250-H890 HydrophobicContact CG1-CB 3.78Å; I250-H890 HydrophobicContact CG2-CB 4.25Å; I250-H890 WeakPolarHBondContact CG2-O 3.44Å; I250-K891 HydrophobicContact CG2-CD 3.74Å; I250-K891 VanDerWaalsContact CG2-CE 3.47Å; I250-K891 HydrophobicContact CG2-CG 3.96Å; I250-K891 PolarHBondContact O-NZ 3.44Å
251W27.5Very low28.3Very low132 Ų132129 Ų12950%0.568%0.677SS.*  trans-152.5111.6150.3-131.87.4000114.2P253 W314W251-P253 HydrophobicContact CD2-CB 4.41Å; W251-P253 HydrophobicContact CD2-CG 4.34Å; W251-P253 HydrophobicContact CE3-CG 4.29Å; W251-W314 HydrophobicContact CD2-CB 4.17Å; W251-W314 HydrophobicContact CD2-CG 4.32Å; W251-W314 AromaticContact CE2-CG 3.79Å; W251-W314 HydrophobicContact CE3-CB 4.29Å; W251-W314 HydrophobicContact CH2-CB 3.78Å; W251-W314 HydrophobicContact CZ2-CB 3.62Å; W251-W314 AromaticContact CZ2-CG 3.94Å; W251-W314 HydrophobicContact CZ2-CG 3.94Å; W251-W314 HydrophobicContact CZ3-CB 4.11Å; W251-W314 AromaticContact NE1-CG 3.96Å
252E26.3Very low28.3Very low147 Ų147133.3 Ų133.369%0.68768%0.682SS**PPolyproline II helix-75.6121.9125.2-70.3-179.9141.100106.7R254 M889E252-R254 PolarHBondContact O-N 3.06Å; E252-M889 HydrophobicContact CG-CE 3.74Å
253P30.4Very low28.3Very low79 Ų79130 Ų13051%0.51367%0.667SS.*PPolyproline II helixtrans-59.1133164.2-17.831.1000108.4W251 Q255W251-P253 HydrophobicContact CD2-CB 4.41Å; W251-P253 HydrophobicContact CD2-CG 4.34Å; W251-P253 HydrophobicContact CE3-CG 4.29Å; P253-Q255 PolarHBondContact O-N 3.28Å
254R25.4Very low28.3Very low155 Ų155130.4 Ų130.459%0.58566%0.663SS**PPolyproline II helixtrans-63.4123164.2-76.8179.4167.2-177.9-6.3107.3E252 N256E252-R254 PolarHBondContact O-N 3.06Å; R254-N256 PolarHBondContact O-N 3.34Å
255Q32.6Very low27.8Very low138 Ų138131.7 Ų131.765%0.64566%0.664SS**  trans-68.794.2149.8-73.4-156.22.900107P253 E1104P253-Q255 PolarHBondContact O-N 3.28Å; Q255-E1104 PolarHBondContact NE2-OE1 2.97Å
256N28.5Very low28.3Very low105 Ų105126.2 Ų126.256%0.56165%0.647SS**  trans-76.1157.6165.6-109.334.9000109R254R254-N256 PolarHBondContact O-N 3.34Å
257N29.4Very low28.2Very low125 Ų125124.3 Ų124.367%0.66865%0.645SS**  trans69.4116.3177.9-45.2-12.3000112
258S30.4Very low28.2Very low123 Ų123125.1 Ų125.186%0.8665%0.645SS**  cis-86.4142.627.3-49.80000116.4
259H29Very low28.5Very low143 Ų143124.6 Ų124.666%0.66264%0.643SS**  trans-71.8132.2165-77-134.5000110
260H28.8Very low28.8Very low185 Ų185125.6 Ų125.686%0.85665%0.647SS**  trans-136.5131144.1-110.3-77.8000109.7
261V25.5Very low29Very low91 Ų91128.8 Ų128.855%0.55267%0.669SS**  trans-93.4128.2-172.3176.30000109.8L263V261-L263 HydrophobicContact CG1-CB 3.96Å; V261-L263 HydrophobicContact CG1-CD1 4.01Å; V261-L263 HydrophobicContact CG1-CG 3.59Å
262W26.9Very low29Very low247 Ų247128.4 Ų128.494%0.93668%0.681SS**  trans-121.896.1140.8-72.171.3000103.2
263L28.6Very low29.1Very low111 Ų111125.2 Ų125.258%0.58168%0.679SS**  43.9129.271.7-88.6164.9000111.4V261V261-L263 HydrophobicContact CG1-CB 3.96Å; V261-L263 HydrophobicContact CG1-CD1 4.01Å; V261-L263 HydrophobicContact CG1-CG 3.59Å
264P29.7Very low28.9Very low102 Ų102127.9 Ų127.966%0.66269%0.689SS**SBendtrans-61.3167.2158.233.2-35.9000108.6P266P264-P266 WeakPolarHBondContact O-CD 3.27Å; P264-P266 WeakPolarHBondContact O-CG 3.08Å
265D26.1Very low29.2Very low132 Ų132127 Ų12771%0.70670%0.702SS**  trans-52.5110.6166-175.8-31000109.2S267D265-S267 VanDerWaalsContact OD1-CB 3.29Å; D265-S267 WeakPolarHBondContact OD1-CB 3.03Å; D265-S267 PolarHBondContact OD1-N 2.88Å; D265-S267 VanDerWaalsContact OD1-N 3.12Å; D265-S267 PolarHBondContact OD1-OG 3.49Å
266P35.4Very low29Very low76 Ų76125.7 Ų125.749%0.49470%0.703SS.*  trans-106.561.2-178.233.7-14.9000107.9P264 Q268P264-P266 WeakPolarHBondContact O-CD 3.27Å; P264-P266 WeakPolarHBondContact O-CG 3.08Å; P266-Q268 CarbonylContact C-O 3.46Å; P266-Q268 CarbonylContact O-C 3.54Å; P266-Q268 PolarHBondContact O-N 3.43Å
267S28.6Very low29.1Very low106 Ų106128.1 Ų128.174%0.74172%0.722SS**  trans-7525.8169.835.20000113.2D265D265-S267 VanDerWaalsContact OD1-CB 3.29Å; D265-S267 WeakPolarHBondContact OD1-CB 3.03Å; D265-S267 PolarHBondContact OD1-N 2.88Å; D265-S267 VanDerWaalsContact OD1-N 3.12Å; D265-S267 PolarHBondContact OD1-OG 3.49Å
268Q28Very low29.1Very low160 Ų160125 Ų12575%0.74872%0.719SS**  trans-135.5120.9152.3-65.9-175.7-6.100103.3P266P266-Q268 CarbonylContact C-O 3.46Å; P266-Q268 CarbonylContact O-C 3.54Å; P266-Q268 PolarHBondContact O-N 3.43Å
269D30.4Very low29.1Very low113 Ų113126.5 Ų126.560%0.60472%0.717SS**  cis-142.9164.829.7-83.5-44.1000111.1V271D269-V271 WeakPolarHBondContact OD1-CG2 3.3Å; D269-V271 PolarHBondContact OD1-N 2.75Å
270P33.5Very low29.2Very low125 Ų125125.8 Ų125.881%0.81273%0.727SS**  -100.3124.861.2-1633.7000116.3T272P270-T272 PolarHBondContact O-N 3.15Å; P270-T272 VanDerWaalsContact O-N 3.08Å
271V28.1Very low29.3Very low110 Ų110121.2 Ų121.267%0.66772%0.721SS**  trans-55.9104.9139.9173.80000107.9D269D269-V271 WeakPolarHBondContact OD1-CG2 3.3Å; D269-V271 PolarHBondContact OD1-N 2.75Å
272T28.1Very low29.8Very low123 Ų123122.8 Ų122.876%0.75573%0.731SS**  -174.2138.812618.90000114.6P270P270-T272 PolarHBondContact O-N 3.15Å; P270-T272 VanDerWaalsContact O-N 3.08Å
273A27.8Very low30.3Very low80 Ų80117.7 Ų117.766%0.66173%0.727SS**  trans55.9102.1142.800000121.3
274N27.3Very low30.7Very low135 Ų135115.4 Ų115.472%0.72273%0.731SS**  52.3105.8118.2-57.7-16.8000120.4
275T29.8Very low31.1Very low137 Ų137117.1 Ų117.184%0.8473%0.734SS**  -158.890.6110.22.80000109.5
276T29.5Very low31.5Very low111 Ų111117.2 Ų117.268%0.68174%0.735SS**  32.490.878.639.50000116
277V29.9Very low31.6Very low156 Ų156119.7 Ų119.795%0.94575%0.752SS**  trans-11694.6145.4-179.40000106.8
278G29.6Very low32.3Very low59 Ų59120.3 Ų120.361%0.60875%0.754SS**SBendtrans175.926.8-167.200000117.5
279N31Very low32.6Very low154 Ų154121.9 Ų121.982%0.82476%0.761SS**  trans70.295.3166.2-50.7-26000118.9
280C29.8Very low32.7Very low128 Ų128124.1 Ų124.187%0.86577%0.768SS**  153123.3110.2-82.10000116.9
281A32.4Very low32.8Very low89 Ų89125.1 Ų125.174%0.73676%0.762SS**  trans79.3100.2145.100000125.2
282T34.8Very low33.1Very low124 Ų124126 Ų12676%0.76176%0.763SS**  70.6106.8126.256.30000126.6
283T37.1Very low33.4Very low141 Ų141125.7 Ų125.787%0.86576%0.757SS**  trans62.6156.5138.449.50000123.3
284G37.8Very low33.8Very low63 Ų63129.7 Ų129.765%0.64976%0.761SS**  cis157.5151.1-11.300000117.3
285N37.2Very low34Very low137 Ų137129.9 Ų129.973%0.73376%0.762SS**  trans73.4155.4154.2-51.389.2000121.3
286D35.8Very low34.3Very low134 Ų134131.2 Ų131.272%0.71776%0.759SS**  cis-168151.1-23.5-90.4-17.6000115.3
287C36.2Very low34.2Very low128 Ų128133.9 Ų133.987%0.86577%0.768SS**  trans53.2152.5152-67.90000129.3
288P43.2Very low34.2Very low120 Ų120130.1 Ų130.178%0.77976%0.761SS**  trans-134.1-179.4-174.946.5-29.8000118.7
289E34.8Very low34.1Very low193 Ų193136.2 Ų136.290%0.90278%0.778SS**  trans-178.1158.5164.8-103.8164.1-153.100110.6
290E33.9Very low34.1Very low159 Ų159132.3 Ų132.374%0.74377%0.774SS**  cis-148.1-95.6-23.3-140-150.3163.200116.7
291Q34.1Very low34.2Very low146 Ų146133.6 Ų133.668%0.68277%0.771SS**  trans-131.2160.4-157.9-59.6178.116.500120
292D35.3Very low34.1Very low130 Ų130135.7 Ų135.770%0.69577%0.77SS**  122.9122.9119.4-134.928.5000124.7
293N33.9Very low34Very low115 Ų115137.1 Ų137.162%0.61577%0.773SS**  trans72.4141.2139.1-98.3-48.3000129.8
294H36.5Very low33.7Very low165 Ų165134 Ų13476%0.76477%0.769SS**  trans102.4162144.6-67.9-5.6000124.7
295N32.3Very low33.4Very low139 Ų139135.9 Ų135.974%0.74378%0.779SS**  trans-117.7157.5-158.3-42-80.9000115.4
296H34.8Very low33.1Very low165 Ų165138 Ų13876%0.76478%0.784SS**  163.4135.8120.4-96.9-79.2000117.2
297L27.7Very low33Very low166 Ų166138.5 Ų138.587%0.86979%0.787SS**  trans20.9134143.7-56.2170.8000122.8
298G30.6Very low32.7Very low77 Ų77139.7 Ų139.779%0.79478%0.78SS**  trans175.291.8158.300000120.2
299L27.7Very low32.2Very low187 Ų187140.6 Ų140.698%0.97978%0.783SS**  trans-8.8140.8158.3-56164.9000121.5
300G31.2Very low31.9Very low72 Ų72138.1 Ų138.174%0.74278%0.775SS**  trans153.892.9142.900000122.8
301I31.5Very low31.9Very low156 Ų156135.7 Ų135.780%0.877%0.773SS**  58.8115.1129.8-63.4172000122.1
302D30.7Very low31.5Very low133 Ų133137.7 Ų137.771%0.71177%0.774SS**  trans67.3130.7139.1-67.712.6000127.1
303N32.3Very low31.3Very low153 Ų153136.8 Ų136.882%0.81877%0.77SS**  trans73.6103.5139.5-65.5-33.1000123.4
304G30.2Very low31Very low77 Ų77136.3 Ų136.379%0.79476%0.759SS**  126.3139.3107.300000121
305A32.2Very low30.7Very low102 Ų102135 Ų13584%0.84376%0.758SS**  trans73.487.115600000121
306E31Very low30.5Very low181 Ų181134 Ų13485%0.84676%0.757SS**  trans5134.3134.2-55.3172.3150.100120
307N33.4Very low30.1Very low145 Ų145131.2 Ų131.278%0.77576%0.762SS**  -164.5140.1116.9-110.3-15.3000117
308E30Very low30.1Very low152 Ų152129.8 Ų129.871%0.7177%0.765SS**  trans42.382.9149.7-57.1-166133.300121.7
309V31.7Very low29.9Very low139 Ų139129.4 Ų129.484%0.84276%0.761SS**  trans-104106.5136.4175.80000107.7P311V309-P311 WeakPolarHBondContact O-CD 3.48Å
310L28.5Very low29.9Very low141 Ų141129 Ų12974%0.73876%0.759SS**  trans-66.6112-170.6-75.4170.8000113.9
311P33.7Very low29.8Very low109 Ų109129.8 Ų129.871%0.70876%0.758SS**  trans-86.6153.7167.61.920.6000109.8V309 N313V309-P311 WeakPolarHBondContact O-CD 3.48Å; P311-N313 PolarHBondContact O-N 3.18Å
312W26.8Very low29.8Very low188 Ų188129.6 Ų129.671%0.71276%0.759SS**  trans-74.773.9174.3-83.241.3000111.9
313N30.9Very low29.8Very low111 Ų111130 Ų13059%0.59477%0.766SS**  trans-66.3145.2170.6-170.2-0.5000110.6P311 D315 T316P311-N313 PolarHBondContact O-N 3.18Å; N313-D315 PolarHBondContact OD1-N 3.27Å; N313-D315 VanDerWaalsContact OD1-N 3.12Å; N313-T316 PolarHBondContact ND2-OG1 2.74Å
314W27.4Very low29.7Very low104 Ų104126.9 Ų126.939%0.39475%0.753SS.*SBendtrans-117.35.6-179.4-108.873.5000115.8I250 W251 K891I250-W314 HydrophobicContact CB-CH2 4.46Å; I250-W314 HydrophobicContact CB-CZ3 4.24Å; I250-W314 HydrophobicContact CG2-CH2 3.84Å; I250-W314 HydrophobicContact CG2-CZ3 4.02Å; I250-W314 WeakPolarHBondContact O-CZ3 3.37Å; W251-W314 HydrophobicContact CD2-CB 4.17Å; W251-W314 HydrophobicContact CD2-CG 4.32Å; W251-W314 AromaticContact CE2-CG 3.79Å; W251-W314 HydrophobicContact CE3-CB 4.29Å; W251-W314 HydrophobicContact CH2-CB 3.78Å; W251-W314 HydrophobicContact CZ2-CB 3.62Å; W251-W314 AromaticContact CZ2-CG 3.94Å; W251-W314 HydrophobicContact CZ2-CG 3.94Å; W251-W314 HydrophobicContact CZ3-CB 4.11Å; W251-W314 AromaticContact NE1-CG 3.96Å; W314-K891 VanDerWaalsContact CE2-CE 3.41Å
315D30.1Very low29.5Very low137 Ų137129 Ų12973%0.73376%0.756SS**SBendtrans-122.262.3174.7-84.1-56.3000112.4N313N313-D315 PolarHBondContact OD1-N 3.27Å; N313-D315 VanDerWaalsContact OD1-N 3.12Å
316T29.2Very low29.3Very low120 Ų120134.4 Ų134.474%0.73675%0.754SS**  trans-151.154.6166.1-29.70000114N313N313-T316 PolarHBondContact ND2-OG1 2.74Å
317A25.7Very low29.1Very low105 Ų105136.6 Ų136.687%0.86876%0.755SS**  trans-135.710.6169.300000114.8
318C26.7Very low28.9Very low137 Ų137135.9 Ų135.993%0.92675%0.751SS**  trans-86.8114159.4-68.30000108
319G27.6Very low28.7Very low69 Ų69134.8 Ų134.871%0.71175%0.749SS**  trans173.12.9-178.100000120.5
320L27.1Very low28.6Very low179 Ų179136.8 Ų136.894%0.93775%0.747SS**SBendtrans-142.6117.5176.8-77.9171.3000110.8
321A28.7Very low28.7Very low88 Ų88135.1 Ų135.173%0.72774%0.744SS**  cis-151155.4-15.500000108.8
322N31.6Very low28.3Very low151 Ų151137.4 Ų137.481%0.80775%0.746SS**  trans-69133.6178.4-78-27.3000112.3
323T30.2Very low28.1Very low142 Ų142131.1 Ų131.187%0.87173%0.73SS**  trans-99.5108.9142.549.10000107.8
324T30.8Very low27.8Very low87 Ų87131.2 Ų131.253%0.53473%0.725SS.*  trans-67.9171.5-167.1-29.90000113W326T324-W326 PolarHBondContact O-NE1 3.38Å; T324-W326 VanDerWaalsContact O-NE1 3.13Å
325S27.2Very low27.7Very low122 Ų122130.6 Ų130.685%0.85373%0.73SS**  trans-133.7117.8146.1-1780000110.4
326W26.2Very low27.7Very low215 Ų215128.8 Ų128.881%0.81473%0.728SS**  cis-150.518.1-40.8-124.1107.1000109.6T324T324-W326 PolarHBondContact O-NE1 3.38Å; T324-W326 VanDerWaalsContact O-NE1 3.13Å
327R28.7Very low27.5Very low227 Ų227131.4 Ų131.486%0.85773%0.732SS**  trans-129.8-20.2-147.6-140-179.5-161.31219.4117
328D28.9Very low27.6Very low131 Ų131131 Ų13170%0.70172%0.72SS**  trans-128112.5-163.5-74.7-70.7000112.6
329L25.6Very low27.7Very low129 Ų129131 Ų13168%0.67571%0.71SS**  trans56.3112.4143.3-35.7175.6000116.7
330F29Very low27.8Very low181 Ų181134.1 Ų134.179%0.79471%0.71SS**  cis-170.5-179.21.1-90.5-53.2000106.4
331P30.7Very low27.9Very low105 Ų105132.8 Ų132.868%0.68270%0.703SS**  cis-124.9136.7-5.933-15.2000114.4C333P331-C333 HydrophobicContact CB-CB 4.33Å
332E25.9Very low28.1Very low158 Ų158133.6 Ų133.674%0.73870%0.701SS**  trans-84.9148.3134.1-161.3179.7-13600107.5H928E332-H928 IonicContact OE1-CD2 2.74Å; E332-H928 IonicContact OE1-NE2 3.69Å
333C22.4Very low27.8Very low56 Ų56135.3 Ų135.338%0.37870%0.697SS.*  trans-163.8163.1-171-158.60000104.8P331 V926 N927P331-C333 HydrophobicContact CB-CB 4.33Å; C333-V926 HydrophobicContact CB-CB 4.29Å; C333-V926 HydrophobicContact CB-CG1 4.2Å; C333-V926 HydrophobicContact CB-CG2 3.62Å; C333-V926 VanDerWaalsContact O-CB 3.3Å; C333-V926 WeakPolarHBondContact O-CB 3.46Å; C333-N927 PolarHBondContact O-OD1 3.22Å; C333-N927 VanDerWaalsContact O-OD1 3.07Å
334K25Very low27.8Very low113 Ų113135.5 Ų135.549%0.49169%0.693SS.*  cis-86.8-108.726-158.7-158.5-10778.50111.7G925 V926 N927K334-G925 PolarHBondContact NZ-O 3.25Å; K334-V926 HydrophobicContact CB-CB 4.31Å; K334-V926 HydrophobicContact CB-CG2 3.63Å; K334-V926 HydrophobicContact CG-CG2 4.07Å; K334-V926 PolarHBondContact NZ-O 2.97Å; K334-N927 HydrophobicContact CB-CB 3.79Å; K334-N927 PolarHBondContact N-OD1 3.17Å
335D25.6Very low27.7Very low91 Ų91137.4 Ų137.449%0.48770%0.699SS.*  cis-150.5161.9-15.1-145.1-33.2000109.8N927D335-N927 VanDerWaalsContact CB-ND2 3.33Å; D335-N927 WeakPolarHBondContact CB-ND2 3.1Å; D335-N927 WeakPolarHBondContact OD2-CB 3.34Å; D335-N927 VanDerWaalsContact OD2-CG 3.32Å; D335-N927 PolarHBondContact OD2-ND2 3.26Å
336S28.6Very low27.7Very low99 Ų99135.9 Ų135.969%0.69269%0.689SS**  trans59.6121.1-166.335.10000113.9
337E25.9Very low27.8Very low175 Ų175133.3 Ų133.382%0.81869%0.686SS**  63139.265.7-73.4-73.9105.300112.6
338P28Very low27.8Very low96 Ų96129.3 Ų129.362%0.62368%0.682SS**  -121.7-139.6-125.531-12000112.9
339I27.5Very low27.9Very low138 Ų138126.5 Ų126.571%0.70868%0.684SS**  trans104.8136.6155-60.2156000118
340N30.5Very low28.2Very low134 Ų134127 Ų12772%0.71769%0.686SS**  trans72.2115.6170.6-64.2-20.1000118.1
341L28.8Very low28.3Very low151 Ų151124.4 Ų124.479%0.79168%0.68SS**  cis92.7147.949.3-81.5179.5000112.8
342P32.5Very low28.5Very low105 Ų105127.3 Ų127.368%0.68268%0.684SS**  cis-120.4175.1-19.644.6-31.3000110.3
343Y25.5Very low29Very low187 Ų187124.5 Ų124.573%0.73368%0.682SS**  cis59.913144.6-115.7-83.8000116.9N345Y343-N345 HydrophobicContact CD1-CB 4.2Å; Y343-N345 HydrophobicContact CE1-CB 4.22Å
344N31.3Very low29.6Very low146 Ų146129 Ų12978%0.78170%0.702SS**  trans125100.7175.2-71.1-2.2000110.5
345N28.2Very low30.2Very low126 Ų126127.7 Ų127.767%0.67471%0.713SS**  cis71.1145.619.2-147.131.1000114.6Y343Y343-N345 HydrophobicContact CD1-CB 4.2Å; Y343-N345 HydrophobicContact CE1-CB 4.22Å
346S27.7Very low30.9Very low91 Ų91128.4 Ų128.464%0.63672%0.722SS**  trans71.5154.8-170.683.60000115
347E28.2Very low31.2Very low160 Ų160131.3 Ų131.375%0.74873%0.725SS**  cis-154.8143.77.6-150.8142.4-122.400115.3
348N28.2Very low31.4Very low143 Ų143131.7 Ų131.777%0.76572%0.724SS**  trans19.5143.3150.5-56.1-30.6000124.6
349G32.1Very low31.7Very low73 Ų73130.2 Ų130.275%0.75373%0.726SS**  trans145.588158.900000113.4
350I30Very low31.9Very low139 Ų139128 Ų12871%0.71373%0.729SS**  77.6105.858.3-56.7179.6000114.5
351N31.5Very low31.9Very low126 Ų126130.6 Ų130.667%0.67474%0.737SS**  trans64.8118.2153-61.5-2.7000122.9
352H36Very low31.9Very low166 Ų166127.3 Ų127.377%0.76973%0.731SS**  151.7136.398.4-92.7-50.6000115.3
353S36.3Very low32.2Very low99 Ų99127.7 Ų127.769%0.69273%0.734SS**  trans59.4147.6152.252.60000120.3
354N34.8Very low32.3Very low150 Ų150124.1 Ų124.180%0.80274%0.736SS**  cis-156.5128.9-9.8-94.8-11.3000105.8
355A37.6Very low32.1Very low86 Ų86120.5 Ų120.571%0.71173%0.733SS**  72.1146.484.700000115.4
356P41Very low32.1Very low106 Ų106121.6 Ų121.669%0.68874%0.738SS**  cis-141.8-170-25.341.4-23000114.9
357E33Very low32Very low160 Ų160128.5 Ų128.575%0.74875%0.751SS**  trans70.3146156.1-75.8169.8-163.500119.4
358F31.8Very low31.7Very low183 Ų183126 Ų12680%0.80375%0.751SS**  cis-148.8146.93.6-129-62.8000111
359G33.9Very low31.6Very low65 Ų65124 Ų12467%0.6775%0.748SS**  trans84.1105169.500000115.3
360A31.4Very low31.2Very low93 Ų93125.7 Ų125.777%0.76975%0.748SS**  cis69.41313900000114.3
361H30.9Very low31Very low188 Ų188126 Ų12687%0.8775%0.75SS**  cis-160.8163.9-15.2-125.3-84000108.6
362A28.4Very low30.8Very low81 Ų81127.5 Ų127.567%0.66975%0.753SS**  trans-92.1-174.5166.500000110.6
363P38.4Very low30.4Very low114 Ų114125.6 Ų125.674%0.7475%0.748SS**  cis-125.9-142.5-18.934.9-13.1000110.3
364S28.5Very low29.9Very low111 Ų111127.1 Ų127.178%0.77675%0.753SS**  trans85.3118.2154.2-49.40000120.6
365G26.7Very low29.5Very low71 Ų71125.9 Ų125.973%0.73275%0.751SS**  92.9154.3114.800000121.2
366L27.3Very low29Very low149 Ų149127 Ų12778%0.7875%0.753SS**  trans70.3121149.5-55171.8000120.5
367W25.4Very low28.5Very low235 Ų235126.4 Ų126.489%0.8975%0.752SS**  trans70.7119.3138.7-63.814.6000116.5
368S23.1Very low28.4Very low109 Ų109127.4 Ų127.476%0.76276%0.759SS**  83.3157.175.4-161.30000113.3
369S24.8Very low28.3Very low101 Ų101122.8 Ų122.871%0.70675%0.749SS**  trans77.9111.1171.8-50.80000118.7
370S24.7Very low28.1Very low107 Ų107126.5 Ų126.575%0.74875%0.752SS**  54.9125.1122.6-52.40000122.2
371I25.1Very low28Very low146 Ų146127.6 Ų127.675%0.74975%0.754SS**  18.2116.4116.6-54.3169.4000115.5
372H27.9Very low28.1Very low158 Ų158122.4 Ų122.473%0.73174%0.744SS**  -171.9148.7120.8-105.1-67000113.6
373N27.6Very low28.3Very low126 Ų126123.6 Ų123.667%0.67475%0.747SS**  trans51.5125.1148.6-60.70.4000119.3
374V25.8Very low28Very low131 Ų131123.6 Ų123.679%0.79475%0.75SS**  cis59.289.442.3-167.70000113.7
375T27Very low28.4Very low124 Ų124123.8 Ų123.876%0.76175%0.748SS**  trans-163123.9140.421.60000111.6
376S26.7Very low28.8Very low109 Ų109127.9 Ų127.976%0.76275%0.753SS**  trans64.2156.1140.8-43.40000118.7
377S30Very low28.8Very low94 Ų94125.3 Ų125.366%0.65775%0.747SS**  cis-155.6149.47.5-17.10000110.7
378M30.4Very low29.1Very low181 Ų181120.3 Ų120.389%0.89274%0.743SS**  trans66.3148146.2-64.3176.3179.600118.3
379S30Very low29.4Very low85 Ų85123.2 Ų123.259%0.59474%0.744SS**  cis-164.7141.9-9.7-105.50000113
380I30.2Very low29.7Very low144 Ų144123.3 Ų123.374%0.73874%0.743SS**  trans63.4105134.2-56.8167.5000119.6
381S29.5Very low29.9Very low115 Ų115122.4 Ų122.480%0.80473%0.733SS**  trans72.8161.6142.286.20000119
382A32.3Very low30.2Very low80 Ų80123.3 Ų123.366%0.66174%0.737SS**  cis-153.9171.72.200000113.1
383S33.9Very low30.2Very low106 Ų106122.7 Ų122.774%0.74174%0.738SS**  trans59.498153.846.40000120.7
384S32Very low30.1Very low113 Ų113125.7 Ų125.779%0.7975%0.746SS**  20152.7100.9-43.80000119.2
385P36.8Very low30.2Very low115 Ų115122.8 Ų122.875%0.74774%0.742SS**  cis-139.5-162.228.344.8-24.6000113.3
386L33.6Very low30Very low157 Ų157121.9 Ų121.982%0.82274%0.741SS**  cis-151.4164.86.2-165.956.6000111.7
387S27.6Very low29.9Very low95 Ų95121.2 Ų121.266%0.66474%0.743SS**  trans-31152.9156.4-135.60000114.9
388T32.9Very low29.8Very low130 Ų130125.9 Ų125.980%0.79876%0.756SS**  cis-149.8136.245.450.90000115.8
389Q28.6Very low29.5Very low171 Ų171120.5 Ų120.580%0.79975%0.747SS**  trans-72.8173.4150.9-145.4-164.46900109
390P31.2Very low29.2Very low103 Ų103123.9 Ų123.967%0.66976%0.758SS**  -163.1-172.979.445.2-23.4000117.4
391T30.1Very low28.9Very low88 Ų88122.6 Ų122.654%0.5476%0.756SS.*  trans76.6110.7137.4-65.90000120.5L393T391-L393 HydrophobicContact CG2-CB 3.5Å; T391-L393 HydrophobicContact CG2-CD1 3.74Å; T391-L393 HydrophobicContact CG2-CG 4.17Å
392I30.9Very low28.7Very low164 Ų164121.5 Ų121.584%0.84175%0.749SS**  trans-82.6130.3130.1-66.3171.7000106.8
393L26.5Very low28.5Very low145 Ų145125.6 Ų125.676%0.75975%0.754SS**  trans-126.6142.5168.8-138.874.9000111.3T391T391-L393 HydrophobicContact CG2-CB 3.5Å; T391-L393 HydrophobicContact CG2-CD1 3.74Å; T391-L393 HydrophobicContact CG2-CG 4.17Å
394F27.1Very low28.2Very low189 Ų189125 Ų12583%0.82975%0.75SS**  trans-77.2146.7162.5-98.4-115.1000111
395G26.2Very low28.1Very low70 Ų70126 Ų12672%0.72275%0.747SS**  trans179.479.7176.200000108.2
396S24Very low27.9Very low105 Ų105125.9 Ų125.973%0.73474%0.74SS**  71.6131.964.7-56.90000113.6
397A23.6Very low27.8Very low96 Ų96124.8 Ų124.879%0.79373%0.733SS**  trans68.8111.7167.500000118.8G399A397-G399 PolarHBondContact O-N 3.5Å
398M28.2Very low28Very low191 Ų191126.5 Ų126.594%0.94174%0.735SS**  -7.6116126.9-63.9-97.3-91.300114.9
399G24.5Very low27.8Very low68 Ų68124.6 Ų124.670%0.70172%0.723SS**  trans-161.575.117700000110A397A397-G399 PolarHBondContact O-N 3.5Å
400L23.6Very low27.8Very low156 Ų156122.8 Ų122.882%0.81772%0.718SS**  92.1120.985.3-81.5169000112.7
401V23.9Very low27.7Very low117 Ų117123.9 Ų123.971%0.70972%0.715SS**  trans59.3107.2142.7-175.50000118.7
402S26.3Very low27.7Very low93 Ų93125.7 Ų125.765%0.6572%0.717SS**  -172.3119.5105.9-93.20000107.2
403E26.9Very low27.7Very low166 Ų166120.3 Ų120.378%0.77669%0.694SS**  69.9130.391.9-68.9166.7130.100112.8
404S28.3Very low27.9Very low94 Ų94120.1 Ų120.166%0.65769%0.689SS**  cis-165.1156.65.445.20000111.6
405N29.2Very low28Very low134 Ų134120.2 Ų120.272%0.71768%0.684SS**  trans64.4145.4147-70.437.5000118.7
406D32.8Very low28.1Very low112 Ų112122.5 Ų122.560%0.59968%0.683SS**  cis-157.2153.25.1-117.6-19.9000112
407I31.6Very low28.2Very low134 Ų134123.4 Ų123.469%0.68768%0.679SS**  trans41.9120.8131.2-68.4169.6000116.9
408D31.8Very low28.4Very low131 Ų131126.6 Ų126.670%0.70168%0.678SS**  cis-167.8158.820.9-138.9-11.6000117.8
409T29.2Very low28.3Very low90 Ų90123 Ų12355%0.55266%0.662SS**  trans61.4108.1130.1-80.80000123.4
410L28.7Very low28.4Very low132 Ų132127.1 Ų127.169%0.69166%0.663SS**  65.1152.9117.7-49.9-172.7000119.7
411Q28.8Very low28.6Very low126 Ų126123.9 Ų123.959%0.58965%0.654SS**  cis-165.8147.7-13.8-118.4177.1-31.400111
412H30.5Very low28.6Very low126 Ų126125.4 Ų125.458%0.58366%0.658SS**  trans62.7159.3135.1-70.9-1000120.5A577H412-A577 WeakPolarHBondContact O-CB 3.47Å
413S30.2Very low28.6Very low52 Ų52125 Ų12536%0.36466%0.661SS.*  cis-172.1172.9-24.155.60000109.5
414H31.2Very low28.6Very low140 Ų140127.3 Ų127.365%0.64866%0.663SS**  trans73.9149.1139-78.3-18.4000118.4
415R28.3Very low28.4Very low192 Ų192128.7 Ų128.773%0.72566%0.663SS**  cis-174.5178.6-11.4-173.6-175.4-146.5-179.98.7106.9
416V28.5Very low28.2Very low118 Ų118128.3 Ų128.372%0.71566%0.662SS**  trans76.9137.5162.9-171.20000113.3
417L27.1Very low27.8Very low124 Ų124128.8 Ų128.865%0.64967%0.668SS**  cis169.8155.9-37.2-105.5162.6000105.6
418Q27Very low27.5Very low163 Ų163127 Ų12776%0.76266%0.664SS**  trans65.3165.4154.3-72.7163.3-69.500115.9
419D26.3Very low27.3Very low116 Ų116128 Ų12862%0.6267%0.666SS**  cis-171.3172-31.3-174.421.6000106.1
420Q27.1Very low27.5Very low154 Ų154130.5 Ų130.572%0.7268%0.684SS**  trans64.5120.2167.8-69.7148.256.700115.4
421S26.3Very low27.5Very low88 Ų88132.6 Ų132.662%0.61568%0.683SS**  85.6133.757.587.10000114.5
422D25.3Very low27.4Very low148 Ų148131.1 Ų131.179%0.79169%0.686SS**  trans71.6142.8160.1-51.9-52.5000121.9
423A25.9Very low27.3Very low86 Ų86132.4 Ų132.471%0.71170%0.697SS**  trans72.9127.814400000122.3
424Y26.2Very low27.1Very low213 Ų213133.2 Ų133.284%0.83571%0.707SS**  trans69.2119.7134.7-89.9-110000121.8
425N25.2Very low26.9Very low123 Ų123131.7 Ų131.766%0.65871%0.712SS**  trans76.4151.7133-87.636.2000123.4
426D24Very low26.8Very low127 Ų127128.3 Ų128.368%0.67971%0.708SS**  trans64109.5150.3-71.2-57.5000121.9
427V25.6Very low26.7Very low122 Ų122132 Ų13274%0.73972%0.715SS**  36113.6117.3-174.40000117.7
428T25Very low26.7Very low97 Ų97130.2 Ų130.260%0.59572%0.718SS**  -172.3146.2114.7-77.90000111.8R431T428-R431 HydrophobicContact CG2-CB 4.3Å
429M26.4Very low27.1Very low151 Ų151130.1 Ų130.174%0.74472%0.717SS**  trans-68.1168176.7-61.7170.8167.300113.9R431M429-R431 HydrophobicContact CB-CB 4.21Å; M429-R431 PolarHBondContact O-N 2.85Å
430P35.2Very low27.6Very low142 Ų142130.4 Ų130.492%0.92273%0.725SS**SBendtrans-59.786.6139.230.3-33.4000108.8
431R27.6Very low27.8Very low177 Ų177129.2 Ų129.267%0.66872%0.724SS**  trans-92.1165.3-170.1-164.9176.7-174.8161.2-0.5110.4T428 M429T428-R431 HydrophobicContact CG2-CB 4.3Å; M429-R431 HydrophobicContact CB-CB 4.21Å; M429-R431 PolarHBondContact O-N 2.85Å
432S27.4Very low27.9Very low95 Ų95129.5 Ų129.566%0.66473%0.726SS**  trans76.8139163.8910000114.7
433N26.7Very low28.1Very low152 Ų152128.3 Ų128.381%0.81372%0.724SS**  cis-144.71585.4-80.3-62.5000110.9
434A27.6Very low28.2Very low70 Ų70130.8 Ų130.858%0.57973%0.725SS**  cis-171135-23.800000111.1
435S26.8Very low28.4Very low107 Ų107127.5 Ų127.575%0.74872%0.72SS**  trans62.1177.8143.776.70000118.5
436L25.6Very low28.7Very low121 Ų121128.7 Ų128.763%0.63473%0.727SS**  cis-156.2118.12.6-148139.3000111.2
437F26.1Very low29.4Very low196 Ų196126.8 Ų126.886%0.8672%0.721SS**  trans61.9168.5157.7-73-128.5000117.5
438A28.5Very low29.6Very low87 Ų87131.8 Ų131.872%0.71973%0.727SS**  cis-145.8167.82.600000112.2
439Q34Very low29.9Very low160 Ų160131.2 Ų131.275%0.74873%0.726SS**  trans-79.1167.4154.5-51.7-177.8-30.300110N441Q439-N441 HydrophobicContact CB-CB 4.45Å
440P36.8Very low30.2Very low122 Ų122130.4 Ų130.479%0.79273%0.73SS**  -127.3157.968.314.48.9000112.7
441N30.9Very low30.1Very low130 Ų130127.8 Ų127.870%0.69572%0.721SS**  cis80.2152.427.2-155.36.4000114.7Q439Q439-N441 HydrophobicContact CB-CB 4.45Å
442S29.8Very low30.1Very low93 Ų93128.4 Ų128.465%0.6573%0.728SS**  trans77.5144.3-175.2-24.60000114.1
443T28.9Very low30.4Very low124 Ų124135.3 Ų135.376%0.76174%0.74SS**  cis-175.2179.2-4.417.80000107
444L27.7Very low30.6Very low138 Ų138131.2 Ų131.272%0.72373%0.734SS**  cis-162.9166.311.2-123.9152.4000108.3
445I32Very low30.8Very low144 Ų144133.8 Ų133.874%0.73875%0.747SS**  trans73.5110159.1-61.8155.8000116
446N29.6Very low30.9Very low147 Ų147133.7 Ų133.779%0.78675%0.747SS**  cis83.315329.8-152.451.2000112.7
447P39.9Very low31.1Very low87 Ų87135.2 Ų135.257%0.56576%0.761SS**  -137.1-156.3-50.638.5-21.3000113.8
448R30Very low31.6Very low228 Ų228131.1 Ų131.186%0.8676%0.757SS**  trans84.8146.7156.4-78.9170.1172.7-179.8-2.6117.2
449S30.5Very low31.7Very low84 Ų84134.2 Ų134.259%0.58776%0.761SS**  cis-165153.7-4.1-128.40000113.5
450T32.6Very low31.9Very low134 Ų134131.5 Ų131.582%0.82276%0.76SS**  trans61157.8149.750.90000118.5
451A33.2Very low31.7Very low87 Ų87132.1 Ų132.172%0.71976%0.756SS**  cis-170.1170.5-4.300000107.6
452F28.3Very low31.8Very low190 Ų190132.1 Ų132.183%0.83376%0.755SS**  cis-171.6160.9-31.7-153.2-84.9000106.9
453R32.3Very low31.9Very low241 Ų241134.5 Ų134.591%0.90976%0.761SS**  trans75.7140.4175.6-51-174.3173.6-153.6-4.5116.7
454G32.2Very low32Very low66 Ų66133.2 Ų133.268%0.6876%0.757SS**  cis158.9157.8-15.600000116.3
455S32Very low32.3Very low123 Ų123135.6 Ų135.686%0.8677%0.767SS**  trans68.4150.6157.8-55.70000118.5
456S28.5Very low32.3Very low106 Ų106133.7 Ų133.774%0.74177%0.766SS**  cis-176.1140.1-25.2500000108.7
457V30.4Very low32.6Very low153 Ų153134.6 Ų134.693%0.92777%0.771SS**  trans-135.3147.5168.3-176.50000109.3
458S35.2Very low32.1Very low110 Ų110136 Ų13677%0.76978%0.778SS**  trans-119.8161.4-167.651.40000114.2
459N32.1Very low32.3Very low151 Ų151132.8 Ų132.881%0.80778%0.777SS**  trans-73.5162.1-175.8-55.4-23.8000114.6
460S37Very low32.2Very low104 Ų104134.3 Ų134.373%0.72778%0.782SS**  trans147.7149.514450.40000111.1
461D33.7Very low32.2Very low134 Ų134132.2 Ų132.272%0.71777%0.773SS**  cis-156.2139.3-22.5-103.2-26.5000111.5
462L32.4Very low32.1Very low130 Ų130134.8 Ų134.868%0.68178%0.775SS**  45.9142.5128.4-64170.9000124.6
463N31.8Very low32.2Very low144 Ų144133.4 Ų133.477%0.7778%0.775SS**  trans71.9155.8140-70.2-11.2000119
464S31.6Very low32.3Very low96 Ų96130.7 Ų130.767%0.67177%0.77SS**  cis-169.8152-17.2168.80000108
465M33.5Very low32.5Very low189 Ų189133.1 Ų133.193%0.93177%0.774SS**  -178.1124128.1-101.7168.6177.500112.3
466S31.2Very low32.8Very low104 Ų104133.7 Ų133.773%0.72777%0.767SS**  trans-92.6159.4151.1-56.20000108.2
467D35.8Very low33.2Very low165 Ų165134.8 Ų134.888%0.88277%0.771SS**  -162.6166.7123.9-109-29.2000113.2
468T30.9Very low33.2Very low118 Ų118132.5 Ų132.572%0.72476%0.763SS**  trans-125.5158.8-173.8-580000109.2
469I32.7Very low33Very low160 Ų160132.3 Ų132.382%0.82176%0.761SS**  trans176.3145.2134.3-90.7154000112.6
470T29.1Very low32.9Very low115 Ų115131 Ų13171%0.70676%0.759SS**  trans-52.6165-179.859.60000114.8
471S32.5Very low32.6Very low91 Ų91130.3 Ų130.364%0.63676%0.759SS**  175.5153.558.645.40000115.8
472N30.3Very low32.7Very low141 Ų141132.4 Ų132.475%0.75477%0.767SS**  trans70.9118.1134.8-69.3-3.6000125.2
473L32.2Very low33Very low160 Ų160131.3 Ų131.384%0.83877%0.767SS**  99.8122126.4-69.9167.7000122.8
474F32.8Very low33.1Very low184 Ų184131.2 Ų131.281%0.80777%0.767SS**  trans-57.8177.7160.1-80.9-91.6000114.3
475P36.8Very low33Very low117 Ų117131.4 Ų131.476%0.7677%0.768SS**  cis-137.8179.615.837.2-15.9000118.2
476L38Very low32.9Very low136 Ų136129 Ų12971%0.71276%0.758SS**  trans-66.8165160.7-77.970.7000111.4
477P36.7Very low32.9Very low128 Ų128130.8 Ų130.883%0.83176%0.759SS**  -133.6177.7110.339.3-31.9000114.3
478S31.3Very low32.8Very low106 Ų106126.3 Ų126.374%0.74175%0.745SS**  trans-107.2169.4-164.2-44.70000114.7
479S30.3Very low33.1Very low105 Ų105127.3 Ų127.373%0.73475%0.745SS**  trans88.7149.4138.2-168.90000121
480T29.8Very low33.4Very low125 Ų125125.5 Ų125.577%0.76774%0.743SS**  trans100.6137141.2-7.70000120.5
481A30.5Very low33.9Very low89 Ų89125.2 Ų125.274%0.73674%0.743SS**  trans76.6104151.500000120.4
482M36.8Very low34Very low178 Ų178128.1 Ų128.188%0.87775%0.751SS**  trans-55.2157.3138.3-68-84.4-15500110
483P38.5Very low34.2Very low106 Ų106129.7 Ų129.769%0.68875%0.751SS**  -149.1139.3100.936.6-20000117
484N32.9Very low34.3Very low142 Ų142127.6 Ų127.676%0.75974%0.74SS**  58.6151128.7-57.6-15.6000123.8
485S31Very low34.3Very low101 Ų101127 Ų12771%0.70674%0.738SS**  trans83.1140.3139.5-73.10000119.8
486L29.8Very low34.1Very low137 Ų137124.6 Ų124.672%0.71773%0.734SS**  cis-172.4170.7-9.4-119175.5000109.5
487L32.7Very low33.9Very low142 Ų142126.4 Ų126.474%0.74374%0.739SS**  trans70.2150.9155.3-68.1158.2000117.2I489L487-I489 HydrophobicContact CD2-CD1 4.28Å
488A32.1Very low33.6Very low71 Ų71125.3 Ų125.359%0.58773%0.734SS**  cis-160.8136.82.200000115.1
489I37.7Very low33.7Very low140 Ų140124.2 Ų124.272%0.71873%0.732SS**  69.8149124.3-62.6170.4000118.6L487L487-I489 HydrophobicContact CD2-CD1 4.28Å
490P38.9Very low33.6Very low121 Ų121128.3 Ų128.379%0.78674%0.739SS**  cis-117.6152.41.818.83.5000116.5
491P41Very low33.7Very low109 Ų109128 Ų12871%0.70874%0.743SS**  trans-110.3178.4168.141.8-33.9000112.9
492L34.5Very low33.6Very low153 Ų153132.3 Ų132.380%0.80175%0.747SS**  trans-144.5120.2149.1-72.5-178.4000114.1
493F33.4Very low33.2Very low173 Ų173129.5 Ų129.576%0.75974%0.744SS**  trans57.5137.9135.5-73.9-105.8000121.1
494L34.2Very low32.8Very low117 Ų117130.2 Ų130.261%0.61375%0.752SS**  cis-168.6147.6-1.7-174.363.6000113.9
495F33.2Very low32.7Very low172 Ų172126.7 Ų126.775%0.75475%0.748SS**  trans48.3143.4161.9-67.9-43.5000122.6
496G33.8Very low32.6Very low66 Ų66130.1 Ų130.168%0.6876%0.758SS**  cis157.4167.2-12.700000117.1
497Q33.5Very low32.8Very low173 Ų173131 Ų13181%0.80876%0.762SS**  trans73.8152.5158.9-63.9-174.840.500120.3
498S29Very low32.7Very low105 Ų105130.4 Ų130.473%0.73476%0.764SS**  cis-177.4177.8-30.4-100.10000110.9
499A33.7Very low32.7Very low84 Ų84132.8 Ų132.869%0.69477%0.773SS**  trans77.4126.8173.300000116
500E28.7Very low32.3Very low190 Ų190131.9 Ų131.989%0.88878%0.78SS**  cis80.7142.947.9-63.9163.8-144.700112.3
501S32.4Very low32.1Very low120 Ų120130.9 Ų130.984%0.83978%0.782SS**  cis-143.3-179.528.265.70000115.9
502E27.3Very low31.5Very low179 Ų179133.3 Ų133.384%0.83679%0.789SS**  trans-84.2162.1-175.2-48.7160.4111.800114.3
503C29.7Very low31.4Very low119 Ų119133.8 Ų133.880%0.80479%0.79SS**  -171.4128.7126.4-103.50000115.7
504S29.1Very low31.1Very low121 Ų121130.7 Ų130.785%0.84679%0.786SS**  trans32.5126.4135.6-50.70000120.8
505G31.9Very low30.8Very low67 Ų67131 Ų13169%0.69179%0.792SS**  cis156.3-175.1-0.400000111.8
506L27Very low30.6Very low174 Ų174130.7 Ų130.791%0.91180%0.798SS**  trans46.4126.1155.3-59.6165.5000117.7
507I34.2Very low30.4Very low155 Ų155132.9 Ų132.980%0.79580%0.8SS**  cis-154.3145.246.7-71.6176000109.4
508T31.4Very low30.4Very low129 Ų129129.3 Ų129.379%0.79180%0.801SS**  trans-100.5157.9162.356.10000110.4
509P33.1Very low30.5Very low121 Ų121130 Ų13079%0.78681%0.805SS**  -144.2158.5105.438.1-25.2000114.9
510S28.4Very low30.2Very low122 Ų122130.5 Ų130.585%0.85380%0.804SS**  trans-84.7150.7162.3-490000110.8
511A33.8Very low30.2Very low100 Ų100126.7 Ų126.783%0.82679%0.793SS**  trans-145.7123.2166.200000111
512N28.7Very low30Very low160 Ų160127.1 Ų127.186%0.85679%0.794SS**  trans-92.2124.5172.4-79.3-25.4000110.4
513I32.1Very low30.1Very low162 Ų162125.6 Ų125.683%0.83179%0.79SS**  trans-142.699.7149.7-60.1-173000105.4
514T28.5Very low29.9Very low109 Ų109129 Ų12967%0.66979%0.794SS**  81.2108.576.6-56.60000113.6
515T26.5Very low29.9Very low122 Ų122130.2 Ų130.275%0.74879%0.79SS**  trans51.9127.5158.959.50000121.5
516L30.2Very low29.7Very low166 Ų166132.4 Ų132.487%0.86979%0.792SS**  -166.6123.4109.7-106169.5000111.6
517P28.4Very low29.7Very low112 Ų112129.7 Ų129.773%0.72778%0.782SS**  trans-86.3135.1162.633.4-30.2000110.3
518A33.5Very low29.5Very low99 Ų99128.2 Ų128.282%0.81879%0.786SS**  trans-118.277.4-177.600000112
519S31Very low29.2Very low118 Ų118130.6 Ų130.683%0.82579%0.785SS**  trans-102.397170.257.50000110.6
520S29.2Very low29.1Very low96 Ų96132 Ų13267%0.67179%0.792SS**  trans-163.9144.4-179.546.60000110.5
521T28.8Very low29Very low109 Ų109129.8 Ų129.867%0.66979%0.788SS**  cis-160.8140.4-9.414.10000108.5
522P26.5Very low28.8Very low130 Ų130128.5 Ų128.584%0.84478%0.784SS**  trans-78.6119.7164.631.5-30.4000109.9
523L30Very low28.8Very low146 Ų146130.4 Ų130.476%0.76479%0.788SS**  trans-101.4109.7179.1-85.3169.7000112.2
524Q24.8Very low28.6Very low191 Ų191126.4 Ų126.489%0.89379%0.786SS**  trans-95.8117.7162.5-66.8-178.2-6300110.2
525I28.9Very low28.7Very low147 Ų147127.1 Ų127.175%0.75480%0.796SS**  trans-148.9160.4159.95.4178.2000109.1
526P27.8Very low28.7Very low112 Ų112125.3 Ų125.373%0.72779%0.794SS**  -128.3165.6-101.940.7-26.5000117.5
527V27Very low28.7Very low117 Ų117128 Ų12871%0.70980%0.799SS**  trans-3.3123.7158.8-166.80000119.4F529V527-F529 HydrophobicContact CG1-CB 4.19Å; V527-F529 HydrophobicContact CG1-CD2 4Å
528S30.1Very low28.7Very low124 Ų124126 Ų12687%0.86780%0.799SS**  trans-172.392.6144.2-790000108.3
529F25.5Very low28.7Very low179 Ų179126.9 Ų126.979%0.78580%0.796SS**  69.471.558.8-133.7-60.5000115.2V527V527-F529 HydrophobicContact CG1-CB 4.19Å; V527-F529 HydrophobicContact CG1-CD2 4Å
530V30.6Very low28.4Very low151 Ų151127.1 Ų127.192%0.91579%0.792SS**  trans-139140.2139.7-179.10000107.6
531G26.4Very low28.4Very low76 Ų76131.5 Ų131.578%0.78480%0.8SS**  trans-149.7151.9173.800000112.1
532G30.8Very low28.2Very low72 Ų72131.3 Ų131.374%0.74279%0.791SS**  trans165.9104.9177.900000107.5
533Q28.1Very low28.3Very low201 Ų201133.2 Ų133.294%0.93979%0.794SS**  72129.263.8-72.3-141.111.100114.7
534G29.2Very low28.1Very low77 Ų77130.5 Ų130.579%0.79479%0.786SS**  trans85.8136.4170.500000114.3
535S28.9Very low28.3Very low125 Ų125130.3 Ų130.387%0.87479%0.786SS**  cis-158.5162.7-9.851.10000110.6
536A27.6Very low28.2Very low84 Ų84127.3 Ų127.369%0.69478%0.783SS**  trans-61.5157.3-177.700000114.8
537F30.4Very low28.2Very low222 Ų222130.1 Ų130.197%0.97479%0.786SS**  -178.4145.5127.5-98.4-63.3000112.3
538G27.9Very low28.2Very low71 Ų71131.3 Ų131.373%0.73279%0.787SS**  trans94.1146.1154.600000118
539P33.3Very low28Very low116 Ų116133.6 Ų133.675%0.75379%0.786SS**  trans-103.3-177.8178.441.2-36000113.8
540T25.6Very low28.1Very low123 Ų123132.4 Ų132.476%0.75579%0.788SS**  trans62.8125170.639.90000116
541F27.9Very low27.9Very low189 Ų189131.9 Ų131.983%0.82978%0.78SS**  -151.1164.572.5-117.3-95.6000113.7
542Q24.9Very low28Very low104 Ų104135.4 Ų135.449%0.48678%0.779SS.*  trans-79.2151.4163.6-91.9-150.5-4.300111.7I1307Q542-I1307 HydrophobicContact CB-CG2 3.86Å; Q542-I1307 HydrophobicContact CG-CG1 4.2Å; Q542-I1307 HydrophobicContact CG-CG2 3.99Å; Q542-I1307 VanDerWaalsContact OE1-CD1 3.27Å
543L29.3Very low27.9Very low171 Ų171142.8 Ų142.890%0.89579%0.786SS**  trans-116.3103.6147.1-94.4167.1000109E545L543-E545 PolarHBondContact O-N 3.29Å
544S24.7Very low27.9Very low88 Ų88138.7 Ų138.762%0.61578%0.775SS**  trans-87.690.8170.556.70000109.9A546S544-A546 VanDerWaalsContact C-N 3.26Å; S544-A546 PolarHBondContact O-N 3.44Å
545E30.7Very low27.9Very low187 Ų187144.5 Ų144.587%0.87478%0.778SS**  trans-85.573.9162.2-73.6-156.9132.800110.5L543L543-E545 PolarHBondContact O-N 3.29Å
546A24.9Very low28.1Very low85 Ų85149.1 Ų149.170%0.70278%0.778SS**  trans-85.7103.4154.100000107.8S544S544-A546 VanDerWaalsContact C-N 3.26Å; S544-A546 PolarHBondContact O-N 3.44Å
547H27.6Very low28.4Very low171 Ų171150.8 Ų150.879%0.79278%0.782SS**  trans-147.5137164.6-103.184.7000112.1
548I28.6Very low28.3Very low141 Ų141143 Ų14372%0.72377%0.765SS**  trans67.893.4157.9-56.2170.7000115.7
549M24.5Very low28.3Very low173 Ų173146.9 Ų146.985%0.85277%0.767SS**  trans-49.5145.8146.5-62.7154.1143.700111
550N27.8Very low28.2Very low153 Ų153148.7 Ų148.782%0.81877%0.769SS**  trans-155.5122.3138.2-106.1-35000111.1
551D26.7Very low28.7Very low140 Ų140147.5 Ų147.575%0.74976%0.764SS**  trans-69.2131.1169.4-61.6-86.5000111
552I29.1Very low29.1Very low151 Ų151144.7 Ų144.777%0.77476%0.764SS**  trans-132.898.6144-58.4-174.1000109.6T554I552-T554 HydrophobicContact CG2-CG2 4.35Å
553Y27.9Very low29.6Very low227 Ų227145.7 Ų145.789%0.8978%0.78SS**  trans-78.8108.4163.9-121.5-89.8000109.4
554T28.6Very low29.6Very low114 Ų114141 Ų14170%0.69977%0.773SS**  trans-143.699.8167.633.80000115.1I552I552-T554 HydrophobicContact CG2-CG2 4.35Å
555K28.2Very low29.8Very low199 Ų199145.1 Ų145.187%0.86579%0.788SS**  trans41.1126.7135.1-65.5-178.5176.4177.40121.6
556Y34.2Very low29.7Very low222 Ų222142.4 Ų142.487%0.87179%0.788SS**  trans-49.2154.1147.8-80.8-90.5000113.5
557P34Very low29.8Very low119 Ų119142.5 Ų142.577%0.77379%0.788SS**  -116.8177.291.739.3-37.3000111.2
558G28.4Very low29.7Very low59 Ų59140.9 Ų140.961%0.60879%0.79SS**  cis88.4130.624.700000110.8
559I27.8Very low29.7Very low153 Ų153139.5 Ų139.579%0.78579%0.793SS**  cis-163137.74.6-126.6165.8000110
560L30Very low29.9Very low153 Ų153136.7 Ų136.780%0.80179%0.79SS**  trans55.4177.1162.5-83.180.7000119.2
561P36.4Very low30.3Very low98 Ų98134.7 Ų134.764%0.63679%0.786SS**  -132.9173.7-56.439.9-25.1000113.5P563P561-P563 WeakPolarHBondContact O-CD 3.33Å
562P36.9Very low30.4Very low130 Ų130133 Ų13384%0.84479%0.785SS**  trans-95125.816934.5-30.2000113.7
563P36Very low30.3Very low126 Ų126130.5 Ų130.582%0.81878%0.781SS**  trans-109.6165.3155.337.3-28.8000111.1P561P561-P563 WeakPolarHBondContact O-CD 3.33Å
564G29.7Very low30.4Very low73 Ų73124.8 Ų124.875%0.75377%0.774SS**  trans-156.3-172.5-178.900000116.2
565L28.6Very low30.4Very low174 Ų174125.9 Ų125.991%0.91178%0.775SS**  trans77.8147.5176.6-61.4175.8000118.7
566C27.3Very low30.3Very low130 Ų130120.3 Ų120.388%0.87876%0.761SS**  trans73.3143.8177.3-57.50000117.1
567A27Very low30.1Very low86 Ų86113.2 Ų113.271%0.71175%0.748SS**  cis-167.5158-23.900000108.7
568V25.6Very low30.4Very low138 Ų138113.8 Ų113.884%0.83675%0.75SS**  trans-5.4117.5163-159.30000115.7
569S28.5Very low30.7Very low111 Ų111116.4 Ų116.478%0.77676%0.756SS**  -172159.588.6-64.20000113.5
570S29.1Very low31.1Very low114 Ų114114.8 Ų114.880%0.79775%0.753SS**  trans-96.5-172.7174.6-22.40000111.6
571P36.4Very low31.3Very low111 Ų111114.7 Ų114.772%0.72175%0.753SS**  cis-132.4-160.8-2638.7-20.3000112.3
572S27.8Very low31.6Very low106 Ų106115.9 Ų115.974%0.74176%0.761SS**  trans72.6161.6157.174.90000119.7
573S27.4Very low31.6Very low97 Ų97115 Ų11568%0.67876%0.757SS**  -177.8129.5-64.848.40000112
574S30.4Very low31.7Very low107 Ų107113.1 Ų113.175%0.74875%0.752SS**  trans67.9160.4166.3850000116.3
575N28.9Very low31.9Very low137 Ų137114.5 Ų114.573%0.73376%0.757SS**  cis-16615914.9-134.6-18.6000113.2
576C26.7Very low32.1Very low82 Ų82111 Ų11155%0.55475%0.753SS**  trans63.5153.1155.5-64.50000120.4
577A29.5Very low32.5Very low74 Ų74108.8 Ų108.861%0.61274%0.744SS**  cis-159.5169.1-6.600000112.9H412H412-A577 WeakPolarHBondContact O-CB 3.47Å
578T40.8Very low32.8Very low131 Ų131110.6 Ų110.680%0.80475%0.751SS**  trans-99.5174.5178.554.20000113.7
579P34.9Very low33.2Very low114 Ų114108 Ų10874%0.7475%0.745SS**  -151.2136.6117.836.6-18.7000120.1
580T34.2Very low33.5Very low118 Ų118108.9 Ų108.972%0.72475%0.746SS**  trans61.7117133.162.90000126.9
581L36.2Very low33.8Very low152 Ų152108.6 Ų108.680%0.79674%0.743SS**  57.7166.5125.5-87.580.3000121.9
582P41.6Very low33.7Very low123 Ų123108.4 Ų108.480%0.79975%0.745SS**  cis-127.2-163.29.723.92.3000114.4
583S37.3Very low34Very low110 Ų110109.1 Ų109.177%0.76975%0.745SS**  cis-174.3-173.6-42.3-169.10000110.4
584A36.9Very low34.2Very low87 Ų87109.4 Ų109.472%0.71975%0.747SS**  trans75.1127.6175.100000118.7
585A34.3Very low34.1Very low103 Ų103112.6 Ų112.685%0.85175%0.75SS**  cis86.2146.512.400000116.4
586A33.6Very low34.2Very low99 Ų99113.2 Ų113.282%0.81875%0.752SS**  cis-178.6176.7-11.600000108.1
587A35.5Very low34.8Very low85 Ų85114.3 Ų114.370%0.70276%0.758SS**  cis-171-178.7-10.400000110.3
588S33.6Very low35.5Very low123 Ų123116.8 Ų116.886%0.8677%0.768SS**  trans70156155.260.30000121.5
589A33.8Very low35.2Very low84 Ų84113.8 Ų113.869%0.69476%0.763SS**  cis-172.1-178.8-2300000113.6
590T34.3Very low34.9Very low130 Ų130115.3 Ų115.380%0.79877%0.765SS**  trans79.6118.1153.149.80000125.9
591S35Very low34.8Very low107 Ų107117.7 Ų117.775%0.74877%0.766SS**  81.4136.5127.363.40000127.7
592S36.1Very low34.3Very low108 Ų108119 Ų11976%0.75577%0.767SS**  trans85.7101.4138.148.10000126
593V32.3Very low33.9Very low121 Ų121116.9 Ų116.973%0.73377%0.769SS**  37.3125122.3-174.40000122.3
594S31.5Very low33.4Very low103 Ų103119.4 Ų119.472%0.7277%0.773SS**  175.8135.5123.3-78.60000116.7
595Q28.7Very low33.4Very low174 Ų174120.5 Ų120.581%0.81377%0.773SS**  trans24.5155.7136.1-57-175.9400122.8
596L31Very low33Very low149 Ų149123.1 Ų123.178%0.7877%0.772SS**  cis-166.6173.4-13.9-99.5171.5000108.6
597P39.9Very low32.6Very low106 Ų106123.2 Ų123.269%0.68877%0.766SS**  trans-110-144.1-168.746.7-39000112.4
598P44.3Very low32.2Very low126 Ų126127.1 Ų127.182%0.81877%0.77SS**  cis-136.9-173.1-18.741.8-23.9000116.1
599G33.5Very low31.9Very low68 Ų68126.1 Ų126.170%0.70176%0.762SS**  trans110.7168.9154.700000116.3
600N29.1Very low31.7Very low145 Ų145127.6 Ų127.678%0.77576%0.763SS**  cis-170177.7-24.6-137.332.6000108.2
601F31.6Very low31.4Very low169 Ų169127.4 Ų127.474%0.74176%0.761SS**  trans71.8126.2-178.7-60.7-86.8000114.4
602E26.6Very low31.5Very low178 Ų178129 Ų12983%0.83277%0.766SS**  72.3127.454.6-66.5-168.1135.400114.3
603G32.4Very low31.1Very low80 Ų80129 Ų12983%0.82576%0.758SS**  trans150.569.5165.100000119.2
604N28.3Very low31Very low162 Ų162129.2 Ų129.287%0.86676%0.755SS**  trans42.7152151.3-83.7-16.7000123.9
605P35.6Very low30.8Very low111 Ų111129.7 Ų129.772%0.72175%0.749SS**  trans-86156.9164.537.2-34.8000112.8
606L27.3Very low31Very low157 Ų157128.2 Ų128.282%0.82275%0.747SS**  trans-175.9139.1150-95.3157.4000106.5
607C24.2Very low31.1Very low102 Ų102129.8 Ų129.869%0.68975%0.748SS**  44.1133.797.7-66.90000114.8
608E26.7Very low30.6Very low167 Ų167129.9 Ų129.978%0.7875%0.749SS**  cis-165.7155.512.3-140.8-178.2126.200112.3
609S28.2Very low29.8Very low101 Ų101132.7 Ų132.771%0.70675%0.748SS**  trans61.8156.7152.2-123.20000117.5
610T29.8Very low29.4Very low115 Ų115132.3 Ų132.371%0.70674%0.744SS**  cis-149.5147.82945.60000113.1
611V27.8Very low29.1Very low127 Ų127135.4 Ų135.477%0.7775%0.746SS**  trans61.8122.9143175.10000116.2
612V36.7Very low28.8Very low140 Ų140133.5 Ų133.585%0.84874%0.744SS**  cis-113.812241.61800000113.7
613N26.6Very low28.8Very low109 Ų109132.6 Ų132.658%0.58374%0.741SS**  trans-85.6143.1161.9-179.625.7000109.5
614N31.6Very low28.6Very low125 Ų125133.6 Ų133.667%0.66873%0.733SS**  175.3119.8127.2-87.9-18.6000112.7
615N27.3Very low28.5Very low112 Ų112130.5 Ų130.560%0.59972%0.722SS**  48.1114.8120-44.6-19.3000116.8
616N31.8Very low28.1Very low143 Ų143131.4 Ų131.477%0.76573%0.726SS**  cis-160.8138.836-90.6-30.1000113.1
617F34.5Very low28.1Very low183 Ų183129 Ų12980%0.80372%0.723SS**  trans-78.5147.6132.7-88-100.5000108
618P28.9Very low28.2Very low108 Ų108130.9 Ų130.970%0.70172%0.721SS**  -128.5144.7102.237.5-31.5000111.3
619F27Very low28.2Very low185 Ų185130.8 Ų130.881%0.81173%0.725SS**  58.688.764.8-89.7-78000114.2
620G24.4Very low28.2Very low59 Ų59132.7 Ų132.761%0.60873%0.727SS**  trans-167.6114.2163.100000106.6
621Y24.6Very low27.9Very low210 Ų210133.5 Ų133.582%0.82473%0.725SS**  49.1125.577.3-60.5-53.4000111.9
622N24.5Very low27.7Very low129 Ų129134.8 Ų134.869%0.6972%0.724SS**  cis-175158.4-8.5-135.8-11.4000105.8
623M27.3Very low27.3Very low159 Ų159131 Ų13178%0.78370%0.699SS**  trans63.7169.2167.5-59.4-70.7-177.900116.3
624P26.4Very low27.5Very low101 Ų101132.2 Ų132.266%0.65671%0.713SS**  cis-108.2166.3-12.839.3-29.9000113
625P26.9Very low27.4Very low98 Ų98133.4 Ų133.464%0.63671%0.714SS**  trans-65.2157.1157.231.8-35.3000110.8
626T27.7Very low27.4Very low129 Ų129129 Ų12979%0.79169%0.693SS**  trans56105.717053.20000118.3
627S26.8Very low27.3Very low108 Ų108130.4 Ų130.476%0.75570%0.696SS**  trans-143.676.1153.7-68.60000108.4
628Q26.1Very low26.9Very low141 Ų141125.8 Ų125.866%0.65969%0.692SS**  26.8107.9102.9-69.7-150.220.800114.8
629L27Very low26.8Very low165 Ų165127.8 Ų127.886%0.86469%0.694SS**SBendtrans-11196.7147.2-98.8169.1000108.5
630N28.1Very low26.7Very low140 Ų140121.9 Ų121.975%0.74968%0.679SS**SBendtrans6169156.6-57.9-4.9000117.8
631M24.5Very low26.9Very low133 Ų133128.4 Ų128.466%0.65570%0.696SS**  32.2114.5127.2-55.1-155.679.300119.4
632M23.9Very low27Very low154 Ų154122.3 Ų122.376%0.75968%0.681SS**  -128.9137.4112-101.9-179.3-177.300108.2S636 A640M632-S636 WeakPolarHBondContact CB-OG 3.49Å; M632-A640 HydrophobicContact CE-CB 4.31Å; M632-A640 HydrophobicContact SD-CB 4Å
633D28.4Very low27Very low61 Ų61123.9 Ų123.933%0.32669%0.689SS.*  trans-79.7158.4-170.5114.389.4000112.7Q635 S636D633-Q635 PolarHBondContact O-N 3.09Å; D633-Q635 PolarHBondContact OD1-N 3.17Å; D633-Q635 WeakPolarHBondContact OD2-CA 3.39Å; D633-Q635 PolarHBondContact OD2-N 3.29Å; D633-S636 PolarHBondContact N-OG 3.12Å; D633-S636 PolarHBondContact O-N 2.89Å; D633-S636 PolarHBondContact O-OG 3.29Å; D633-S636 VanDerWaalsContact OD2-CB 3.28Å; D633-S636 WeakPolarHBondContact OD2-CB 3.22Å; D633-S636 PolarHBondContact OD2-N 3.06Å
634P28.9Very low27Very low133 Ų133126.7 Ų126.786%0.86470%0.697SS**THydrogen-bonded Turntrans-56.2-13.8175.3-26.736.5000116.9
635Q30.6Very low26.9Very low150 Ų150129.4 Ų129.470%0.70170%0.703SS**THydrogen-bonded Turntrans-100.2-10.4171.4-52.6-165.8-85.100113.4D633 A638D633-Q635 PolarHBondContact O-N 3.09Å; D633-Q635 PolarHBondContact OD1-N 3.17Å; D633-Q635 WeakPolarHBondContact OD2-CA 3.39Å; D633-Q635 PolarHBondContact OD2-N 3.29Å; Q635-A638 WeakPolarHBondContact O-CB 2.97Å; Q635-A638 PolarHBondContact O-N 2.74Å
636S27Very low26.9Very low21 Ų21129.7 Ų129.715%0.14771%0.707CS.*G310 helixtrans-88.2-18.1-175.270.80000115M632 D633 A638 M639 A640M632-S636 WeakPolarHBondContact CB-OG 3.49Å; D633-S636 PolarHBondContact N-OG 3.12Å; D633-S636 PolarHBondContact O-N 2.89Å; D633-S636 PolarHBondContact O-OG 3.29Å; D633-S636 VanDerWaalsContact OD2-CB 3.28Å; D633-S636 WeakPolarHBondContact OD2-CB 3.22Å; D633-S636 PolarHBondContact OD2-N 3.06Å; S636-A638 PolarHBondContact O-N 3.23Å; S636-A638 VanDerWaalsContact O-N 3.13Å; S636-M639 CarbonylContact O-C 3.57Å; S636-M639 PolarHBondContact O-N 2.63Å; S636-A640 WeakPolarHBondContact O-CB 3.29Å; S636-A640 PolarHBondContact O-N 3.04Å
637M28.8Very low26.9Very low171 Ų171132.1 Ų132.184%0.84271%0.709SS**G310 helixtrans-66.4-7.7163.6-157.5163.9108.200112
638A27.8Very low26.8Very low87 Ų87130.5 Ų130.572%0.71971%0.71SS**G310 helixtrans-98.96.1166.300000114.4Q635 S636Q635-A638 WeakPolarHBondContact O-CB 2.97Å; Q635-A638 PolarHBondContact O-N 2.74Å; S636-A638 PolarHBondContact O-N 3.23Å; S636-A638 VanDerWaalsContact O-N 3.13Å
639M27.1Very low26.7Very low150 Ų150127.3 Ų127.374%0.73972%0.715SS**THydrogen-bonded Turntrans-133.7-6.5174.5-65-163.6-166.100115.2S636 M641S636-M639 CarbonylContact O-C 3.57Å; S636-M639 PolarHBondContact O-N 2.63Å; M639-M641 PolarHBondContact O-N 3.29Å
640A24.2Very low26.6Very low60 Ų60124.7 Ų124.750%0.49672%0.717SS.*THydrogen-bonded Turntrans-85.23.7-173.900000116.6M632 S636M632-A640 HydrophobicContact CE-CB 4.31Å; M632-A640 HydrophobicContact SD-CB 4Å; S636-A640 WeakPolarHBondContact O-CB 3.29Å; S636-A640 PolarHBondContact O-N 3.04Å
641M27.3Very low26.6Very low196 Ų196122.7 Ų122.797%0.96672%0.72SS**THydrogen-bonded Turntrans-118.230.7167.4-101.8-157.8173.100113.6M639M639-M641 PolarHBondContact O-N 3.29Å
642T27.4Very low26.7Very low83 Ų83123.2 Ų123.251%0.50973%0.725SS.*  trans-123.456.5177.8-46.50000112.1M645T642-M645 HydrophobicContact CG2-CE 4.45Å; T642-M645 HydrophobicContact CG2-CG 3.9Å; T642-M645 HydrophobicContact CG2-SD 3.59Å; T642-M645 VanDerWaalsContact CG2-SD 3.59Å
643L25.1Very low26.9Very low161 Ų161122 Ų12284%0.84372%0.722SS**SBendtrans-144.434.6169.8-112.1-178000115.6
644F27.9Very low27Very low219 Ų219124.7 Ų124.796%0.96174%0.737SS**  trans-130.151.1148.8-111.3-74.1000110.5S646F644-S646 PolarHBondContact O-N 3.24Å
645M23.9Very low27Very low157 Ų157125.5 Ų125.577%0.77373%0.734SS**  trans-71.5116.6167.2-62.7-1769300109.4T642T642-M645 HydrophobicContact CG2-CE 4.45Å; T642-M645 HydrophobicContact CG2-CG 3.9Å; T642-M645 HydrophobicContact CG2-SD 3.59Å; T642-M645 VanDerWaalsContact CG2-SD 3.59Å
646S26.7Very low27Very low105 Ų105122.1 Ų122.173%0.73473%0.726SS**  trans-130.6102.4148.4-165.10000108.5F644F644-S646 PolarHBondContact O-N 3.24Å
647Q26.7Very low27.1Very low179 Ų179127.5 Ų127.584%0.83675%0.754SS**  trans11.7134150.3-33.9-171.861.300116.7
648G24.8Very low27.1Very low75 Ų75126.4 Ų126.477%0.77375%0.751SS**  cis72.5123.438.300000110.3
649G25.2Very low27.2Very low74 Ų74126.8 Ų126.876%0.76375%0.749SS**  cis176.9176.5-6.500000110.8
650A25.1Very low27.3Very low109 Ų109128.3 Ų128.390%0.90175%0.754SS**  trans40103.2158.100000121.3
651A26.7Very low27.5Very low99 Ų99133.4 Ų133.482%0.81877%0.771SS**  trans-179.3114.2135.300000107.3
652N26.4Very low27.8Very low143 Ų143129.3 Ų129.377%0.76576%0.759SS**  cis71.391.135.8-156.338.7000114.9
653N29.1Very low28Very low128 Ų128131.4 Ų131.468%0.68477%0.774SS**  -176.4124.1129.5-95.7-22.5000114.2
654N29.7Very low28.1Very low119 Ų119129 Ų12964%0.63677%0.768SS**  trans61.9133.8130.7-52.6-19.9000123.4
655N29.7Very low28.1Very low149 Ų149126.8 Ų126.880%0.79777%0.765SS**  trans68.6141.3140.1-65.56.1000118.7
656S30Very low28.2Very low79 Ų79125 Ų12555%0.55277%0.769SS**  cis-165.8152.87.6-121.30000113.5
657N29.7Very low28.3Very low134 Ų134128.9 Ų128.972%0.71778%0.775SS**  trans65.2134142.5-52-1000121.4
658N28.5Very low28.5Very low148 Ų148124.4 Ų124.479%0.79177%0.769SS**  trans47.8124.6142.5-53.20.2000118.6
659S30.8Very low28.7Very low96 Ų96126.6 Ų126.667%0.67177%0.769SS**  cis-169.7146.143.6-48.30000112.7
660Q27.8Very low28.8Very low182 Ų182131.5 Ų131.585%0.8577%0.772SS**  trans55.7164.4145.6-64.6175.3-49.200121.3
661I30Very low29Very low167 Ų167137.1 Ų137.186%0.85677%0.771SS**  trans84.9138.6170.3-57.9169.3000114.2
662P31.8Very low29.5Very low109 Ų109137.7 Ų137.771%0.70876%0.76SS**  trans-89.8169.7-151.336.4-36.8000115.7
663P31.9Very low29.9Very low127 Ų127138.6 Ų138.683%0.82576%0.759SS**  trans-88.9134.7-149.832.6-35.8000116.2
664P28.7Very low30.2Very low111 Ų111136.5 Ų136.572%0.72175%0.751SS**  trans-104.1149.4161.237-30.1000113.2
665L26.2Very low30.3Very low172 Ų172133.8 Ų133.890%0.90175%0.745SS**  trans21.4112.7147.3-68.1158.2000119.1
666S27.7Very low30.7Very low121 Ų121133.5 Ų133.585%0.84674%0.737SS**  trans-126.7125.7159.961.30000111.1
667Q28.3Very low30.8Very low185 Ų185135.2 Ų135.286%0.86474%0.737SS**PPolyproline II helixtrans-89.1145.1-174.5-64170.5-7.600112.5
668A29.5Very low31.1Very low85 Ų85133.4 Ų133.470%0.70273%0.727SS**PPolyproline II helixtrans-95.5154.1162.200000109.8
669P30.3Very low31.4Very low121 Ų121133.2 Ų133.279%0.78672%0.723SS**PPolyproline II helixtrans-71.9131.5-159.726.3-34.9000114.5
670Q27.7Very low31.6Very low177 Ų177134 Ų13483%0.82772%0.716SS**PPolyproline II helixtrans-72.4134.2172.8-66.6179.5-22.600112
671W29.3Very low31.8Very low228 Ų228132.6 Ų132.686%0.86471%0.709SS**  trans-136.396158.2-82.897.3000111.4
672N37Very low32Very low110 Ų110131.4 Ų131.459%0.58870%0.704SS**  trans48.680.3159.5-68.1-23.2000119.7V674 A675N672-V674 PolarHBondContact O-N 3.22Å; N672-A675 PolarHBondContact O-N 3.37Å
673H35.2Very low32Very low163 Ų163129.8 Ų129.876%0.75570%0.7SS**Hα-helixtrans-48.9-22.2156.1-99-99.5000114.5A675 F676 M677H673-A675 VanDerWaalsContact C-N 3.31Å; H673-A675 PolarHBondContact O-N 2.91Å; H673-F676 WeakPolarHBondContact O-CB 2.88Å; H673-F676 PolarHBondContact O-N 3.47Å; H673-M677 PolarHBondContact O-N 2.97Å
674V34Very low31.8Very low83 Ų83130.4 Ų130.450%0.50370%0.696SS.*Hα-helixtrans-61.1-35.4-178.4-1760000112.5N672 F676 M677 I678N672-V674 PolarHBondContact O-N 3.22Å; V674-F676 VanDerWaalsContact C-N 3.31Å; V674-F676 PolarHBondContact O-N 2.84Å; V674-M677 PolarHBondContact O-N 3.06Å; V674-I678 HydrophobicContact CG1-CD1 3.84Å; V674-I678 HydrophobicContact CG1-CG1 4.38Å; V674-I678 WeakPolarHBondContact O-CG1 3.44Å; V674-I678 PolarHBondContact O-N 2.98Å
675A32.9Very low31.8Very low63 Ų63128.3 Ų128.352%0.52169%0.694SS.*Hα-helixtrans-66-35.5178.300000112.2N672 H673 M679N672-A675 PolarHBondContact O-N 3.37Å; H673-A675 VanDerWaalsContact C-N 3.31Å; H673-A675 PolarHBondContact O-N 2.91Å; A675-M679 WeakPolarHBondContact O-CG 3.29Å; A675-M679 PolarHBondContact O-N 3.03Å
676F36.9Very low31.9Very low143 Ų143129.4 Ų129.463%0.62770%0.697SS**Hα-helixtrans-68.5-42.7176.1-157.6-92.8000111.1H673 V674 M679 Q680H673-F676 WeakPolarHBondContact O-CB 2.88Å; H673-F676 PolarHBondContact O-N 3.47Å; V674-F676 VanDerWaalsContact C-N 3.31Å; V674-F676 PolarHBondContact O-N 2.84Å; F676-M679 PolarHBondContact O-N 2.98Å; F676-Q680 WeakPolarHBondContact O-CB 3.35Å; F676-Q680 PolarHBondContact O-N 3.35Å
677M33Very low31.9Very low114 Ų114128.1 Ų128.156%0.56269%0.694SS**Hα-helixtrans-63.4-40.1175.5-69.8-176.168.100113.1H673 V674 Q680 Q681H673-M677 PolarHBondContact O-N 2.97Å; V674-M677 PolarHBondContact O-N 3.06Å; M677-Q680 PolarHBondContact O-N 3.33Å; M677-Q681 WeakPolarHBondContact O-CB 3.21Å; M677-Q681 WeakPolarHBondContact O-CG 3.42Å; M677-Q681 PolarHBondContact O-N 2.81Å
678I35.3Very low32.1Very low97 Ų97127 Ų12750%0.49769%0.694SS.*Hα-helixtrans-67.5-41.4179.4-70.7171000111.3V674 Q680 Q681 L682V674-I678 HydrophobicContact CG1-CD1 3.84Å; V674-I678 HydrophobicContact CG1-CG1 4.38Å; V674-I678 WeakPolarHBondContact O-CG1 3.44Å; V674-I678 PolarHBondContact O-N 2.98Å; I678-Q680 VanDerWaalsContact C-N 3.35Å; I678-Q681 PolarHBondContact O-N 3.27Å; I678-L682 PolarHBondContact O-N 3.27Å
679M35Very low32.2Very low143 Ų143130.2 Ų130.270%0.70470%0.699SS**Hα-helixtrans-65.5-38.1174.1-69.3-76.9-87.800111.7A675 F676 L682A675-M679 WeakPolarHBondContact O-CG 3.29Å; A675-M679 PolarHBondContact O-N 3.03Å; F676-M679 PolarHBondContact O-N 2.98Å; M679-L682 PolarHBondContact O-N 3.44Å
680Q36Very low32.3Very low112 Ų112129.8 Ų129.852%0.52370%0.697SS.*Hα-helixtrans-75.6-22.8179.4-162.2152.543.500113.6F676 M677 I678F676-Q680 WeakPolarHBondContact O-CB 3.35Å; F676-Q680 PolarHBondContact O-N 3.35Å; M677-Q680 PolarHBondContact O-N 3.33Å; I678-Q680 VanDerWaalsContact C-N 3.35Å
681Q31.4Very low32.3Very low153 Ų153125 Ų12572%0.71570%0.695SS**Hα-helixtrans-79.4-16168.9-76.6-172.3-17.800114M677 I678M677-Q681 WeakPolarHBondContact O-CB 3.21Å; M677-Q681 WeakPolarHBondContact O-CG 3.42Å; M677-Q681 PolarHBondContact O-N 2.81Å; I678-Q681 PolarHBondContact O-N 3.27Å
682L32.9Very low32.2Very low143 Ų143120 Ų12075%0.74969%0.694SS**THydrogen-bonded Turntrans-87.9-8.1172.8-85.1162.8000114I678 M679I678-L682 PolarHBondContact O-N 3.27Å; M679-L682 PolarHBondContact O-N 3.44Å
683A31.9Very low31.6Very low74 Ų74120.7 Ų120.761%0.61270%0.701SS**THydrogen-bonded Turntrans-100.6-17.7-177.900000114.8
684N28.8Very low31.2Very low141 Ų141119.4 Ų119.475%0.75470%0.704SS**SBendtrans-117.178.8-172.4-83.6-26.4000112.7
685G28.6Very low30.9Very low66 Ų66120.6 Ų120.668%0.6872%0.716SS**  trans162.6121171.700000110
686M28.1Very low30.8Very low195 Ų195122.4 Ų122.496%0.96173%0.725SS**  cis-133.3128.620.2-58.8165.4-74.900111.6
687A27.7Very low30.4Very low94 Ų94121.7 Ų121.778%0.77773%0.733SS**  trans-149.390.1167.100000110.9
688N32.5Very low30.7Very low163 Ų163121.5 Ų121.587%0.87274%0.74SS**  trans-159.9133.8164.7-83.3-46.9000104
689N31.1Very low30.5Very low152 Ų152123.7 Ų123.781%0.81375%0.753SS**  -157.4156.951.7-158.439.7000110.7
690P32.8Very low30.3Very low112 Ų112122.7 Ų122.773%0.72776%0.755SS**  trans-103.9160.9-176.737.9-32.6000115.9
691G28.3Very low29.8Very low77 Ų77122.6 Ų122.679%0.79476%0.762SS**  trans89.7159169.600000116.2
692C26.3Very low29.6Very low123 Ų123122.1 Ų122.183%0.83176%0.763SS**  cis-165.8160.7-6.6-1500000112.6
693V25.8Very low29.4Very low124 Ų124121.2 Ų121.275%0.75276%0.758SS**  trans65.6126.2161.3-156.60000122.5
694V25.9Very low29.1Very low135 Ų135124 Ų12482%0.81876%0.763SS**  trans-9.9143.5143.2-151.20000116.2
695S27.4Very low29.1Very low108 Ų108125 Ų12576%0.75577%0.767SS**  -161.2177.352.165.20000118
696S30.3Very low29.1Very low101 Ų101127.9 Ų127.971%0.70677%0.772SS**  trans-57.3168.9173.955.30000116.1
697T29.7Very low29.6Very low129 Ų129124.2 Ų124.279%0.79176%0.762SS**  cis-145.4168.728.240.40000114.4
698P39Very low29.5Very low110 Ų110125 Ų12571%0.71476%0.762SS**  trans-107.1162.6177.240.1-33.6000115
699N31.3Very low29.4Very low142 Ų142121.3 Ų121.376%0.75975%0.754SS**  trans178137.4135.1-103.8-19.4000115.4
700T30.1Very low29.3Very low123 Ų123122 Ų12276%0.75576%0.758SS**  trans63.1150.1142.662.70000119.7
701V26.7Very low29.2Very low109 Ų109119.7 Ų119.766%0.66175%0.754SS**  cis-167.2141.621100000110.6
702I27.2Very low29.3Very low144 Ų144122.7 Ų122.774%0.73875%0.752SS**  trans58.7143.6141.4-69.1173.7000118.8
703D28.1Very low29.8Very low123 Ų123124.9 Ų124.966%0.65876%0.755SS**  cis-153.4174.116-140.51.6000115.1
704N26.3Very low29.8Very low133 Ų133126.2 Ų126.271%0.71176%0.757SS**  trans11.3152151.7-61.1-44.5000122
705I28.1Very low30.2Very low162 Ų162126.8 Ų126.883%0.83176%0.76SS**  cis-155158.344.6-68.8170.7000111.7
706T29.2Very low30.3Very low127 Ų127126 Ų12678%0.77975%0.748SS**  trans-123.8179.2175.445.70000112.5
707P37.6Very low30.4Very low118 Ų118129.7 Ų129.777%0.76675%0.754SS**  cis-134.1-166.8-4238.3-20.3000112.9
708S26.7Very low30.5Very low110 Ų110127.9 Ų127.977%0.76975%0.746SS**  trans139.4137.8130.1-163.40000117.2
709A29.5Very low30.1Very low86 Ų86132.3 Ų132.371%0.71175%0.749SS**  trans55.4153.4152.200000120.6
710N28.8Very low30.3Very low166 Ų166132.7 Ų132.789%0.88875%0.75SS**  cis-157.9171-7.7-133.8-16.6000110.5
711G31.4Very low30.4Very low63 Ų63130.3 Ų130.365%0.64974%0.743SS**  trans117.980150.100000120.7
712N31Very low30.8Very low141 Ų141128.1 Ų128.175%0.75474%0.736SS**  trans13.9135.5141.1-53-10.5000121.6
713N35Very low31Very low168 Ų168123.2 Ų123.290%0.89872%0.721SS**  -164.6161.6107.5-103.7-46.3000114
714I27.7Very low31.3Very low153 Ų153120.4 Ų120.479%0.78572%0.715SS**  trans-114137.9-161.1-62.6162.8000112
715V32.3Very low31.9Very low146 Ų146121.8 Ų121.889%0.88572%0.715SS**  trans-138138.4160.1-177.10000109.7
716D30.9Very low32.3Very low92 Ų92116.6 Ų116.649%0.49270%0.696SS.*  trans-81.1119-165.5177.426.1000114.3S718D716-S718 WeakPolarHBondContact OD1-CB 3.18Å; D716-S718 PolarHBondContact OD1-N 2.79Å; D716-S718 PolarHBondContact OD1-OG 2.72Å
717Q32.9Very low32.7Very low179 Ų179117.4 Ų117.484%0.83669%0.689SS**  trans-86.3-6174.1-71.4-167.9-6.400114.1R719 L720Q717-R719 PolarHBondContact O-N 2.99Å; Q717-L720 PolarHBondContact O-N 3.11Å
718S31.6Very low32.6Very low90 Ų90118.5 Ų118.563%0.62968%0.682SS**Hα-helixtrans-63.2-12.6-171.5-48.80000114.6D716D716-S718 WeakPolarHBondContact OD1-CB 3.18Å; D716-S718 PolarHBondContact OD1-N 2.79Å; D716-S718 PolarHBondContact OD1-OG 2.72Å
719R30.7Very low33.6Very low203 Ų203118.9 Ų118.977%0.76667%0.672SS**Hα-helixtrans-91.9-20.5-174.7-68.4-173.8170.2-131.9-4.8115.5Q717 G723Q717-R719 PolarHBondContact O-N 2.99Å; R719-G723 PolarHBondContact O-N 2.87Å
720L33.8Very low34Very low151 Ų151117.2 Ų117.279%0.79166%0.658SS**Hα-helixtrans-77.9-38.1179.5-107.973000112.9Q717 A722 G723 A724Q717-L720 PolarHBondContact O-N 3.11Å; L720-A722 VanDerWaalsContact C-N 3.34Å; L720-A722 PolarHBondContact O-N 3.45Å; L720-G723 PolarHBondContact O-N 3Å; L720-G723 VanDerWaalsContact O-N 3.12Å; L720-A724 PolarHBondContact O-N 3.21Å
721A33.8Very low34.6Very low73 Ų73113 Ų11360%0.60363%0.633SS**Hα-helixtrans-61.9-41.417900000112.1G723 A724 F725A721-G723 VanDerWaalsContact C-N 3.34Å; A721-G723 PolarHBondContact O-N 3.31Å; A721-A724 PolarHBondContact O-N 3.37Å; A721-F725 PolarHBondContact O-N 3.43Å; A721-F725 VanDerWaalsContact O-N 3.09Å
722A33.5Very low35.4Very low62 Ų62115.3 Ų115.351%0.51263%0.627SS.*Hα-helixtrans-63.1-38.5173.300000112.3L720 F725 A726L720-A722 VanDerWaalsContact C-N 3.34Å; L720-A722 PolarHBondContact O-N 3.45Å; A722-F725 PolarHBondContact O-N 2.93Å; A722-A726 VanDerWaalsContact O-CB 3.28Å; A722-A726 WeakPolarHBondContact O-CB 3.41Å; A722-A726 PolarHBondContact O-N 3.22Å
723G32.4Very low36.1Very low42 Ų42113.7 Ų113.743%0.43362%0.615SS.*Hα-helixtrans-64.4-42.7176.200000113.3R719 L720 A721 A726 F727R719-G723 PolarHBondContact O-N 2.87Å; L720-G723 PolarHBondContact O-N 3Å; L720-G723 VanDerWaalsContact O-N 3.12Å; A721-G723 VanDerWaalsContact C-N 3.34Å; A721-G723 PolarHBondContact O-N 3.31Å; G723-A726 PolarHBondContact O-N 2.89Å; G723-F727 WeakPolarHBondContact O-CB 3.46Å; G723-F727 PolarHBondContact O-N 3.33Å
724A34.7Very low36.4Very low63 Ų63111.7 Ų111.752%0.52160%0.604SS.*Hα-helixtrans-65.9-41.217600000112.2L720 A721 F727 F728L720-A724 PolarHBondContact O-N 3.21Å; A721-A724 PolarHBondContact O-N 3.37Å; A724-F727 PolarHBondContact O-N 3.34Å; A724-F728 PolarHBondContact O-N 2.99Å
725F37.5Very low37Very low162 Ų162110.1 Ų110.171%0.71159%0.594SS**Hα-helixtrans-66.3-41.5176.7-136.6-88.9000111.8A721 A722 F728 Q729A721-F725 PolarHBondContact O-N 3.43Å; A721-F725 VanDerWaalsContact O-N 3.09Å; A722-F725 PolarHBondContact O-N 2.93Å; F725-F728 PolarHBondContact O-N 3.5Å; F725-Q729 VanDerWaalsContact O-CB 3.3Å; F725-Q729 WeakPolarHBondContact O-CB 3.5Å; F725-Q729 PolarHBondContact O-N 3.4Å
726A37.6Very low37.5Very low54 Ų54107.9 Ų107.945%0.44658%0.577SS.*Hα-helixtrans-64.9-37.8173.500000112.2A722 G723 A730A722-A726 VanDerWaalsContact O-CB 3.28Å; A722-A726 WeakPolarHBondContact O-CB 3.41Å; A722-A726 PolarHBondContact O-N 3.22Å; G723-A726 PolarHBondContact O-N 2.89Å; A726-A730 WeakPolarHBondContact O-CB 3.07Å; A726-A730 PolarHBondContact O-N 2.93Å
727F36.5Very low37.8Very low143 Ų143106.6 Ų106.663%0.62758%0.58SS**Hα-helixtrans-64.8-44.5174.8-175-89.5000111.8G723 A724 A730 Q731G723-F727 WeakPolarHBondContact O-CB 3.46Å; G723-F727 PolarHBondContact O-N 3.33Å; A724-F727 PolarHBondContact O-N 3.34Å; F727-A730 PolarHBondContact O-N 3.15Å; F727-Q731 WeakPolarHBondContact O-CB 3.03Å; F727-Q731 PolarHBondContact O-N 3.31Å
728F37.2Very low37.9Very low142 Ų142102.2 Ų102.262%0.62357%0.574SS**Hα-helixtrans-68.3-38.7177.6-130.4-88.4000112.1A724 F725 Q731 Q732A724-F728 PolarHBondContact O-N 2.99Å; F725-F728 PolarHBondContact O-N 3.5Å; F728-Q731 PolarHBondContact O-N 3.17Å; F728-Q732 WeakPolarHBondContact O-CB 3.37Å; F728-Q732 PolarHBondContact O-N 2.84Å
729Q46.5Very low38.5Very low118 Ų118106 Ų10655%0.55158%0.582SS**Hα-helixtrans-65.4-39.6173.3-170.7171.344.700111.6F725 Q733F725-Q729 VanDerWaalsContact O-CB 3.3Å; F725-Q729 WeakPolarHBondContact O-CB 3.5Å; F725-Q729 PolarHBondContact O-N 3.4Å; Q729-Q733 WeakPolarHBondContact O-CB 3.41Å; Q729-Q733 VanDerWaalsContact O-CG 3.23Å; Q729-Q733 WeakPolarHBondContact O-CG 3.29Å; Q729-Q733 PolarHBondContact O-N 3.08Å
730A39.2Very low38.5Very low51 Ų51104.3 Ų104.342%0.42158%0.583SS.*Hα-helixtrans-67.4-36.2173.300000112.1A726 F727 Q733 L734A726-A730 WeakPolarHBondContact O-CB 3.07Å; A726-A730 PolarHBondContact O-N 2.93Å; F727-A730 PolarHBondContact O-N 3.15Å; A730-Q733 CarbonylContact O-C 3.53Å; A730-Q733 PolarHBondContact O-N 3.45Å; A730-L734 VanDerWaalsContact O-CB 3.29Å; A730-L734 WeakPolarHBondContact O-CB 3.33Å; A730-L734 PolarHBondContact O-N 3.02Å
731Q41.2Very low38.4Very low76 Ų76105.9 Ų105.936%0.35559%0.586SS.*Hα-helixtrans-70.6-39176.5-170.4172.9900111.8F727 F728 Q733 L734 M735F727-Q731 WeakPolarHBondContact O-CB 3.03Å; F727-Q731 PolarHBondContact O-N 3.31Å; F728-Q731 PolarHBondContact O-N 3.17Å; Q731-Q733 VanDerWaalsContact C-N 3.34Å; Q731-L734 PolarHBondContact O-N 3.24Å; Q731-M735 PolarHBondContact O-N 3.39Å
732Q47.2Very low38.4Very low112 Ų112113.3 Ų113.352%0.52360%0.598SS.*Hα-helixtrans-61.5-42.8169.9-168.67475.600111F728 N736F728-Q732 WeakPolarHBondContact O-CB 3.37Å; F728-Q732 PolarHBondContact O-N 2.84Å; Q732-N736 WeakPolarHBondContact O-CB 3.25Å; Q732-N736 PolarHBondContact O-N 2.82Å; Q732-N736 VanDerWaalsContact O-N 3.1Å; Q732-N736 PolarHBondContact O-OD1 2.79Å
733Q45.9Very low38.5Very low107 Ų107118.9 Ų118.950%0.561%0.613SS.*Hα-helixtrans-67.3-34173.7-73.7169.91.900112.5Q729 A730 Q731 N736 A737Q729-Q733 WeakPolarHBondContact O-CB 3.41Å; Q729-Q733 VanDerWaalsContact O-CG 3.23Å; Q729-Q733 WeakPolarHBondContact O-CG 3.29Å; Q729-Q733 PolarHBondContact O-N 3.08Å; A730-Q733 CarbonylContact O-C 3.53Å; A730-Q733 PolarHBondContact O-N 3.45Å; Q731-Q733 VanDerWaalsContact C-N 3.34Å; Q733-N736 PolarHBondContact O-N 2.96Å; Q733-A737 WeakPolarHBondContact O-CB 3.25Å; Q733-A737 PolarHBondContact O-N 2.96Å
734L41Very low38.4Very low127 Ų127121.6 Ų121.667%0.66563%0.625SS**Hα-helixtrans-71.4-42.4179.3-160.479000111.7A730 Q731 N736 A737 A738A730-L734 VanDerWaalsContact O-CB 3.29Å; A730-L734 WeakPolarHBondContact O-CB 3.33Å; A730-L734 PolarHBondContact O-N 3.02Å; Q731-L734 PolarHBondContact O-N 3.24Å; L734-N736 VanDerWaalsContact C-N 3.35Å; L734-A737 PolarHBondContact O-N 3.46Å; L734-A738 WeakPolarHBondContact O-CB 3.49Å; L734-A738 PolarHBondContact O-N 2.8Å
735M40.9Very low38.1Very low119 Ų119124 Ų12459%0.58663%0.634SS**Hα-helixtrans-64.2-40.2172.8-72.6-169.7175.400111.6Q731 A738Q731-M735 PolarHBondContact O-N 3.39Å; M735-A738 PolarHBondContact O-N 3.39Å
736N43.6Very low37.9Very low99 Ų99119 Ų11953%0.52962%0.623SS.*Hα-helixtrans-70.3-31.2176.2-66.75.7000112.5Q732 Q733 L734Q732-N736 WeakPolarHBondContact O-CB 3.25Å; Q732-N736 PolarHBondContact O-N 2.82Å; Q732-N736 VanDerWaalsContact O-N 3.1Å; Q732-N736 PolarHBondContact O-OD1 2.79Å; Q733-N736 PolarHBondContact O-N 2.96Å; L734-N736 VanDerWaalsContact C-N 3.35Å
737A36.4Very low37.5Very low66 Ų66122.8 Ų122.855%0.54563%0.634SS.*Hα-helixtrans-78.5-27.7176.900000113.3Q733 L734 Q739 Q740Q733-A737 WeakPolarHBondContact O-CB 3.25Å; Q733-A737 PolarHBondContact O-N 2.96Å; L734-A737 PolarHBondContact O-N 3.46Å; A737-Q739 PolarHBondContact O-N 3.48Å; A737-Q739 VanDerWaalsContact O-N 3.09Å; A737-Q740 PolarHBondContact O-N 3.27Å
738A35.8Very low37.2Very low86 Ų86120.2 Ų120.271%0.71163%0.634SS**THydrogen-bonded Turntrans-65.9-7.9179.200000114.3L734 M735L734-A738 WeakPolarHBondContact O-CB 3.49Å; L734-A738 PolarHBondContact O-N 2.8Å; M735-A738 PolarHBondContact O-N 3.39Å
739Q42.7Very low36.9Very low171 Ų171116.3 Ų116.380%0.79963%0.634SS**THydrogen-bonded Turntrans-1096.3-177.6-65-170.3-29.100114.7A737A737-Q739 PolarHBondContact O-N 3.48Å; A737-Q739 VanDerWaalsContact O-N 3.09Å
740Q32.4Very low36Very low167 Ų167112.7 Ų112.778%0.7863%0.629SS**  trans-131.751.9-173.2-64.7-166-11.800115.2A737A737-Q740 PolarHBondContact O-N 3.27Å
741Q31.4Very low35.5Very low184 Ų184114 Ų11486%0.8664%0.635SS**  trans-136.5144.6162.7-73.7-160.5-8.800113.5
742R32.9Very low34.9Very low228 Ų228115.8 Ų115.886%0.8665%0.65SS**  trans75.2140.1-173.9-47.3-179.5-178.8-179.61.6115.6
743H36.7Very low34Very low180 Ų180115.2 Ų115.283%0.83366%0.655SS**  cis-164.3175.1-33.3-102.2-44000107.5
744S29.5Very low33.1Very low98 Ų98113.7 Ų113.769%0.68566%0.656SS**  trans-135.1168.6-174.2-470000112.7
745T29.1Very low32.5Very low114 Ų114113.6 Ų113.670%0.69966%0.656SS**  trans77.4149.4169.172.50000117T156T156-T745 VanDerWaalsContact OG1-CA 3.3Å; T156-T745 WeakPolarHBondContact OG1-CA 3.31Å
746A31.6Very low31.9Very low57 Ų57114.3 Ų114.347%0.47166%0.662SS.*  cis-153.5143-11.300000113.1T156T156-A746 WeakPolarHBondContact OG1-CA 3.32Å; T156-A746 PolarHBondContact OG1-N 3.02Å
747L31Very low31.3Very low133 Ų133114.5 Ų114.570%0.69667%0.671SS**  trans42.1133.3150.4-61.4165.3000122.9
748S30.2Very low31.1Very low89 Ų89116.1 Ų116.162%0.62268%0.679SS**  166.9136111.749.20000117.7
749G29.1Very low30.8Very low61 Ų61118.9 Ų118.963%0.62968%0.681SS**  59.5125.712800000125S160 N161S160-G749 PolarHBondContact OG-O 2.96Å; N161-G749 PolarHBondContact ND2-O 3.41Å
750G28.7Very low30.1Very low42 Ų42115.5 Ų115.543%0.43368%0.675SS.*  trans154.775.7156.200000118.3N161 C162N161-G750 WeakPolarHBondContact CB-O 3.36Å; N161-G750 PolarHBondContact ND2-N 3.49Å; C162-G750 WeakPolarHBondContact CB-O 3.41Å
751S27.7Very low30.1Very low78 Ų78114.9 Ų114.955%0.54568%0.676SS.*  trans-58.1164.3176.2-1610000113.7S163S163-S751 PolarHBondContact OG-OG 3.39Å
752V28.3Very low29.9Very low113 Ų113110.2 Ų110.269%0.68567%0.669SS**  178.5133.796.9145.70000113.2
753V28.3Very low30Very low101 Ų101104.7 Ų104.761%0.61266%0.663SS**  trans53.3118146.1177.20000119.8
754S27.4Very low29.6Very low75 Ų75102.4 Ų102.452%0.52466%0.661SS.*  68.3162.474.8-28.80000115.3
755N28.7Very low29.7Very low124 Ų124103.1 Ų103.166%0.66366%0.662SS**  cis-163.6156.917.1-141.32000112.9
756N29.1Very low29.7Very low134 Ų134103.3 Ų103.372%0.71766%0.662SS**  trans40.9146.4141.2-66.2-9000122.1
757S30.1Very low29.6Very low103 Ų103105.8 Ų105.872%0.7268%0.677SS**  -176.4163.363.443.20000115.7
758S31.5Very low29.6Very low101 Ų101104.9 Ų104.971%0.70668%0.681SS**  trans83.9149.2178-48.50000115
759N31.3Very low29.7Very low143 Ų143106.7 Ų106.777%0.76569%0.689SS**  cis-171157.4-20.9-103.4-22.2000108.2
760C27.9Very low30Very low100 Ų100108.5 Ų108.568%0.67669%0.689SS**  cis-168.4172.1-21.7-142.40000108.9
761I31.4Very low30.1Very low155 Ų155114 Ų11480%0.79571%0.708SS**  trans65.1108.4163.5-58.7159000114.6
762A27.2Very low30.3Very low86 Ų86116.5 Ų116.571%0.71172%0.72SS**  cis68.3155.645.300000114.5
763P35.6Very low30.5Very low112 Ų112115.9 Ų115.973%0.72772%0.72SS**  cis-116.4159.4-3.111.814.9000113.8
764T28.8Very low30.9Very low131 Ų131115.4 Ų115.480%0.80472%0.72SS**  84155.169.3-40.50000116.4
765V30.5Very low31.2Very low114 Ų114120.3 Ų120.369%0.69173%0.732SS**  trans116.683.4152.1-169.80000120.5
766T29.2Very low31.3Very low117 Ų117120 Ų12072%0.71873%0.734SS**  trans65.1149132.665.60000127.4
767S30.2Very low31.4Very low110 Ų110118.2 Ų118.277%0.76973%0.733SS**  trans78.8149.1141.567.60000120
768S31.3Very low31.2Very low113 Ų113118.2 Ų118.279%0.7973%0.733SS**  cis-162.6168.5-8.536.30000113
769T31.8Very low31.1Very low128 Ų128119.3 Ų119.379%0.78573%0.734SS**  trans-89.5-160.7175.4580000111.3
770P35.9Very low30.9Very low99 Ų99118.6 Ų118.664%0.64374%0.735SS**  cis-144.1-156.4030.1-1.6000116.2
771L30.4Very low31Very low156 Ų156119.8 Ų119.882%0.81774%0.74SS**  trans86.2146160.2-49.3172.7000117.1
772V31.8Very low30.9Very low131 Ų131119.5 Ų119.579%0.79474%0.739SS**  cis-151.6169-3.3105.70000112.7
773S31.5Very low31.3Very low100 Ų100120.8 Ų120.870%0.69974%0.741SS**  trans-106.7-152-176.760.10000111.6
774P37.5Very low30.9Very low92 Ų92119.9 Ų119.960%0.59774%0.737SS**  cis-142.4-149.84.643.5-19.9000116.1
775F32.7Very low30.7Very low178 Ų178120.3 Ų120.378%0.78173%0.734SS**  trans91.792.1174.2-58-69.9000116.5
776T31.8Very low30.6Very low117 Ų117124 Ų12472%0.71874%0.737SS**  75.1142.967.565.30000114.4
777S30.3Very low30.5Very low97 Ų97127.2 Ų127.268%0.67874%0.742SS**  cis-168.8137.7-7-104.70000108.8
778S27.4Very low30.4Very low103 Ų103125.8 Ų125.872%0.7274%0.744SS**  78159.795.3-46.10000116.7
779V28.9Very low30.4Very low123 Ų123123.9 Ų123.975%0.74574%0.743SS**  trans73.6121.3173.9-1580000113.4
780V26.3Very low30.4Very low129 Ų129124.5 Ų124.578%0.78274%0.74SS**  cis84.1155.236.5-173.70000113.1
781T29.7Very low30.3Very low125 Ų125129.4 Ų129.477%0.76775%0.747SS**  trans85.4131.8175.973.40000118.9
782N29.9Very low30.5Very low148 Ų148126.3 Ų126.379%0.79174%0.739SS**  trans-91.8146.3154.4-162.615.3000105.3
783P35.1Very low30.7Very low113 Ų113125.8 Ų125.873%0.73474%0.741SS**  -153-173.984.141.9-22.7000116
784S27.6Very low30.8Very low93 Ų93124.3 Ų124.365%0.6574%0.741SS**  trans-56.3166.5178-38.20000117.7
785N26Very low30.5Very low141 Ų141125.3 Ų125.375%0.75475%0.751SS**  trans113124.4139.9-73.4-15.8000120.5
786Y26.4Very low30.5Very low191 Ų191122.7 Ų122.775%0.74975%0.749SS**  trans94.2108.8135.3-87.1-132000122.1
787F27.3Very low30.3Very low185 Ų185123.6 Ų123.681%0.81175%0.754SS**  101.4124.6124.9-106.2-109.3000122.8
788G28.8Very low30.2Very low80 Ų80122.5 Ų122.583%0.82576%0.758SS**  trans76.3134162.400000116
789G30.5Very low30.2Very low73 Ų73120.9 Ų120.975%0.75376%0.758SS**  cis165158.2-100000108.3
790L32.3Very low30.1Very low141 Ų141123.4 Ų123.474%0.73877%0.766SS**  cis-159.1165.83.1-95.5162.5000109.8
791Y33.5Very low30.3Very low202 Ų202124.7 Ų124.779%0.79277%0.769SS**  trans75.4133161.4-60-57000120.3
792S34Very low30.5Very low90 Ų90124.3 Ų124.363%0.62977%0.768SS**  cis-162.4148.9-16.5-1500000114
793S36.3Very low30.3Very low120 Ų120120.5 Ų120.584%0.83976%0.764SS**  trans52134.9149.2-47.10000120.3
794G34.1Very low29.9Very low69 Ų69122.4 Ų122.471%0.71177%0.768SS**  cis172.5132.7-4.600000107.1
795S32.4Very low29.9Very low114 Ų114127 Ų12780%0.79778%0.777SS**  63.7139.166.5-137.70000112.5
796V31Very low30Very low123 Ų123125.3 Ų125.375%0.74578%0.776SS**  cis-152146.741.7175.90000113.7
797V29.3Very low30.4Very low136 Ų136122.7 Ų122.782%0.82477%0.773SS**  trans-3.7153.4142.4-168.70000117.7
798G27.7Very low30.7Very low73 Ų73119.4 Ų119.475%0.75377%0.771SS**  cis137.9149.713.300000107.6
799G27.2Very low30.7Very low70 Ų70122.3 Ų122.372%0.72277%0.767SS**  143.1176.35300000108.9
800L27.2Very low30.7Very low176 Ų176122.3 Ų122.392%0.92177%0.767SS**  trans67.8144.3-178.8-45.9176.3000114
801N29.3Very low30.4Very low156 Ų156122.2 Ų122.283%0.83477%0.766SS**  cis-161.9168.944.8-151.123.2000110.5
802P33.7Very low30.1Very low116 Ų116119 Ų11975%0.75376%0.763SS**  trans-112.2163.8-176.439.8-31.1000116.1
803G27.2Very low29.8Very low69 Ų69121.6 Ų121.671%0.71177%0.769SS**  trans128.4119.3145.800000120.2
804N26.7Very low29.9Very low152 Ų152122.9 Ų122.981%0.81377%0.765SS**  trans58.1165.7145.5-73.58.3000123.3
805F26.7Very low29.8Very low191 Ų191125 Ų12584%0.83877%0.766SS**  trans73.7134.2173.6-62.3-85.3000116.6
806S29.2Very low29.8Very low105 Ų105124.5 Ų124.573%0.73476%0.761SS**  cis-158.6162.3-13.5-142.30000112.9
807I33Very low29.5Very low135 Ų135125.1 Ų125.169%0.69276%0.764SS**  trans-96.3150170.4-39.2169000109.1
808P35.2Very low29.4Very low117 Ų117121.3 Ų121.376%0.7675%0.753SS**  -129.2140.51116.215.5000111.3
809N28.7Very low29.3Very low140 Ų140125.7 Ų125.775%0.74976%0.758SS**  65.1118.360.1-65.9-19.6000113
810G29Very low29.3Very low73 Ų73130.6 Ų130.675%0.75377%0.767SS**  trans166.559-176.800000112.6
811I27.1Very low29.4Very low139 Ų139130.1 Ų130.171%0.71376%0.76SS**  71.6103.885.6-65.4171.9000112.4
812N26.5Very low29.6Very low135 Ų135127.2 Ų127.272%0.72275%0.749SS**  trans69.9159.6144.4-68.70.1000119.2
813L27.7Very low29.2Very low144 Ų144130.2 Ų130.275%0.75475%0.753SS**  cis-150.4141.7-5.8-121158.3000109.3
814L38.5Very low29.3Very low147 Ų147129.8 Ų129.877%0.7774%0.743SS**  trans-57152.5148.3-91162.4000108.5
815P31.9Very low29.3Very low113 Ų113128.9 Ų128.973%0.73475%0.748SS**  -152.8-143.57545.9-22.6000112.3
816P33.2Very low29.4Very low105 Ų105123.1 Ų123.168%0.68274%0.743SS**  -134.5-151.2-12535.5-8.5000113
817V25.5Very low29.8Very low135 Ų135123.7 Ų123.782%0.81875%0.747SS**  trans73.8142.7170.6-165.90000113.1
818G26.9Very low30.2Very low57 Ų57122.1 Ų122.159%0.58875%0.746SS**  cis-143166.81.600000111.5
819L24.3Very low30Very low165 Ų165123.3 Ų123.386%0.86475%0.746SS**  46.29283.1-70.3168.8000112.7
820L27.1Very low30.1Very low172 Ų172121 Ų12190%0.90174%0.741SS**  -171.9122.9108.9-96.9162.2000112.3
821H30.8Very low30.2Very low166 Ų166124.3 Ų124.377%0.76975%0.746SS**  trans-62.6164.7146.8-132.4-115.7000107.8
822P33.3Very low30.4Very low95 Ų95121.9 Ų121.962%0.61775%0.747SS**  cis-150.8-171.524.146-26.2000116.5
823E25.7Very low30.8Very low179 Ų179118.7 Ų118.784%0.83675%0.746SS**  trans62.4174.1145.6-65.1-104.511900118.4
824A27.8Very low30.8Very low61 Ų61118.9 Ų118.950%0.50475%0.748SS.*  cis-165.8164.8-46.900000108.4
825S27.9Very low30.3Very low132 Ų132117.3 Ų117.392%0.92374%0.744SS**  trans65.2148.517677.60000116.6
826G28.3Very low30.2Very low70 Ų70116.6 Ų116.672%0.72274%0.741SS**  cis-171155-6.800000115
827S37.2Very low29.8Very low117 Ų117115.7 Ų115.782%0.81874%0.738SS**  trans-37.4161.9148.8-47.40000112.1
828P41.8Very low29.8Very low102 Ų102119.5 Ų119.566%0.66274%0.739SS**  cis-160.6-172.149.244.5-21.8000119.9
829N30.8Very low29.7Very low142 Ų142121.5 Ų121.576%0.75974%0.744SS**  trans82.8146.8142.2-78.3-12.8000120.1
830S31.1Very low29.8Very low93 Ų93124.9 Ų124.965%0.6575%0.745SS**  cis-175.7-173.7-23.7-114.90000110.9
831V31.9Very low30Very low141 Ų141125 Ų12586%0.85574%0.743SS**  trans87.9133.1155.1-169.30000116
832A31.2Very low30.1Very low89 Ų89122.3 Ų122.374%0.73674%0.74SS**  cis-173.1176.9-26.500000107.9
833G33.1Very low29.7Very low68 Ų68124.9 Ų124.970%0.70175%0.747SS**  trans114.975172.400000113.4
834D29Very low29.7Very low148 Ų148121.4 Ų121.479%0.79174%0.742SS**  63.5131.953.3-76.6-14.3000113.4
835V28.4Very low29.8Very low114 Ų114127 Ų12769%0.69176%0.759SS**  cis-160.6146.4-0.790.50000113.8
836S28.5Very low30.7Very low97 Ų97126.5 Ų126.568%0.67875%0.752SS**  trans64.1169.7146.7-75.90000122.8
837S26.2Very low31Very low87 Ų87129 Ų12961%0.60876%0.756SS**  cis-179.2172.5-32.3-85.80000108.9
838Y25.1Very low30.7Very low215 Ų215126.7 Ų126.784%0.84375%0.75SS**  trans79.6126.3149.2-80.1-64.9000121.3
839S25.1Very low30.1Very low98 Ų98126.2 Ų126.269%0.68575%0.754SS**  trans90.8100.7130.2-69.70000121.9
840R24.6Very low29.9Very low237 Ų237127.7 Ų127.789%0.89476%0.761SS**  84.1127.1107.6-153-179.7-158.1-1745.4119
841M32.3Very low29.7Very low174 Ų174127 Ų12786%0.85776%0.761SS**  trans-24.8149.7153.4-77.4177.7166.300115.9
842P33.6Very low29.5Very low109 Ų109126.9 Ų126.971%0.70876%0.761SS**  -157.3160.159.942-20.9000121.8
843I24.8Very low29.3Very low149 Ų149127.7 Ų127.776%0.76476%0.761SS**  trans39.4123.5130.8-49.5165.1000121.5
844S25.7Very low29.1Very low106 Ų106132.6 Ų132.674%0.74177%0.768SS**  trans150.7133.7138.6-65.90000109.8
845Q29.9Very low29.1Very low180 Ų180133.4 Ų133.484%0.84177%0.766SS**  cis68.4148.743.5-73.7-162.2-13.900115.7
846P46.5Very low29.2Very low120 Ų120135.1 Ų135.178%0.77977%0.77SS**  cis-109.7-143.3-24.841.8-27000108.9
847P34.9Very low29.4Very low124 Ų124135 Ų13581%0.80577%0.769SS**  cis-102.7-148.2-24.943-29.9000110.5
848G29.9Very low29.8Very low67 Ų67136.1 Ų136.169%0.69177%0.774SS**  cis108.7147.7-1.800000114.6
849A28.9Very low29.9Very low92 Ų92131.9 Ų131.976%0.7677%0.771SS**  cis-163.6172.1-0.900000114
850L27.7Very low30.7Very low174 Ų174132.4 Ų132.491%0.91178%0.775SS**  trans74.1148.1165-53.6177.5000118.6
851A26.7Very low31.2Very low78 Ų78127.3 Ų127.365%0.64577%0.772SS**  cis-169.4174.5-2300000112.1
852V27.8Very low31.1Very low139 Ų139124.8 Ų124.884%0.84277%0.772SS**  trans88.1105159.4-1670000118.3
853S26.9Very low31Very low105 Ų105123 Ų12373%0.73477%0.773SS**  trans-56.5172.5165.4-38.20000113.4
854M29.4Very low31.1Very low172 Ų172123.4 Ų123.485%0.84778%0.776SS**  cis-145.3139.146.7-59.2-172.9-16600110.7
855H28Very low31.3Very low164 Ų164126.7 Ų126.776%0.75978%0.78SS**  55.412284.1-133-100.2000111.5
856I31.4Very low31.3Very low150 Ų150129.1 Ų129.177%0.76978%0.781SS**  -145.5136.358.3-73.1151.6000112.3
857S32.1Very low30.9Very low96 Ų96128.1 Ų128.167%0.67178%0.775SS**  trans-101.6163.1157.3-50.10000109.2
858P34.5Very low31Very low109 Ų109126.9 Ų126.971%0.70877%0.767SS**  -152.8126.892.637-17000117.8
859T28Very low31.1Very low127 Ų127131 Ų13178%0.77977%0.772SS**  52123.5124.568.20000122.9
860S40.8Very low31.2Very low109 Ų109131.3 Ų131.376%0.76277%0.768SS**  trans-77.8150.6133.6-39.30000110.4
861P35.8Very low31.2Very low130 Ų130129 Ų12984%0.84476%0.761SS**  trans-101133167.434.1-27.2000112.3
862S30.5Very low31.2Very low121 Ų121130 Ų13085%0.84676%0.764SS**  trans-112156.3-176.9-560000112.9
863G30.3Very low31.2Very low72 Ų72130.2 Ų130.274%0.74277%0.766SS**  trans104174.1149.400000118
864L28.2Very low31.1Very low157 Ų157129 Ų12982%0.82277%0.769SS**  cis-165.1175.8-4.3-121.9172.5000111.7
865Q28.7Very low30.9Very low175 Ų175130.8 Ų130.882%0.81877%0.773SS**  trans68.4115.5168.4-66.1165-23.400116.3
866R31.4Very low30.8Very low230 Ų230128.5 Ų128.587%0.86878%0.775SS**  cis70.7150.229-135.8-162.3-167.3-105.61.5113.1
867P37.8Very low30.6Very low99 Ų99126.2 Ų126.264%0.64377%0.773SS**  cis-118.7-140.1-7.644-26.1000110.5
868P36.4Very low30.3Very low98 Ų98126.6 Ų126.664%0.63678%0.782SS**  cis-133.3165.5-23.737-18.8000117.1
869L32.1Very low30.1Very low155 Ų155126.8 Ų126.881%0.81278%0.781SS**  trans31.5142.6136.8-53.8173.9000121.4
870S30.3Very low30.1Very low97 Ų97126.4 Ų126.468%0.67878%0.781SS**  cis-164.8-166.82.4-120.70000108.6
871V28.8Very low29.5Very low126 Ų126131 Ų13176%0.76478%0.782SS**  cis-155.6161.717-133.90000111.8
872S26.7Very low29.3Very low99 Ų99129.6 Ų129.669%0.69277%0.774SS**  trans56.1127.4145.9-70.90000125.8
873T26.2Very low29.2Very low144 Ų144132.1 Ų132.188%0.88377%0.77SS**  trans69.9113.7138.2550000121.8
874G26.1Very low29Very low78 Ų78136.3 Ų136.380%0.80478%0.775SS**  trans-179.9117.3159.700000111
875F24.6Very low29.1Very low210 Ų210137 Ų13792%0.92177%0.772SS**  trans-93.5168.4177.2-101.1-103.2000111.6
876S26.7Very low29Very low117 Ų117136.3 Ų136.382%0.81877%0.774SS**  trans85.1153.2178.1-29.40000114.3
877S27.1Very low28.9Very low102 Ų102128.9 Ų128.971%0.71376%0.762SS**  cis-147.4159.94.665.70000111.7
878A25.8Very low28.4Very low104 Ų104127.7 Ų127.786%0.8676%0.755SS**  trans-152.261.4170.500000110.7
879T28.8Very low28Very low112 Ų112129.9 Ų129.969%0.68776%0.759SS**PPolyproline II helixtrans-89134.5179.745.60000111.8
880P29.7Very low28Very low120 Ų120128 Ų12878%0.77975%0.746SS**PPolyproline II helixtrans-71.8142.217430.3-34.3000111.8
881Y28.2Very low28Very low204 Ų204127.7 Ų127.780%0.873%0.732SS**PPolyproline II helixtrans-77.5133.3179.1-64.4-91.8000112F883Y881-F883 PolarHBondContact O-N 3.34Å
882P29.9Very low28.1Very low102 Ų102127.2 Ų127.266%0.66273%0.726SS**  trans-81.4105.4163.431.7-29.6000109.6N884P882-N884 PolarHBondContact O-N 2.99Å
883F28.7Very low28.1Very low174 Ų174134.2 Ų134.276%0.76374%0.737SS**  trans-73113.3170.9-91.5-86000110.4Y881 F885Y881-F883 PolarHBondContact O-N 3.34Å; F883-F885 PolarHBondContact O-N 3.47Å
884N27Very low28.1Very low159 Ų159131.6 Ų131.685%0.8573%0.73SS**  trans-76.5118.9172-151.615.1000108.3P882P882-N884 PolarHBondContact O-N 2.99Å
885F29Very low28.1Very low173 Ų173137.8 Ų137.876%0.75974%0.735SS**  trans-132.687-175.6-137.3-72.2000110.8F883F883-F885 PolarHBondContact O-N 3.47Å
886D27.6Very low28.2Very low159 Ų159131.9 Ų131.985%0.8573%0.725SS**  trans-129.389171.8-176.111.4000108.7
887A29.1Very low28.1Very low75 Ų75131.1 Ų131.162%0.6273%0.726SS**  trans-166.4119.6169.600000112.6
888S28.3Very low28.1Very low73 Ų73130.6 Ų130.651%0.5173%0.728SS.*  trans58.2103.4145.4-154.50000120.7
889M27.7Very low28.1Very low144 Ų144134.7 Ų134.771%0.70973%0.726SS**  -111138.3114.8-96.6-68-163.900107.6E252E252-M889 HydrophobicContact CG-CE 3.74Å
890H32Very low28Very low117 Ų117134.5 Ų134.554%0.54274%0.736SS.*  trans-131122.9-168.1-126.365.7000110.2I250I250-H890 HydrophobicContact CD1-CB 4Å; I250-H890 HydrophobicContact CG1-CB 3.78Å; I250-H890 HydrophobicContact CG2-CB 4.25Å; I250-H890 WeakPolarHBondContact CG2-O 3.44Å
891K28.7Very low27.9Very low90 Ų90132.4 Ų132.439%0.39173%0.729SS.*  trans168.3138.1158.8-97.5154.9174.6160.60107.3I250 W314I250-K891 HydrophobicContact CG2-CD 3.74Å; I250-K891 VanDerWaalsContact CG2-CE 3.47Å; I250-K891 HydrophobicContact CG2-CG 3.96Å; I250-K891 PolarHBondContact O-NZ 3.44Å; W314-K891 VanDerWaalsContact CE2-CE 3.41Å
892N31.7Very low27.9Very low116 Ų116126.8 Ų126.862%0.6273%0.725SS**  cis-117168.56.7-80-31.3000113.2
893R26.8Very low27.9Very low245 Ų245128 Ų12893%0.92574%0.736SS**  trans-126.3107.2-174.2172.9-163.5-168.6-179.44.9109.4
894A26.4Very low28Very low90 Ų90123.3 Ų123.374%0.74474%0.737SS**  trans172.199.915400000111.9
895F27Very low28.2Very low207 Ų207122.8 Ų122.891%0.90874%0.739SS**  -169.3161.8102.5-124.6-96.1000109.7
896A25.3Very low28.3Very low87 Ų87118.5 Ų118.572%0.71974%0.735SS**  trans-147.8169.9-177.100000111.9
897A26Very low28.4Very low100 Ų100117.1 Ų117.183%0.82673%0.733SS**  trans85.5127.3173.900000118.2
898A25.2Very low28.5Very low92 Ų92120 Ų12076%0.7674%0.742SS**  trans51.6116.6150.800000121
899F26.9Very low28.7Very low189 Ų189120.1 Ų120.183%0.82975%0.748SS**  -138.8121.5115.1-135.4-90.3000111.5A901F899-A901 HydrophobicContact CE1-CB 4.39Å; F899-A901 WeakPolarHBondContact CE1-O 3.35Å
900A25.8Very low29.1Very low108 Ų108119.8 Ų119.889%0.89375%0.754SS**  trans-15350.3179.100000110.6
901A29Very low29.4Very low76 Ų76119.4 Ų119.463%0.62876%0.762SS**  trans-141.4157.9171.800000109.1F899F899-A901 HydrophobicContact CE1-CB 4.39Å; F899-A901 WeakPolarHBondContact CE1-O 3.35Å
902A28.6Very low30Very low87 Ų87119 Ų11972%0.71977%0.769SS**  trans-103.4153.1-17800000112.3
903S29Very low30.3Very low127 Ų127116.8 Ų116.889%0.88876%0.761SS**  trans41.2109150.1-52.30000119.7
904G31.6Very low30.8Very low76 Ų76107 Ų10778%0.78474%0.735SS**  trans169.868165.700000120
905V30.5Very low31.2Very low147 Ų147109.4 Ų109.489%0.89173%0.733SS**  trans32.9119.5135.4-176.50000121.5
906A30.6Very low31.6Very low83 Ų83102.9 Ų102.969%0.68672%0.724SS**  trans85.2105.6139.300000125.9
907V30Very low32.4Very low131 Ų131105.4 Ų105.479%0.79473%0.733SS**  46143.6127.1-135.50000125.1
908T31Very low32.8Very low134 Ų134107.7 Ų107.782%0.82273%0.732SS**  trans78.9147.9160.165.90000120.1
909A32.8Very low33.7Very low76 Ų76107.3 Ų107.363%0.62872%0.721SS**  cis-171.4139-28.600000113.4
910T36.5Very low34Very low138 Ų138104.7 Ų104.785%0.84772%0.716SS**  trans61.3164.9152.354.90000121.8
911P38.7Very low34.4Very low109 Ų109106.3 Ų106.371%0.70871%0.709SS**  -140.2177.1-53.242.2-25.3000116.4
912P40.6Very low34.6Very low81 Ų81113.8 Ų113.853%0.52672%0.721SS.*  trans-126.6162.6169.842.4-30.9000116A91A91-P912 WeakPolarHBondContact O-CA 3.41Å
913P39.1Very low35Very low70 Ų70114.3 Ų114.346%0.45572%0.717SS.*  -144.4-125.4102.441.5-26.3000119.7D89 D90 A91 L92D89-P913 WeakPolarHBondContact O-CG 3.5Å; D90-P913 VanDerWaalsContact C-CD 3.48Å; A91-P913 CarbonylContact C-O 3.07Å; A91-P913 PolarHBondContact N-O 2.98Å; L92-P913 WeakPolarHBondContact CD1-O 3.43Å; L92-P913 PolarHBondContact N-O 3.35Å
914G36.2Very low35.3Very low38 Ų38115 Ų11539%0.39272%0.716SS.*  trans-91.5-143.8-143.900000121.4D90D90-G914 WeakPolarHBondContact CB-O 3.4Å; D90-G914 VanDerWaalsContact CG-O 3.27Å; D90-G914 WeakPolarHBondContact OD1-CA 3.49Å; D90-G914 PolarHBondContact OD1-N 3.18Å
915M35.5Very low35.5Very low141 Ų141113.6 Ų113.670%0.69570%0.702SS**  cis-141.8-179.60.4-94.9174.1-6.300114.8D90D90-M915 VanDerWaalsContact CG-N 3.28Å; D90-M915 VanDerWaalsContact OD1-CB 3.3Å; D90-M915 WeakPolarHBondContact OD1-CB 3.16Å; D90-M915 WeakPolarHBondContact OD1-CG 3.12Å; D90-M915 PolarHBondContact OD1-N 3.4Å; D90-M915 VanDerWaalsContact OD1-N 3.15Å; D90-M915 VanDerWaalsContact OD2-CB 3.27Å; D90-M915 WeakPolarHBondContact OD2-CB 3.47Å; D90-M915 PolarHBondContact OD2-N 2.92Å; D90-M915 VanDerWaalsContact OD2-N 3.09Å
916G34.8Very low35.6Very low70 Ų70110.5 Ų110.572%0.72268%0.683SS**  trans-96.9-144.4176.400000115.4
917P41.3Very low35.8Very low140 Ų140110.6 Ų110.691%0.90967%0.672SS**  cis-136.8-136.119.743.1-21.9000116.2
918N36.4Very low36.1Very low149 Ų149111 Ų11180%0.79767%0.665SS**  trans-129.8-146-150.3-155.17000112.4
919P42.9Very low36.3Very low83 Ų83110.2 Ų110.254%0.53966%0.662SS.*  -113.6172.4-69.720.8-0.5000115.3
920N34.3Very low36.3Very low134 Ų134110.6 Ų110.672%0.71767%0.665SS**  167.8138.9112.4-90.8-57.9000118.8
921L32.7Very low36Very low143 Ų143111.4 Ų111.475%0.74966%0.664SS**  trans53.7105143.1-60.9168.8000124.1
922R34.1Very low35.6Very low232 Ų232114.2 Ų114.288%0.87567%0.672SS**  37.4157.7114.7-82.1-172.9141.5-163.8-3.4122.4
923P37.3Very low35.3Very low98 Ų98114.1 Ų114.164%0.63669%0.686SS**  cis-144.9-168.9-28.941-20.9000116.1
924T34.8Very low34.9Very low141 Ų141117.3 Ų117.387%0.86570%0.704SS**  trans76.8106.5156.952.50000123.4
925G34.9Very low34.8Very low48 Ų48127.3 Ų127.350%0.49573%0.73SS.*  132.585.4108.800000124.9K334K334-G925 PolarHBondContact NZ-O 3.25Å
926V33.9Very low34.7Very low81 Ų81124.4 Ų124.449%0.49173%0.729SS.*  53.5150.1127.1-79.30000126.9C333 K334C333-V926 HydrophobicContact CB-CB 4.29Å; C333-V926 HydrophobicContact CB-CG1 4.2Å; C333-V926 HydrophobicContact CB-CG2 3.62Å; C333-V926 VanDerWaalsContact O-CB 3.3Å; C333-V926 WeakPolarHBondContact O-CB 3.46Å; K334-V926 HydrophobicContact CB-CB 4.31Å; K334-V926 HydrophobicContact CB-CG2 3.63Å; K334-V926 HydrophobicContact CG-CG2 4.07Å; K334-V926 PolarHBondContact NZ-O 2.97Å
927N34.3Very low34.8Very low86 Ų86126.8 Ų126.846%0.4673%0.732SS.*  151.9165.9127.1-149.936.5000116C333 K334 D335C333-N927 PolarHBondContact O-OD1 3.22Å; C333-N927 VanDerWaalsContact O-OD1 3.07Å; K334-N927 HydrophobicContact CB-CB 3.79Å; K334-N927 PolarHBondContact N-OD1 3.17Å; D335-N927 VanDerWaalsContact CB-ND2 3.33Å; D335-N927 WeakPolarHBondContact CB-ND2 3.1Å; D335-N927 WeakPolarHBondContact OD2-CB 3.34Å; D335-N927 VanDerWaalsContact OD2-CG 3.32Å; D335-N927 PolarHBondContact OD2-ND2 3.26Å
928H35.1Very low34.5Very low139 Ų139126.4 Ų126.464%0.64473%0.726SS**  trans-107-173.7-169.3-92.3-47000114E332E332-H928 IonicContact OE1-CD2 2.74Å; E332-H928 IonicContact OE1-NE2 3.69Å
929P36.3Very low34.5Very low117 Ų117125 Ų12576%0.7673%0.725SS**  cis-147.3167.718.944.1-23000121.9
930A31.8Very low34.4Very low84 Ų84125.9 Ų125.969%0.69473%0.731SS**  trans33.3140.314300000126.4
931L30.6Very low34.7Very low156 Ų156125.4 Ų125.482%0.81774%0.735SS**  169142.3111.5-89.3165.3000117.1
932L31.2Very low34.7Very low168 Ų168125.5 Ų125.588%0.8874%0.736SS**  trans59.5138.3148.6-68.8162.8000124.3
933G33.1Very low34.7Very low79 Ų79122.1 Ų122.181%0.81473%0.732SS**  trans158.1113.3157.900000116.5
934T32.2Very low34.6Very low137 Ų137122.8 Ų122.884%0.8474%0.736SS**  trans-108.9159.5-167.956.40000117
935R32.7Very low34.2Very low247 Ų247121.9 Ų121.993%0.93273%0.73SS**  trans115.7139.9136.1-160.4169.4176.9168.9-1.7119.3
936A33.1Very low34Very low81 Ų81126 Ų12667%0.66975%0.745SS**  trans-108.6-163.9178.500000111.4
937P38.7Very low33.7Very low120 Ų120128.3 Ų128.378%0.77976%0.76SS**  cis-153.5-15731.840.1-13.2000118.2
938V35Very low33.4Very low131 Ų131127.5 Ų127.579%0.79477%0.772SS**  trans105.7125.1157.5-168.30000119.2
939P35.5Very low33.1Very low120 Ų120132.9 Ų132.978%0.77979%0.787SS**  trans-123.4-140.717736.1-13.5000114.7
940P41Very low32.9Very low101 Ų101132.6 Ų132.666%0.65679%0.788SS**  -126.8-168.2-107.143.8-25.6000115.3
941P39.6Very low33.1Very low124 Ų124134.8 Ų134.881%0.80580%0.795SS**  trans-108.9166.5158.637.3-28.9000114
942L33.8Very low32.9Very low146 Ų146130.4 Ų130.476%0.76479%0.787SS**  trans-143.2176.1-170.3-77.2169.8000113.3
943M33.7Very low32.8Very low160 Ų160130.2 Ų130.279%0.78879%0.786SS**  trans84.2156.2156.2-58.4-48-175.400119
944P34.7Very low32.6Very low112 Ų112134 Ų13473%0.72779%0.787SS**  cis-121.2149.9338.1-24.6000116.8
945V27.1Very low32.5Very low123 Ų123132.8 Ų132.875%0.74578%0.784SS**  trans-89.1145.3151.5169.70000108.2T947V945-T947 HydrophobicContact CG1-CG2 4.26Å
946V31Very low32.3Very low134 Ų134124.8 Ų124.881%0.81277%0.771SS**  trans-112.1110.9175179.30000110.6
947T27.4Very low32.3Very low129 Ų129127 Ų12779%0.79178%0.776SS**  trans-146.5120.7168.652.40000109.7V945V945-T947 HydrophobicContact CG1-CG2 4.26Å
948G27.9Very low31.8Very low70 Ų70128.9 Ų128.972%0.72277%0.774SS**  trans147.9115.2162.100000118.6
949R28Very low31.7Very low251 Ų251126.6 Ų126.695%0.94776%0.763SS**  trans65.6135.6134.7-71.6178.5162172.6-6.3122.1
950S32.3Very low31.4Very low112 Ų112128.5 Ų128.578%0.78376%0.762SS**  trans-54.9164.6158.8-13.60000113
951P35.6Very low30.8Very low130 Ų130129.7 Ų129.784%0.84477%0.768SS**  -152175.564.242.3-23.5000117.8
952G28.2Very low30.2Very low64 Ų64128.9 Ų128.966%0.6676%0.76SS**  119.8112.812900000120.5
953L28.2Very low29.8Very low163 Ų163129.4 Ų129.485%0.85376%0.759SS**  75.5125.9126.1-70.8165.8000122.6
954L28.1Very low29.5Very low159 Ų159129.4 Ų129.483%0.83276%0.757SS**  trans71.9135.4152.3-55.5162.9000116.5
955S30.2Very low29.4Very low112 Ų112129.2 Ų129.278%0.78376%0.758SS**  cis-147.7169.623.3-162.40000114.7
956A28.9Very low29.8Very low79 Ų79128.8 Ų128.865%0.65376%0.758SS**  trans-32.3165.4173.900000118
957V32.4Very low29.8Very low127 Ų127129.1 Ų129.177%0.7776%0.755SS**  cis-151.7146.346.6169.50000113.5
958H30.2Very low29.8Very low160 Ų160133.5 Ų133.574%0.74176%0.759SS**  trans-2.7151.6152.5-56.786.1000119.8
959S31.9Very low29.9Very low82 Ų82134 Ų13457%0.57376%0.756SS**  cis-158.3141.929.9-140.90000116.3
960Q29.3Very low29.9Very low160 Ų160127 Ų12775%0.74875%0.751SS**  trans58.8120.2138.1-67.1162.38.300120.8
961T27.6Very low29.6Very low127 Ų127125.2 Ų125.278%0.77974%0.744SS**  66.6120.379.1-37.40000111.4
962V27.2Very low29.2Very low107 Ų107126.3 Ų126.365%0.64874%0.742SS**  -179.3126.389.4153.10000109.9
963Q26.9Very low29.2Very low156 Ų156131 Ų13173%0.72975%0.746SS**  trans51.2166.3143.8-61.1175.1-2200120.3
964Q26.2Very low29.1Very low161 Ų161128 Ų12875%0.75274%0.739SS**  cis-155.5171.8-25.7-110.4163.10.300109.7
965S33.3Very low29.3Very low108 Ų108127.7 Ų127.776%0.75573%0.733SS**  trans-42.7166.2160.7-43.10000114.3
966P34.8Very low29.3Very low113 Ų113128.4 Ų128.473%0.73472%0.724SS**  cis-149.9-175.93144.1-23.1000119.1
967N31.2Very low29.3Very low141 Ų141130.7 Ų130.775%0.75473%0.725SS**  trans-59.4147.4162.9-47.7-59.4000112.7
968Y27.5Very low29.3Very low222 Ų222131.4 Ų131.487%0.87172%0.723SS**  trans-157127.3130.5-87.2-73.4000106.1
969A29.7Very low29.3Very low81 Ų81129.8 Ų129.867%0.66972%0.72SS**  cis77.9141.122.300000115.6
970A27.5Very low29.1Very low102 Ų102133.3 Ų133.384%0.84373%0.727SS**  trans73.9156179.700000117.3
971A26.1Very low29Very low76 Ų76136 Ų13663%0.62873%0.731SS**  cis-174.2150.1-31.400000110.7
972L28.8Very low29.4Very low152 Ų152136.8 Ų136.880%0.79673%0.729SS**  trans-162.5115.4137.1-90.1132.8000105
973Q27.9Very low29.6Very low163 Ų163137.8 Ų137.876%0.76274%0.738SS**  59.113276.2-60.9174.13300112.1
974S26.3Very low29.7Very low100 Ų100134.5 Ų134.570%0.69974%0.738SS**  cis-159.6176.6-9.457.20000106.6
975H31.1Very low30.4Very low153 Ų153132.1 Ų132.171%0.70874%0.736SS**  cis-174.6163.431.1-144.417.3000109.6
976Q30.7Very low30.2Very low127 Ų127134.1 Ų134.159%0.59374%0.738SS**  trans58.5112.3157.7-51.8-59.5-23.400118.7
977N28.9Very low29.9Very low126 Ų126135.5 Ų135.567%0.67474%0.738SS**  71.1133.489.9-88.3-40.8000115
978I32.4Very low30.1Very low142 Ų142133.9 Ų133.973%0.72874%0.738SS**  cis-145.8143.726.1-105.2138.5000112.6
979N30.2Very low30.5Very low127 Ų127129 Ų12968%0.67973%0.733SS**  trans24.7134.9154.2-47.9-27.3000121.2
980Q27.3Very low30.7Very low155 Ų155132.6 Ų132.672%0.72474%0.741SS**  cis63149.143.8-55.1-163.113.600113.8
981R27.5Very low31.2Very low216 Ų216132.4 Ų132.482%0.81573%0.731SS**  cis-160.2163.920.4-150.8173.1-122.1-152.4-2.5112.1
982L36.2Very low31.2Very low144 Ų144136 Ų13675%0.75474%0.739SS**  trans-74166.9164-65.281.8000111.2
983P30.3Very low31.1Very low128 Ų128134.4 Ų134.483%0.83174%0.735SS**  -149.9-179.1105.541.8-26.4000116
984A30.2Very low31.2Very low88 Ų88134.2 Ų134.273%0.72774%0.738SS**  trans-120.7-164.6160.600000108.1
985P41.4Very low31.3Very low110 Ų110134.8 Ų134.871%0.71474%0.743SS**  cis-124.4-164.8-43.527.7-5.6000112.1
986L28.5Very low31.4Very low150 Ų150130.9 Ų130.979%0.78574%0.744SS**  trans86.8128156.8-61.4170000122.4
987L29.3Very low31.5Very low143 Ų143131.5 Ų131.575%0.74976%0.757SS**  trans62.999.7137.6-65.1168.5000123.5
988S33.7Very low31.9Very low107 Ų107129.7 Ų129.775%0.74876%0.759SS**  58.5163.6128.267.10000122.4
989P37.3Very low32.1Very low119 Ų119128.4 Ų128.477%0.77376%0.762SS**  cis-128.2-162-21.436.6-16.3000113.9
990L33.2Very low32.6Very low157 Ų157127.2 Ų127.282%0.82276%0.764SS**  trans-44.4173.5167.6-69.5160000117.3
991P38.1Very low32.9Very low98 Ų98130.7 Ų130.764%0.63677%0.771SS**  cis-137.4-165.4-22.728.2-3.3000114.3
992L26.7Very low33.5Very low152 Ų152125.4 Ų125.480%0.79677%0.765SS**  trans74.5158161.8-47.3176000117.8
993T26.5Very low33.4Very low117 Ų117123.9 Ų123.972%0.71877%0.766SS**  cis-164.8146.2-28.929.90000111.7
994L28.6Very low33.7Very low159 Ų159122.5 Ų122.583%0.83276%0.759SS**  trans71.4150.5147.3-133.472.6000122.8
995S30.4Very low33.9Very low113 Ų113124.4 Ų124.479%0.7976%0.761SS**  trans70140.8162.6-57.20000117.3
996G31.2Very low33.6Very low71 Ų71125.7 Ų125.773%0.73277%0.767SS**  cis157.3166.50.400000108.8
997T34.2Very low33.7Very low140 Ų140121.6 Ų121.686%0.85976%0.761SS**  cis-150.5171-10.166.30000106.1
998A36.1Very low34.1Very low87 Ų87121.3 Ų121.372%0.71977%0.765SS**  cis-140.4-156.44.700000107.3
999S37.3Very low34Very low115 Ų115123.4 Ų123.480%0.80477%0.768SS**  cis-159.9170.42.6-139.40000107.4
1000S39.9Very low34.2Very low103 Ų103124.9 Ų124.972%0.7277%0.768SS**  cis-137.5-113.84.260.60000111.8
1001R34Very low34.3Very low227 Ų227123.7 Ų123.786%0.85777%0.767SS**  trans178.2174.7-169-110174177.7-165.1-2109.4
1002P39.7Very low34.4Very low106 Ų106125 Ų12569%0.68877%0.774SS**  cis-133.9162.9-11.929.6-8.4000116.1
1003S34.9Very low34.9Very low112 Ų112123.5 Ų123.578%0.78378%0.776SS**  trans33.8167.1130.6-32.50000122.9
1004S36.1Very low35.8Very low98 Ų98124.2 Ų124.269%0.68578%0.78SS**  cis-163.6145.39.983.80000115.5
1005V34.3Very low36.4Very low128 Ų128122.5 Ų122.578%0.77678%0.778SS**  trans75.8143.5131.8173.60000121.7
1006V36Very low37Very low137 Ų137124 Ų12483%0.8378%0.777SS**  trans64.3130.5-178.2-1470000116.4
1007G30Very low37.6Very low65 Ų65126.7 Ų126.767%0.6778%0.779SS**  cis129.1117.7-10.800000114.6
1008V38.6Very low38.1Very low137 Ų137123.4 Ų123.483%0.8376%0.758SS**  trans-171146.7158.5132.20000108.9
1009N32.3Very low38.2Very low151 Ų151124.3 Ų124.381%0.80776%0.755SS**  trans-83.6136.6177.5-69.7-17.1000112
1010I40.2Very low38.5Very low149 Ų149124.1 Ų124.176%0.76475%0.749SS**  trans-133.3118.2147.7-60.3-177.7000107.7T1012I1010-T1012 HydrophobicContact CG2-CG2 4.43Å
1011T36Very low38.8Very low133 Ų133121.4 Ų121.482%0.81673%0.728SS**  trans-101.1110.7175.848.10000110.3
1012T39.5Very low39.7Very low126 Ų126115.9 Ų115.977%0.77372%0.724SS**  trans-124.7113.7167.941.90000109.3I1010I1010-T1012 HydrophobicContact CG2-CG2 4.43Å
1013S37.5Very low41.3Very low120 Ų120114.8 Ų114.884%0.83972%0.72SS**PPolyproline II helixtrans-83.1121.7-176.251.70000112.1
1014T44.5Very low43.9Very low132 Ų132114.7 Ų114.781%0.8170%0.702SS**PPolyproline II helixtrans-96.5134.216143.40000109.8
1015P42Very low46.7Very low122 Ų122111.2 Ų111.279%0.79268%0.677SS**PPolyproline II helixtrans-75.6138.3178.730.7-33.8000111
1016L42.7Very low49.5Very low145 Ų145111.4 Ų111.476%0.75967%0.67SS**PPolyproline II helixtrans-91.1116.8179.7-149.7161.6000109V1018L1016-V1018 PolarHBondContact O-N 3.27Å
1017V44Very low52.2Low128 Ų128107 Ų10778%0.77664%0.642SS**  trans-73.9110.1-178.7178.60000109.7
1018V44.3Very low55.2Low70 Ų70104.1 Ų104.142%0.42461%0.611SS.*  trans-82.4115.1171.1178.60000108.5L1016 T1020L1016-V1018 PolarHBondContact O-N 3.27Å; V1018-T1020 PolarHBondContact O-N 2.61Å
1019T39.4Very low57.7Low106 Ų106100.1 Ų100.165%0.6558%0.583SS**  trans-70.5109.2167.945.20000109.3
1020T42.8Very low60.5Low111 Ų11196.2 Ų96.268%0.68156%0.562SS**  trans-71.2148173.151.80000111.5V1018V1018-T1020 PolarHBondContact O-N 2.61Å
1021V46.3Very low62.9Low46 Ų4689.5 Ų89.528%0.27953%0.527SS..  trans-33.8152.2148.8-95.20000113Q237 E238 S1023Q237-V1021 HydrophobicContact CB-CG1 3.96Å; Q237-V1021 HydrophobicContact CG-CG1 3.55Å; Q237-V1021 VanDerWaalsContact OE1-N 3.13Å; E238-V1021 HydrophobicContact CG-CG1 3.56Å; E238-V1021 WeakPolarHBondContact OE1-CA 3.37Å; V1021-S1023 PolarHBondContact O-N 3.25Å
1022S53.1Low65.5Low111 Ų11186.5 Ų86.578%0.77650%0.501SS*.  trans-72.266.4160-176.90000110.7E238E238-S1022 PolarHBondContact OE1-N 2.97Å
1023S72.7Confident67.7Low84 Ų8485.8 Ų85.859%0.58749%0.493SS*.PPolyproline II helixtrans-58.5138.3166.252.10000109.9V1021V1021-S1023 PolarHBondContact O-N 3.25Å
1024R90.4Very high69.6Low110 Ų11081.8 Ų81.842%0.41546%0.464SS..PPolyproline II helixtrans-55.7151.4172.9-60-170-16879.811.2110.7L1028 E1029 E1052 D1056R1024-L1028 HydrophobicContact CB-CB 4.4Å; R1024-L1028 HydrophobicContact CB-CD2 4.23Å; R1024-L1028 HydrophobicContact CB-CG 4.46Å; R1024-L1028 HydrophobicContact CG-CD2 4.06Å; R1024-E1029 HydrophobicContact CB-CB 4.48Å; R1024-E1029 WeakPolarHBondContact CD-OE2 3.31Å; R1024-E1029 IonicContact CZ-OE2 3.18Å; R1024-E1029 IonicContact NE-OE2 3.58Å; R1024-E1029 IonicContact NH1-OE2 2.72Å; R1024-E1029 PolarHBondContact NH1-OE2 2.89Å; R1024-E1052 WeakPolarHBondContact CA-OE1 3.08Å; R1024-D1056 IonicContact NE-OD1 3.83Å; R1024-D1056 PolarHBondContact NE-OD1 3.04Å
1025S94.6Very high70.8Confident24 Ų2478.4 Ų78.417%0.16845%0.446CS..PPolyproline II helixtrans-59.4153.1167.465.60000111L1027 L1028 E1029 H1049 E1052S1025-L1027 PolarHBondContact O-N 2.95Å; S1025-L1028 PolarHBondContact O-N 3.16Å; S1025-L1028 VanDerWaalsContact O-N 3.17Å; S1025-L1028 WeakPolarHBondContact OG-CB 3.04Å; S1025-L1028 PolarHBondContact OG-N 2.78Å; S1025-E1029 PolarHBondContact O-N 3.48Å; S1025-H1049 WeakPolarHBondContact CB-CE1 3.47Å; S1025-H1049 PolarHBondContact OG-ND1 3.1Å; S1025-E1052 WeakPolarHBondContact CB-OE2 3.37Å; S1025-E1052 PolarHBondContact N-OE1 3.37Å; S1025-E1052 VanDerWaalsContact OG-CD 3.3Å; S1025-E1052 PolarHBondContact OG-OE1 2.66Å; S1025-E1052 PolarHBondContact OG-OE2 2.74Å
1026Q92.1Very high72Confident132 Ų13276.2 Ų76.262%0.61744%0.438SS*.Hα-helixtrans-57.9-36.9175.3-168.863.54700111.1L1028 E1029 D1030Q1026-L1028 PolarHBondContact O-N 2.87Å; Q1026-E1029 PolarHBondContact O-N 2.93Å; Q1026-D1030 PolarHBondContact NE2-OD1 3.37Å; Q1026-D1030 VanDerWaalsContact O-CB 3.23Å; Q1026-D1030 WeakPolarHBondContact O-CB 3.43Å; Q1026-D1030 PolarHBondContact O-N 2.94Å
1027L92.7Very high73.1Confident46 Ų4678.4 Ų78.424%0.24144%0.437CS..Hα-helixtrans-59.9-45.8176.6-177.563.5000112.3S1025 F1031 M1041 L1046 H1049 F1053S1025-L1027 PolarHBondContact O-N 2.95Å; L1027-F1031 WeakPolarHBondContact O-CB 3.23Å; L1027-F1031 PolarHBondContact O-N 3.14Å; L1027-M1041 HydrophobicContact CD1-CE 3.89Å; L1027-L1046 HydrophobicContact CD2-CD2 4.19Å; L1027-H1049 HydrophobicContact CD2-CB 4.1Å; L1027-F1053 HydrophobicContact CD2-CE2 4.18Å; L1027-F1053 HydrophobicContact CD2-CZ 4.48Å; L1027-F1053 HydrophobicContact CG-CE2 4.02Å; L1027-F1053 HydrophobicContact CG-CZ 4.02Å
1028L93.3Very high74.3Confident3 Ų374.3 Ų74.32%0.01641%0.408CS..Hα-helixtrans-72.5-37.5178.7-179.659.4000112.3R1024 S1025 Q1026 F1031 R1032 E1052 F1053 D1056R1024-L1028 HydrophobicContact CB-CB 4.4Å; R1024-L1028 HydrophobicContact CB-CD2 4.23Å; R1024-L1028 HydrophobicContact CB-CG 4.46Å; R1024-L1028 HydrophobicContact CG-CD2 4.06Å; S1025-L1028 PolarHBondContact O-N 3.16Å; S1025-L1028 VanDerWaalsContact O-N 3.17Å; S1025-L1028 WeakPolarHBondContact OG-CB 3.04Å; S1025-L1028 PolarHBondContact OG-N 2.78Å; Q1026-L1028 PolarHBondContact O-N 2.87Å; L1028-F1031 HydrophobicContact CD1-CD1 4.44Å; L1028-F1031 PolarHBondContact O-N 3.23Å; L1028-R1032 HydrophobicContact CD1-CG 4.33Å; L1028-R1032 WeakPolarHBondContact O-CB 3.21Å; L1028-R1032 WeakPolarHBondContact O-CD 3.41Å; L1028-R1032 WeakPolarHBondContact O-CG 3.35Å; L1028-R1032 PolarHBondContact O-N 3.21Å; L1028-E1052 HydrophobicContact CD2-CG 3.81Å; L1028-E1052 WeakPolarHBondContact CD2-OE1 3.37Å; L1028-F1053 HydrophobicContact CB-CD2 4.15Å; L1028-F1053 HydrophobicContact CB-CE2 3.57Å; L1028-F1053 HydrophobicContact CB-CZ 4Å; L1028-F1053 HydrophobicContact CD1-CD1 3.98Å; L1028-F1053 HydrophobicContact CD1-CD2 3.9Å; L1028-F1053 HydrophobicContact CD1-CE1 3.87Å; L1028-F1053 HydrophobicContact CD1-CE2 3.8Å; L1028-F1053 HydrophobicContact CD1-CG 3.99Å; L1028-F1053 HydrophobicContact CD1-CZ 3.77Å; L1028-F1053 HydrophobicContact CG-CD2 4.45Å; L1028-F1053 HydrophobicContact CG-CE2 4.22Å; L1028-F1053 HydrophobicContact CG-CZ 4.5Å; L1028-D1056 HydrophobicContact CD1-CB 3.9Å; L1028-D1056 HydrophobicContact CD2-CB 3.8Å; L1028-D1056 HydrophobicContact CG-CB 4.41Å
1029E91.9Very high75.5Confident54 Ų5476.9 Ų76.925%0.25242%0.416SS..Hα-helixtrans-71.3-38.6178-161.457.7-127.900111.4R1024 S1025 Q1026 R1032 N1033R1024-E1029 HydrophobicContact CB-CB 4.48Å; R1024-E1029 WeakPolarHBondContact CD-OE2 3.31Å; R1024-E1029 IonicContact CZ-OE2 3.18Å; R1024-E1029 IonicContact NE-OE2 3.58Å; R1024-E1029 IonicContact NH1-OE2 2.72Å; R1024-E1029 PolarHBondContact NH1-OE2 2.89Å; S1025-E1029 PolarHBondContact O-N 3.48Å; Q1026-E1029 PolarHBondContact O-N 2.93Å; E1029-R1032 PolarHBondContact O-N 2.92Å; E1029-N1033 WeakPolarHBondContact O-CB 3.38Å; E1029-N1033 PolarHBondContact O-N 3.49Å; E1029-N1033 PolarHBondContact O-ND2 3.1Å; E1029-N1033 PolarHBondContact OE1-ND2 3.44Å
1030D90.5Very high77.1Confident69 Ų6979.1 Ų79.137%0.36942%0.419SS..Hα-helixtrans-63.1-44.5170.6-73.3-16.8000111.2Q1026 R1032 N1033 S1034 F1038Q1026-D1030 PolarHBondContact NE2-OD1 3.37Å; Q1026-D1030 VanDerWaalsContact O-CB 3.23Å; Q1026-D1030 WeakPolarHBondContact O-CB 3.43Å; Q1026-D1030 PolarHBondContact O-N 2.94Å; D1030-R1032 VanDerWaalsContact C-N 3.32Å; D1030-R1032 PolarHBondContact O-N 3.16Å; D1030-N1033 PolarHBondContact O-N 3.47Å; D1030-S1034 PolarHBondContact O-N 3.07Å; D1030-F1038 HydrophobicContact CB-CE2 4.15Å; D1030-F1038 HydrophobicContact CB-CZ 4.24Å; D1030-F1038 WeakPolarHBondContact O-CE2 3.33Å
1031F91.1Very high79.1Confident8 Ų874 Ų744%0.03539%0.387CS..Hα-helixtrans-55.8-46.9175.9177.6-97.2000111.9L1027 L1028 S1035 F1038 M1041 F1053 H1058 F1062L1027-F1031 WeakPolarHBondContact O-CB 3.23Å; L1027-F1031 PolarHBondContact O-N 3.14Å; L1028-F1031 HydrophobicContact CD1-CD1 4.44Å; L1028-F1031 PolarHBondContact O-N 3.23Å; F1031-S1035 WeakPolarHBondContact O-CA 3.49Å; F1031-S1035 PolarHBondContact O-N 2.91Å; F1031-S1035 VanDerWaalsContact O-N 3.13Å; F1031-F1038 HydrophobicContact CB-CD2 4.46Å; F1031-F1038 HydrophobicContact CD2-CB 3.54Å; F1031-F1038 HydrophobicContact CD2-CD2 4.27Å; F1031-F1038 HydrophobicContact CD2-CG 4.03Å; F1031-F1038 HydrophobicContact CE2-CB 3.77Å; F1031-M1041 HydrophobicContact CD2-CE 4.14Å; F1031-M1041 HydrophobicContact CD2-SD 4.19Å; F1031-F1053 HydrophobicContact CB-CE1 3.87Å; F1031-F1053 HydrophobicContact CB-CZ 3.82Å; F1031-F1053 HydrophobicContact CD1-CD1 4.46Å; F1031-F1053 AromaticContact CD1-CE1 3.71Å; F1031-F1053 HydrophobicContact CD1-CE1 3.71Å; F1031-F1053 HydrophobicContact CD1-CZ 4.45Å; F1031-F1053 HydrophobicContact CD2-CE1 4.03Å; F1031-F1053 HydrophobicContact CE1-CE1 4.32Å; F1031-F1053 AromaticContact CG-CE1 3.57Å; F1031-F1053 HydrophobicContact CG-CE1 3.57Å; F1031-F1053 HydrophobicContact CG-CZ 4.06Å; F1031-H1058 HydrophobicContact CD1-CB 4.43Å; F1031-H1058 HydrophobicContact CE1-CB 3.87Å; F1031-F1062 HydrophobicContact CE1-CB 4.27Å; F1031-F1062 HydrophobicContact CE2-CB 4.4Å; F1031-F1062 AromaticContact CE2-CD2 3.67Å; F1031-F1062 HydrophobicContact CE2-CD2 3.67Å; F1031-F1062 HydrophobicContact CE2-CE2 4.02Å; F1031-F1062 HydrophobicContact CE2-CG 4Å; F1031-F1062 HydrophobicContact CZ-CB 3.64Å; F1031-F1062 AromaticContact CZ-CD2 3.68Å; F1031-F1062 HydrophobicContact CZ-CD2 3.68Å; F1031-F1062 HydrophobicContact CZ-CE2 4.48Å; F1031-F1062 AromaticContact CZ-CG 3.74Å; F1031-F1062 HydrophobicContact CZ-CG 3.74Å
1032R89.3Confident81Confident69 Ų6976.7 Ų76.726%0.2640%0.396SS..Hα-helixtrans-64.5-43.5177.2-71.3167.157.976.628.4112.3L1028 E1029 D1030 D1056 H1058L1028-R1032 HydrophobicContact CD1-CG 4.33Å; L1028-R1032 WeakPolarHBondContact O-CB 3.21Å; L1028-R1032 WeakPolarHBondContact O-CD 3.41Å; L1028-R1032 WeakPolarHBondContact O-CG 3.35Å; L1028-R1032 PolarHBondContact O-N 3.21Å; E1029-R1032 PolarHBondContact O-N 2.92Å; D1030-R1032 VanDerWaalsContact C-N 3.32Å; D1030-R1032 PolarHBondContact O-N 3.16Å; R1032-D1056 IonicContact CZ-OD1 2.76Å; R1032-D1056 IonicContact NE-OD1 3.92Å; R1032-D1056 IonicContact NH1-OD1 3.71Å; R1032-D1056 PolarHBondContact NH1-OD1 3.41Å; R1032-D1056 IonicContact NH1-OD2 2.76Å; R1032-D1056 PolarHBondContact NH1-OD2 3.43Å; R1032-H1058 PolarHBondContact NH1-CD2 2.9Å
1033N86Confident82.9Confident112 Ų11271.5 Ų71.560%0.59936%0.36SS*.Hα-helixtrans-83.2-6.5-176.5-69.6-60.4000114.4E1029 D1030E1029-N1033 WeakPolarHBondContact O-CB 3.38Å; E1029-N1033 PolarHBondContact O-N 3.49Å; E1029-N1033 PolarHBondContact O-ND2 3.1Å; E1029-N1033 PolarHBondContact OE1-ND2 3.44Å; D1030-N1033 PolarHBondContact O-N 3.47Å
1034S77.3Confident83.7Confident35 Ų3570.8 Ų70.825%0.24536%0.355CS..THydrogen-bonded Turntrans-147.240.8-178.7-79.40000113.2D1030 A1036 R1037 F1038D1030-S1034 PolarHBondContact O-N 3.07Å; S1034-A1036 PolarHBondContact O-N 3.38Å; S1034-R1037 WeakPolarHBondContact O-CB 3.35Å; S1034-R1037 PolarHBondContact O-N 3.02Å; S1034-F1038 VanDerWaalsContact O-CD2 3.31Å; S1034-F1038 WeakPolarHBondContact O-CD2 3.16Å
1035S69.9Low83.7Confident62 Ų6270.2 Ų70.243%0.43436%0.357SS..Hα-helixtrans-43.8-38.3-179.9176.80000114.3F1031 R1037 F1038 Q1039F1031-S1035 WeakPolarHBondContact O-CA 3.49Å; F1031-S1035 PolarHBondContact O-N 2.91Å; F1031-S1035 VanDerWaalsContact O-N 3.13Å; S1035-R1037 PolarHBondContact O-N 3.37Å; S1035-F1038 CarbonylContact O-C 3.56Å; S1035-F1038 PolarHBondContact O-N 2.75Å; S1035-Q1039 PolarHBondContact O-N 2.98Å; S1035-Q1039 VanDerWaalsContact O-N 3.08Å
1036A67.3Low83.6Confident75 Ų7569 Ų6962%0.6235%0.349SS*.Hα-helixtrans-59-37.5175.400000114.3S1034 F1038S1034-A1036 PolarHBondContact O-N 3.38Å; A1036-F1038 VanDerWaalsContact C-N 3.26Å; A1036-F1038 PolarHBondContact O-N 2.96Å
1037R65.7Low83.6Confident192 Ų19269.9 Ų69.973%0.72535%0.346SS*.Hα-helixtrans-66.9-31.2173.6-63.6-174.3-172.5167.13.9112S1034 S1035S1034-R1037 WeakPolarHBondContact O-CB 3.35Å; S1034-R1037 PolarHBondContact O-N 3.02Å; S1035-R1037 PolarHBondContact O-N 3.37Å
1038F70.2Confident83.7Confident41 Ų4174.4 Ų74.418%0.1837%0.37CS..Hα-helixtrans-1039-169.3-60.5-67.9000114D1030 F1031 S1034 S1035 A1036 H1040 M1041D1030-F1038 HydrophobicContact CB-CE2 4.15Å; D1030-F1038 HydrophobicContact CB-CZ 4.24Å; D1030-F1038 WeakPolarHBondContact O-CE2 3.33Å; F1031-F1038 HydrophobicContact CB-CD2 4.46Å; F1031-F1038 HydrophobicContact CD2-CB 3.54Å; F1031-F1038 HydrophobicContact CD2-CD2 4.27Å; F1031-F1038 HydrophobicContact CD2-CG 4.03Å; F1031-F1038 HydrophobicContact CE2-CB 3.77Å; S1034-F1038 VanDerWaalsContact O-CD2 3.31Å; S1034-F1038 WeakPolarHBondContact O-CD2 3.16Å; S1035-F1038 CarbonylContact O-C 3.56Å; S1035-F1038 PolarHBondContact O-N 2.75Å; A1036-F1038 VanDerWaalsContact C-N 3.26Å; A1036-F1038 PolarHBondContact O-N 2.96Å; F1038-H1040 PolarHBondContact O-N 2.97Å; F1038-M1041 HydrophobicContact CB-CB 4.14Å; F1038-M1041 HydrophobicContact CB-CE 4.4Å; F1038-M1041 HydrophobicContact CD1-CB 4.38Å; F1038-M1041 HydrophobicContact CD1-CE 3.58Å; F1038-M1041 HydrophobicContact CE1-CE 4.01Å; F1038-M1041 HydrophobicContact CG-CE 4.12Å; F1038-M1041 VanDerWaalsContact O-CB 3.22Å; F1038-M1041 WeakPolarHBondContact O-CB 3.34Å; F1038-M1041 PolarHBondContact O-N 3.16Å
1039Q69.7Low83.8Confident124 Ų12477.1 Ų77.158%0.57938%0.383SS*.THydrogen-bonded Turntrans-56.3-37.2167.9-66.7-176.5-13.700111.3S1035 K1066S1035-Q1039 PolarHBondContact O-N 2.98Å; S1035-Q1039 VanDerWaalsContact O-N 3.08Å; Q1039-K1066 PolarHBondContact O-NZ 3.29Å
1040H73.3Confident84Confident154 Ų15474.6 Ų74.671%0.71337%0.371SS*.THydrogen-bonded Turntrans-85-1.9177.3-56.7-65.4000114.7F1038 H1042F1038-H1040 PolarHBondContact O-N 2.97Å; H1040-H1042 PolarHBondContact O-CD2 3.23Å; H1040-H1042 VanDerWaalsContact O-CD2 3.31Å
1041M83.1Confident84.4Confident4 Ų472.9 Ų72.92%0.0236%0.363CS..  trans-60140.1175.9-177.9-163.6-9400110.3L1027 F1031 F1038 E1045 L1046 F1062 K1066L1027-M1041 HydrophobicContact CD1-CE 3.89Å; F1031-M1041 HydrophobicContact CD2-CE 4.14Å; F1031-M1041 HydrophobicContact CD2-SD 4.19Å; F1038-M1041 HydrophobicContact CB-CB 4.14Å; F1038-M1041 HydrophobicContact CB-CE 4.4Å; F1038-M1041 HydrophobicContact CD1-CB 4.38Å; F1038-M1041 HydrophobicContact CD1-CE 3.58Å; F1038-M1041 HydrophobicContact CE1-CE 4.01Å; F1038-M1041 HydrophobicContact CG-CE 4.12Å; F1038-M1041 VanDerWaalsContact O-CB 3.22Å; F1038-M1041 WeakPolarHBondContact O-CB 3.34Å; F1038-M1041 PolarHBondContact O-N 3.16Å; M1041-E1045 WeakPolarHBondContact CA-OE1 3.46Å; M1041-E1045 HydrophobicContact CG-CB 3.89Å; M1041-E1045 HydrophobicContact CG-CG 4.41Å; M1041-L1046 HydrophobicContact CE-CD2 4.08Å; M1041-L1046 HydrophobicContact SD-CD2 3.47Å; M1041-L1046 WeakPolarHBondContact SD-CD2 3.44Å; M1041-L1046 HydrophobicContact SD-CG 3.97Å; M1041-F1062 HydrophobicContact CB-CE2 4.07Å; M1041-F1062 HydrophobicContact CB-CZ 3.75Å; M1041-F1062 HydrophobicContact CG-CZ 3.9Å; M1041-F1062 WeakPolarHBondContact O-CZ 3.34Å; M1041-F1062 HydrophobicContact SD-CE1 4.08Å; M1041-F1062 HydrophobicContact SD-CE2 4.49Å; M1041-F1062 HydrophobicContact SD-CZ 3.8Å; M1041-K1066 WeakPolarHBondContact O-CE 3.18Å; M1041-K1066 PolarHBondContact O-NZ 3.07Å
1042H87.1Confident84.7Confident102 Ų10275.2 Ų75.247%0.47237%0.374SS..  trans-97.5155.3174.8-75.8-98.8000111.9H1040 S1044 E1045H1040-H1042 PolarHBondContact O-CD2 3.23Å; H1040-H1042 VanDerWaalsContact O-CD2 3.31Å; H1042-S1044 WeakPolarHBondContact CB-OG 3.23Å; H1042-S1044 PolarHBondContact O-N 3.14Å; H1042-S1044 VanDerWaalsContact O-N 3.13Å; H1042-E1045 PolarHBondContact N-OE1 3.03Å; H1042-E1045 WeakPolarHBondContact O-CB 3.31Å; H1042-E1045 PolarHBondContact O-N 3.07Å
1043L92.2Very high85Confident2 Ų272 Ų721%0.0136%0.362CS..G310 helixtrans-59.2-26.4177.5-72.7167.3000112.8E1045 L1046 M1050 F1062 I1063 K1066 A1070 E1074 V1078L1043-E1045 PolarHBondContact O-N 3.47Å; L1043-L1046 PolarHBondContact O-N 3.2Å; L1043-M1050 WeakPolarHBondContact O-CE 3.39Å; L1043-F1062 HydrophobicContact CD2-CE1 4.46Å; L1043-I1063 HydrophobicContact CD2-CG1 4.31Å; L1043-K1066 HydrophobicContact CD1-CB 3.79Å; L1043-K1066 HydrophobicContact CD2-CB 3.88Å; L1043-K1066 HydrophobicContact CG-CB 3.74Å; L1043-K1066 HydrophobicContact CG-CG 4.45Å; L1043-A1070 HydrophobicContact CD1-CB 3.7Å; L1043-E1074 HydrophobicContact CD1-CB 4.23Å; L1043-V1078 HydrophobicContact CB-CG2 4.04Å; L1043-V1078 HydrophobicContact CD1-CG2 3.95Å; L1043-V1078 HydrophobicContact CD2-CG2 3.92Å; L1043-V1078 HydrophobicContact CG-CG2 4.19Å
1044S90.5Very high85.6Confident68 Ų6866.6 Ų66.648%0.47633%0.333SS..G310 helixtrans-64.5-22.8174.549.80000114.6H1042 L1046H1042-S1044 WeakPolarHBondContact CB-OG 3.23Å; H1042-S1044 PolarHBondContact O-N 3.14Å; H1042-S1044 VanDerWaalsContact O-N 3.13Å; S1044-L1046 VanDerWaalsContact C-N 3.33Å
1045E90.9Very high86.6Confident98 Ų9871.7 Ų71.746%0.45835%0.347SS..G310 helixtrans-81.2-15.1177.6-64.7170.3-106.200112.4M1041 H1042 L1043 R1047M1041-E1045 WeakPolarHBondContact CA-OE1 3.46Å; M1041-E1045 HydrophobicContact CG-CB 3.89Å; M1041-E1045 HydrophobicContact CG-CG 4.41Å; H1042-E1045 PolarHBondContact N-OE1 3.03Å; H1042-E1045 WeakPolarHBondContact O-CB 3.31Å; H1042-E1045 PolarHBondContact O-N 3.07Å; L1043-E1045 PolarHBondContact O-N 3.47Å; E1045-R1047 VanDerWaalsContact C-N 3.32Å
1046L92.5Very high87.9Confident0 Ų069.2 Ų69.20%033%0.329CS..G310 helixtrans-89.710.1177-63.9-170.1000114L1027 M1041 L1043 S1044 D1048 H1049 M1050 F1053 F1062 I1063L1027-L1046 HydrophobicContact CD2-CD2 4.19Å; M1041-L1046 HydrophobicContact CE-CD2 4.08Å; M1041-L1046 HydrophobicContact SD-CD2 3.47Å; M1041-L1046 WeakPolarHBondContact SD-CD2 3.44Å; M1041-L1046 HydrophobicContact SD-CG 3.97Å; L1043-L1046 PolarHBondContact O-N 3.2Å; S1044-L1046 VanDerWaalsContact C-N 3.33Å; L1046-D1048 PolarHBondContact O-N 3.08Å; L1046-H1049 CarbonylContact O-C 3.47Å; L1046-H1049 WeakPolarHBondContact O-CA 3.48Å; L1046-H1049 PolarHBondContact O-N 3.2Å; L1046-M1050 HydrophobicContact CB-CE 3.6Å; L1046-M1050 HydrophobicContact CB-SD 4.08Å; L1046-M1050 HydrophobicContact CD1-SD 4.34Å; L1046-M1050 PolarHBondContact O-N 3.35Å; L1046-F1053 HydrophobicContact CD1-CB 4.24Å; L1046-F1053 HydrophobicContact CD1-CD1 3.6Å; L1046-F1053 HydrophobicContact CD1-CE1 4.12Å; L1046-F1053 HydrophobicContact CD1-CG 3.94Å; L1046-F1053 HydrophobicContact CD2-CD1 3.63Å; L1046-F1053 HydrophobicContact CD2-CD2 3.97Å; L1046-F1053 HydrophobicContact CD2-CE1 3.36Å; L1046-F1053 HydrophobicContact CD2-CE2 3.71Å; L1046-F1053 HydrophobicContact CD2-CG 3.95Å; L1046-F1053 HydrophobicContact CD2-CZ 3.4Å; L1046-F1053 HydrophobicContact CG-CD1 4.28Å; L1046-F1053 HydrophobicContact CG-CE1 4.4Å; L1046-F1062 HydrophobicContact CD1-CD1 3.77Å; L1046-F1062 HydrophobicContact CD1-CE1 3.58Å; L1046-F1062 HydrophobicContact CG-CE1 4.25Å; L1046-I1063 HydrophobicContact CD1-CD1 4.33Å; L1046-I1063 HydrophobicContact CD1-CG1 3.99Å
1047R92.2Very high89.3Confident150 Ų15070.2 Ų70.257%0.56632%0.321SS*.THydrogen-bonded Turntrans-54.7138.7179.1-174-176.2-66.9169.91.4111E1045 H1049E1045-R1047 VanDerWaalsContact C-N 3.32Å; R1047-H1049 PolarHBondContact O-N 3Å
1048D93.9Very high90.6Very high140 Ų14064.9 Ų64.975%0.74930%0.304SS*.THydrogen-bonded Turntrans66.7-11.5-176.3-53.1-56.8000114.1L1046 E1081L1046-D1048 PolarHBondContact O-N 3.08Å; D1048-E1081 WeakPolarHBondContact CA-OE2 3.44Å; D1048-E1081 PolarHBondContact N-OE2 3.05Å
1049H95.5Very high91.8Very high61 Ų6162.9 Ų62.928%0.28230%0.295SS..THydrogen-bonded Turntrans-106.5-2.4175.4-71.7-81.6000113.7S1025 L1027 L1046 R1047 V1051 E1052 F1053S1025-H1049 WeakPolarHBondContact CB-CE1 3.47Å; S1025-H1049 PolarHBondContact OG-ND1 3.1Å; L1027-H1049 HydrophobicContact CD2-CB 4.1Å; L1046-H1049 CarbonylContact O-C 3.47Å; L1046-H1049 WeakPolarHBondContact O-CA 3.48Å; L1046-H1049 PolarHBondContact O-N 3.2Å; R1047-H1049 PolarHBondContact O-N 3Å; H1049-V1051 VanDerWaalsContact C-N 3.27Å; H1049-V1051 PolarHBondContact O-N 3.09Å; H1049-V1051 VanDerWaalsContact O-N 3.16Å; H1049-E1052 IonicContact CE1-OE2 3.98Å; H1049-E1052 IonicContact CG-OE2 2.97Å; H1049-E1052 IonicContact ND1-OE2 3.71Å; H1049-E1052 PolarHBondContact ND1-OE2 3.12Å; H1049-E1052 WeakPolarHBondContact O-CA 3.47Å; H1049-E1052 VanDerWaalsContact O-CB 3.31Å; H1049-E1052 WeakPolarHBondContact O-CB 3.48Å; H1049-E1052 PolarHBondContact O-N 3.08Å; H1049-F1053 HydrophobicContact CB-CD2 4.02Å; H1049-F1053 HydrophobicContact CB-CE2 4.21Å; H1049-F1053 PolarHBondContact O-N 3.41Å
1050M96.4Very high93.2Very high0 Ų057 Ų570%027%0.268CS..Hα-helixtrans-57.2-38.3-171.1-160.766.660.600113.5L1043 L1046 A1054 I1063 V1078 E1081 I1082L1043-M1050 WeakPolarHBondContact O-CE 3.39Å; L1046-M1050 HydrophobicContact CB-CE 3.6Å; L1046-M1050 HydrophobicContact CB-SD 4.08Å; L1046-M1050 HydrophobicContact CD1-SD 4.34Å; L1046-M1050 PolarHBondContact O-N 3.35Å; M1050-A1054 VanDerWaalsContact O-CB 3.23Å; M1050-A1054 WeakPolarHBondContact O-CB 2.99Å; M1050-A1054 PolarHBondContact O-N 3.28Å; M1050-I1063 HydrophobicContact CG-CD1 4.37Å; M1050-I1063 HydrophobicContact SD-CD1 3.7Å; M1050-I1063 HydrophobicContact SD-CG1 4.07Å; M1050-V1078 HydrophobicContact CE-CB 4.36Å; M1050-V1078 HydrophobicContact CE-CG2 3.72Å; M1050-V1078 HydrophobicContact CG-CB 4.41Å; M1050-V1078 HydrophobicContact CG-CG1 3.85Å; M1050-V1078 HydrophobicContact SD-CB 4.23Å; M1050-V1078 HydrophobicContact SD-CG1 3.84Å; M1050-V1078 HydrophobicContact SD-CG2 3.82Å; M1050-E1081 HydrophobicContact CB-CB 3.88Å; M1050-E1081 HydrophobicContact CB-CG 4.44Å; M1050-E1081 WeakPolarHBondContact CB-OE2 3.3Å; M1050-E1081 HydrophobicContact CG-CB 4.44Å; M1050-I1082 HydrophobicContact CG-CG2 3.96Å
1051V97.6Very high94.3Very high33 Ų3357.2 Ų57.220%0.226%0.262CS..Hα-helixtrans-74.7-28.1179.1-1760000111.8H1049 R1055 E1081 I1082 H1085H1049-V1051 VanDerWaalsContact C-N 3.27Å; H1049-V1051 PolarHBondContact O-N 3.09Å; H1049-V1051 VanDerWaalsContact O-N 3.16Å; V1051-R1055 VanDerWaalsContact O-CG 3.27Å; V1051-R1055 WeakPolarHBondContact O-CG 3.48Å; V1051-E1081 VanDerWaalsContact CG2-O 3.3Å; V1051-E1081 WeakPolarHBondContact CG2-O 3.49Å; V1051-I1082 HydrophobicContact CG2-CG2 4.39Å; V1051-H1085 HydrophobicContact CG1-CB 3.98Å; V1051-H1085 HydrophobicContact CG2-CB 4.31Å; V1051-H1085 WeakPolarHBondContact CG2-ND1 3.43Å
1052E97.7Very high94.8Very high58 Ų5857.5 Ų57.527%0.27126%0.264SS..Hα-helixtrans-72-51.1173.6-165.9-164176.300109.9R1024 S1025 L1028 H1049 A1054 R1055 D1056R1024-E1052 WeakPolarHBondContact CA-OE1 3.08Å; S1025-E1052 WeakPolarHBondContact CB-OE2 3.37Å; S1025-E1052 PolarHBondContact N-OE1 3.37Å; S1025-E1052 VanDerWaalsContact OG-CD 3.3Å; S1025-E1052 PolarHBondContact OG-OE1 2.66Å; S1025-E1052 PolarHBondContact OG-OE2 2.74Å; L1028-E1052 HydrophobicContact CD2-CG 3.81Å; L1028-E1052 WeakPolarHBondContact CD2-OE1 3.37Å; H1049-E1052 IonicContact CE1-OE2 3.98Å; H1049-E1052 IonicContact CG-OE2 2.97Å; H1049-E1052 IonicContact ND1-OE2 3.71Å; H1049-E1052 PolarHBondContact ND1-OE2 3.12Å; H1049-E1052 WeakPolarHBondContact O-CA 3.47Å; H1049-E1052 VanDerWaalsContact O-CB 3.31Å; H1049-E1052 WeakPolarHBondContact O-CB 3.48Å; H1049-E1052 PolarHBondContact O-N 3.08Å; E1052-A1054 PolarHBondContact O-N 3.48Å; E1052-R1055 CarbonylContact O-C 3.18Å; E1052-R1055 PolarHBondContact O-N 2.95Å; E1052-D1056 PolarHBondContact O-N 3.45Å
1053F97.2Very high95.3Very high0 Ų052.7 Ų52.70%024%0.241CC..Hα-helixtrans-59.4-43.7177-89.2-113.7000111.8L1027 L1028 F1031 L1046 H1049 R1055 D1056 G1059 S1060 I1063L1027-F1053 HydrophobicContact CD2-CE2 4.18Å; L1027-F1053 HydrophobicContact CD2-CZ 4.48Å; L1027-F1053 HydrophobicContact CG-CE2 4.02Å; L1027-F1053 HydrophobicContact CG-CZ 4.02Å; L1028-F1053 HydrophobicContact CB-CD2 4.15Å; L1028-F1053 HydrophobicContact CB-CE2 3.57Å; L1028-F1053 HydrophobicContact CB-CZ 4Å; L1028-F1053 HydrophobicContact CD1-CD1 3.98Å; L1028-F1053 HydrophobicContact CD1-CD2 3.9Å; L1028-F1053 HydrophobicContact CD1-CE1 3.87Å; L1028-F1053 HydrophobicContact CD1-CE2 3.8Å; L1028-F1053 HydrophobicContact CD1-CG 3.99Å; L1028-F1053 HydrophobicContact CD1-CZ 3.77Å; L1028-F1053 HydrophobicContact CG-CD2 4.45Å; L1028-F1053 HydrophobicContact CG-CE2 4.22Å; L1028-F1053 HydrophobicContact CG-CZ 4.5Å; F1031-F1053 HydrophobicContact CB-CE1 3.87Å; F1031-F1053 HydrophobicContact CB-CZ 3.82Å; F1031-F1053 HydrophobicContact CD1-CD1 4.46Å; F1031-F1053 AromaticContact CD1-CE1 3.71Å; F1031-F1053 HydrophobicContact CD1-CE1 3.71Å; F1031-F1053 HydrophobicContact CD1-CZ 4.45Å; F1031-F1053 HydrophobicContact CD2-CE1 4.03Å; F1031-F1053 HydrophobicContact CE1-CE1 4.32Å; F1031-F1053 AromaticContact CG-CE1 3.57Å; F1031-F1053 HydrophobicContact CG-CE1 3.57Å; F1031-F1053 HydrophobicContact CG-CZ 4.06Å; L1046-F1053 HydrophobicContact CD1-CB 4.24Å; L1046-F1053 HydrophobicContact CD1-CD1 3.6Å; L1046-F1053 HydrophobicContact CD1-CE1 4.12Å; L1046-F1053 HydrophobicContact CD1-CG 3.94Å; L1046-F1053 HydrophobicContact CD2-CD1 3.63Å; L1046-F1053 HydrophobicContact CD2-CD2 3.97Å; L1046-F1053 HydrophobicContact CD2-CE1 3.36Å; L1046-F1053 HydrophobicContact CD2-CE2 3.71Å; L1046-F1053 HydrophobicContact CD2-CG 3.95Å; L1046-F1053 HydrophobicContact CD2-CZ 3.4Å; L1046-F1053 HydrophobicContact CG-CD1 4.28Å; L1046-F1053 HydrophobicContact CG-CE1 4.4Å; H1049-F1053 HydrophobicContact CB-CD2 4.02Å; H1049-F1053 HydrophobicContact CB-CE2 4.21Å; H1049-F1053 PolarHBondContact O-N 3.41Å; F1053-R1055 PolarHBondContact O-N 3.18Å; F1053-R1055 VanDerWaalsContact O-N 3.07Å; F1053-D1056 PolarHBondContact O-N 3.15Å; F1053-G1059 CarbonylContact O-C 3.47Å; F1053-G1059 VanDerWaalsContact O-CA 3.32Å; F1053-G1059 WeakPolarHBondContact O-CA 3.44Å; F1053-S1060 PolarHBondContact O-N 2.82Å; F1053-I1063 HydrophobicContact CB-CD1 3.67Å
1054A98.1Very high95.5Very high0 Ų054.2 Ų54.20%025%0.248CC..THydrogen-bonded Turntrans-59.5-20.6176.300000113.5M1050 E1052 S1060 I1063 L1089 F1094 G1095 V1098M1050-A1054 VanDerWaalsContact O-CB 3.23Å; M1050-A1054 WeakPolarHBondContact O-CB 2.99Å; M1050-A1054 PolarHBondContact O-N 3.28Å; E1052-A1054 PolarHBondContact O-N 3.48Å; A1054-S1060 WeakPolarHBondContact O-CB 3.36Å; A1054-I1063 HydrophobicContact CB-CD1 4.21Å; A1054-L1089 HydrophobicContact CB-CD2 3.98Å; A1054-F1094 CarbonylContact O-C 3.41Å; A1054-F1094 VanDerWaalsContact O-C 3.25Å; A1054-G1095 WeakPolarHBondContact O-CA 3.28Å; A1054-G1095 PolarHBondContact O-N 3.37Å; A1054-V1098 HydrophobicContact CB-CB 4.49Å; A1054-V1098 HydrophobicContact CB-CG2 3.97Å
1055R97.9Very high95.8Very high141 Ų14157.3 Ų57.353%0.53226%0.255SS..THydrogen-bonded Turntrans-103.38178.2-62.1-177.370.7-128.9-12.9113.6V1051 E1052 F1053 L1089 D1092 F1094V1051-R1055 VanDerWaalsContact O-CG 3.27Å; V1051-R1055 WeakPolarHBondContact O-CG 3.48Å; E1052-R1055 CarbonylContact O-C 3.18Å; E1052-R1055 PolarHBondContact O-N 2.95Å; F1053-R1055 PolarHBondContact O-N 3.18Å; F1053-R1055 VanDerWaalsContact O-N 3.07Å; R1055-L1089 HydrophobicContact CG-CD2 3.48Å; R1055-L1089 VanDerWaalsContact CG-CD2 3.48Å; R1055-D1092 IonicContact CZ-OD1 3.12Å; R1055-D1092 IonicContact NE-OD1 2.71Å; R1055-D1092 PolarHBondContact NE-OD1 3.09Å; R1055-D1092 IonicContact NH2-OD1 2.78Å; R1055-D1092 PolarHBondContact NH2-OD1 2.78Å; R1055-F1094 WeakPolarHBondContact O-CD2 3.23Å
1056D97.1Very high95.9Very high11 Ų1155 Ų556%0.05924%0.244CC..SBendtrans-106.6148.5169.2-174.787.6000111.3R1024 L1028 R1032 E1052 F1053 H1058 G1059 S1060R1024-D1056 IonicContact NE-OD1 3.83Å; R1024-D1056 PolarHBondContact NE-OD1 3.04Å; L1028-D1056 HydrophobicContact CD1-CB 3.9Å; L1028-D1056 HydrophobicContact CD2-CB 3.8Å; L1028-D1056 HydrophobicContact CG-CB 4.41Å; R1032-D1056 IonicContact CZ-OD1 2.76Å; R1032-D1056 IonicContact NE-OD1 3.92Å; R1032-D1056 IonicContact NH1-OD1 3.71Å; R1032-D1056 PolarHBondContact NH1-OD1 3.41Å; R1032-D1056 IonicContact NH1-OD2 2.76Å; R1032-D1056 PolarHBondContact NH1-OD2 3.43Å; E1052-D1056 PolarHBondContact O-N 3.45Å; F1053-D1056 PolarHBondContact O-N 3.15Å; D1056-H1058 VanDerWaalsContact C-N 3.34Å; D1056-H1058 PolarHBondContact O-N 3.43Å; D1056-H1058 IonicContact OD2-CD2 2.69Å; D1056-H1058 PolarHBondContact OD2-N 3.12Å; D1056-G1059 PolarHBondContact OD2-N 2.96Å; D1056-S1060 WeakPolarHBondContact O-CB 3.48Å; D1056-S1060 PolarHBondContact O-N 2.77Å
1057Q96.8Very high96.1Very high95 Ų9555.1 Ų55.144%0.44424%0.244SC..Hα-helixtrans-61.4-37.7-178.6-171.8177.96.200113.5R1061 F1094Q1057-R1061 WeakPolarHBondContact O-CD 3.43Å; Q1057-R1061 WeakPolarHBondContact O-CG 3.3Å; Q1057-F1094 HydrophobicContact CB-CD1 4.22Å; Q1057-F1094 HydrophobicContact CB-CD2 4.35Å; Q1057-F1094 HydrophobicContact CB-CE1 3.81Å; Q1057-F1094 HydrophobicContact CB-CE2 3.94Å; Q1057-F1094 HydrophobicContact CB-CG 4.49Å; Q1057-F1094 HydrophobicContact CB-CZ 3.65Å; Q1057-F1094 HydrophobicContact CG-CD1 4.35Å; Q1057-F1094 HydrophobicContact CG-CE1 3.76Å; Q1057-F1094 HydrophobicContact CG-CZ 3.98Å
1058H93.8Very high96.3Very high80 Ų8052.2 Ų52.237%0.3724%0.237SC..Hα-helixtrans-88.9-42.3178.8-54-94000110.5F1031 R1032 D1056 S1060 R1061 F1062F1031-H1058 HydrophobicContact CD1-CB 4.43Å; F1031-H1058 HydrophobicContact CE1-CB 3.87Å; R1032-H1058 PolarHBondContact NH1-CD2 2.9Å; D1056-H1058 VanDerWaalsContact C-N 3.34Å; D1056-H1058 PolarHBondContact O-N 3.43Å; D1056-H1058 IonicContact OD2-CD2 2.69Å; D1056-H1058 PolarHBondContact OD2-N 3.12Å; H1058-S1060 VanDerWaalsContact C-N 3.34Å; H1058-S1060 PolarHBondContact O-N 3.13Å; H1058-R1061 PolarHBondContact O-N 3.41Å; H1058-F1062 PolarHBondContact O-N 2.96Å
1059G95.5Very high96.3Very high0 Ų051.5 Ų51.50%024%0.238CC..Hα-helixtrans-59.1-42.5178.100000112.7F1053 D1056 F1062 I1063F1053-G1059 CarbonylContact O-C 3.47Å; F1053-G1059 VanDerWaalsContact O-CA 3.32Å; F1053-G1059 WeakPolarHBondContact O-CA 3.44Å; D1056-G1059 PolarHBondContact OD2-N 2.96Å; G1059-F1062 PolarHBondContact O-N 3.25Å; G1059-I1063 WeakPolarHBondContact O-CG1 3.26Å; G1059-I1063 PolarHBondContact O-N 3.47Å
1060S97.8Very high96.2Very high1 Ų149.1 Ų49.11%0.00723%0.229CC..Hα-helixtrans-65.6-42.6176.7178.60000111.6F1053 A1054 D1056 H1058 F1062 I1063 Q1064 F1094F1053-S1060 PolarHBondContact O-N 2.82Å; A1054-S1060 WeakPolarHBondContact O-CB 3.36Å; D1056-S1060 WeakPolarHBondContact O-CB 3.48Å; D1056-S1060 PolarHBondContact O-N 2.77Å; H1058-S1060 VanDerWaalsContact C-N 3.34Å; H1058-S1060 PolarHBondContact O-N 3.13Å; S1060-F1062 VanDerWaalsContact C-N 3.34Å; S1060-F1062 PolarHBondContact O-N 3.39Å; S1060-I1063 PolarHBondContact O-N 3.23Å; S1060-Q1064 VanDerWaalsContact C-NE2 3.34Å; S1060-Q1064 WeakPolarHBondContact O-CB 3.49Å; S1060-Q1064 WeakPolarHBondContact O-CG 3.37Å; S1060-Q1064 PolarHBondContact O-N 3.41Å; S1060-Q1064 PolarHBondContact O-NE2 3.32Å; S1060-Q1064 VanDerWaalsContact O-NE2 3.13Å; S1060-Q1064 PolarHBondContact OG-NE2 2.76Å; S1060-F1094 PolarHBondContact OG-O 3.39Å
1061R96Very high96.2Very high157 Ų15752.9 Ų52.959%0.59225%0.252SS*.Hα-helixtrans-62-41.8176.9-77.2176.7174.9-87.52.9112Q1057 H1058 Q1064 Q1065Q1057-R1061 WeakPolarHBondContact O-CD 3.43Å; Q1057-R1061 WeakPolarHBondContact O-CG 3.3Å; H1058-R1061 PolarHBondContact O-N 3.41Å; R1061-Q1064 PolarHBondContact O-N 2.99Å; R1061-Q1065 WeakPolarHBondContact O-CG 3.5Å; R1061-Q1065 PolarHBondContact O-N 3.4Å
1062F95Very high96.1Very high11 Ų1155.4 Ų55.45%0.04827%0.268CS..Hα-helixtrans-62.3-48175.2173.4-89.1000112.1F1031 M1041 L1043 L1046 H1058 G1059 S1060 Q1064 Q1065 K1066F1031-F1062 HydrophobicContact CE1-CB 4.27Å; F1031-F1062 HydrophobicContact CE2-CB 4.4Å; F1031-F1062 AromaticContact CE2-CD2 3.67Å; F1031-F1062 HydrophobicContact CE2-CD2 3.67Å; F1031-F1062 HydrophobicContact CE2-CE2 4.02Å; F1031-F1062 HydrophobicContact CE2-CG 4Å; F1031-F1062 HydrophobicContact CZ-CB 3.64Å; F1031-F1062 AromaticContact CZ-CD2 3.68Å; F1031-F1062 HydrophobicContact CZ-CD2 3.68Å; F1031-F1062 HydrophobicContact CZ-CE2 4.48Å; F1031-F1062 AromaticContact CZ-CG 3.74Å; F1031-F1062 HydrophobicContact CZ-CG 3.74Å; M1041-F1062 HydrophobicContact CB-CE2 4.07Å; M1041-F1062 HydrophobicContact CB-CZ 3.75Å; M1041-F1062 HydrophobicContact CG-CZ 3.9Å; M1041-F1062 WeakPolarHBondContact O-CZ 3.34Å; M1041-F1062 HydrophobicContact SD-CE1 4.08Å; M1041-F1062 HydrophobicContact SD-CE2 4.49Å; M1041-F1062 HydrophobicContact SD-CZ 3.8Å; L1043-F1062 HydrophobicContact CD2-CE1 4.46Å; L1046-F1062 HydrophobicContact CD1-CD1 3.77Å; L1046-F1062 HydrophobicContact CD1-CE1 3.58Å; L1046-F1062 HydrophobicContact CG-CE1 4.25Å; H1058-F1062 PolarHBondContact O-N 2.96Å; G1059-F1062 PolarHBondContact O-N 3.25Å; S1060-F1062 VanDerWaalsContact C-N 3.34Å; S1060-F1062 PolarHBondContact O-N 3.39Å; F1062-Q1064 VanDerWaalsContact C-N 3.33Å; F1062-Q1064 PolarHBondContact O-N 2.96Å; F1062-Q1065 PolarHBondContact O-N 2.9Å; F1062-K1066 HydrophobicContact CD1-CG 4.33Å; F1062-K1066 HydrophobicContact CD2-CG 4.43Å; F1062-K1066 HydrophobicContact CE1-CG 4.06Å; F1062-K1066 HydrophobicContact CE2-CD 4.38Å; F1062-K1066 VanDerWaalsContact CE2-CE 3.48Å; F1062-K1066 HydrophobicContact CE2-CG 4.18Å; F1062-K1066 HydrophobicContact CZ-CD 4.26Å; F1062-K1066 HydrophobicContact CZ-CG 3.98Å; F1062-K1066 WeakPolarHBondContact O-CB 3.44Å; F1062-K1066 VanDerWaalsContact O-CG 3.29Å; F1062-K1066 WeakPolarHBondContact O-CG 3.39Å; F1062-K1066 PolarHBondContact O-N 2.87Å
1063I96.6Very high96Very high0 Ų056.1 Ų56.10%028%0.284CS..Hα-helixtrans-60-45175.9-69.4168.3000110.4L1043 L1046 M1050 F1053 A1054 G1059 S1060 Q1065 K1066 L1067 V1078 V1098L1043-I1063 HydrophobicContact CD2-CG1 4.31Å; L1046-I1063 HydrophobicContact CD1-CD1 4.33Å; L1046-I1063 HydrophobicContact CD1-CG1 3.99Å; M1050-I1063 HydrophobicContact CG-CD1 4.37Å; M1050-I1063 HydrophobicContact SD-CD1 3.7Å; M1050-I1063 HydrophobicContact SD-CG1 4.07Å; F1053-I1063 HydrophobicContact CB-CD1 3.67Å; A1054-I1063 HydrophobicContact CB-CD1 4.21Å; G1059-I1063 WeakPolarHBondContact O-CG1 3.26Å; G1059-I1063 PolarHBondContact O-N 3.47Å; S1060-I1063 PolarHBondContact O-N 3.23Å; I1063-Q1065 PolarHBondContact O-N 3.13Å; I1063-K1066 PolarHBondContact O-N 3.01Å; I1063-L1067 HydrophobicContact CG2-CD1 3.65Å; I1063-L1067 HydrophobicContact CG2-CG 4.1Å; I1063-L1067 WeakPolarHBondContact O-CB 3.45Å; I1063-L1067 WeakPolarHBondContact O-CG 3.32Å; I1063-L1067 PolarHBondContact O-N 3.02Å; I1063-V1078 HydrophobicContact CG2-CG1 4.39Å; I1063-V1098 HydrophobicContact CB-CG2 4.29Å; I1063-V1098 HydrophobicContact CG2-CB 4.5Å; I1063-V1098 HydrophobicContact CG2-CG1 3.75Å; I1063-V1098 HydrophobicContact CG2-CG2 3.95Å
1064Q97.6Very high96Very high35 Ų3558.5 Ų58.516%0.16430%0.295CS..Hα-helixtrans-56.6-50.9177.2-72.2165.162.300111.9S1060 R1061 F1062 L1067 E1068 Y1097 K1101S1060-Q1064 VanDerWaalsContact C-NE2 3.34Å; S1060-Q1064 WeakPolarHBondContact O-CB 3.49Å; S1060-Q1064 WeakPolarHBondContact O-CG 3.37Å; S1060-Q1064 PolarHBondContact O-N 3.41Å; S1060-Q1064 PolarHBondContact O-NE2 3.32Å; S1060-Q1064 VanDerWaalsContact O-NE2 3.13Å; S1060-Q1064 PolarHBondContact OG-NE2 2.76Å; R1061-Q1064 PolarHBondContact O-N 2.99Å; F1062-Q1064 VanDerWaalsContact C-N 3.33Å; F1062-Q1064 PolarHBondContact O-N 2.96Å; Q1064-L1067 PolarHBondContact O-N 3.07Å; Q1064-E1068 WeakPolarHBondContact O-CG 3.32Å; Q1064-Y1097 VanDerWaalsContact NE2-CB 3.32Å; Q1064-K1101 HydrophobicContact CB-CG 4.11Å; Q1064-K1101 HydrophobicContact CG-CG 3.96Å
1065Q95.1Very high95.9Very high132 Ų13259.8 Ų59.862%0.61730%0.3SS*.Hα-helixtrans-62.2-45.2179.9-73.8171.6-33.800112.2R1061 F1062 I1063 L1067 E1068R1061-Q1065 WeakPolarHBondContact O-CG 3.5Å; R1061-Q1065 PolarHBondContact O-N 3.4Å; F1062-Q1065 PolarHBondContact O-N 2.9Å; I1063-Q1065 PolarHBondContact O-N 3.13Å; Q1065-L1067 VanDerWaalsContact C-N 3.35Å; Q1065-L1067 PolarHBondContact O-N 2.73Å; Q1065-E1068 PolarHBondContact O-N 2.89Å
1066K94.5Very high95.9Very high50 Ų5056.1 Ų56.122%0.21729%0.291CS..Hα-helixtrans-68-34179.7-63.9-82.9171.41630111.5Q1039 M1041 L1043 F1062 I1063 E1068 T1069 A1070Q1039-K1066 PolarHBondContact O-NZ 3.29Å; M1041-K1066 WeakPolarHBondContact O-CE 3.18Å; M1041-K1066 PolarHBondContact O-NZ 3.07Å; L1043-K1066 HydrophobicContact CD1-CB 3.79Å; L1043-K1066 HydrophobicContact CD2-CB 3.88Å; L1043-K1066 HydrophobicContact CG-CB 3.74Å; L1043-K1066 HydrophobicContact CG-CG 4.45Å; F1062-K1066 HydrophobicContact CD1-CG 4.33Å; F1062-K1066 HydrophobicContact CD2-CG 4.43Å; F1062-K1066 HydrophobicContact CE1-CG 4.06Å; F1062-K1066 HydrophobicContact CE2-CD 4.38Å; F1062-K1066 VanDerWaalsContact CE2-CE 3.48Å; F1062-K1066 HydrophobicContact CE2-CG 4.18Å; F1062-K1066 HydrophobicContact CZ-CD 4.26Å; F1062-K1066 HydrophobicContact CZ-CG 3.98Å; F1062-K1066 WeakPolarHBondContact O-CB 3.44Å; F1062-K1066 VanDerWaalsContact O-CG 3.29Å; F1062-K1066 WeakPolarHBondContact O-CG 3.39Å; F1062-K1066 PolarHBondContact O-N 2.87Å; I1063-K1066 PolarHBondContact O-N 3.01Å; K1066-E1068 PolarHBondContact O-N 3.15Å; K1066-T1069 PolarHBondContact O-N 3.34Å; K1066-A1070 WeakPolarHBondContact O-CA 3.5Å; K1066-A1070 WeakPolarHBondContact O-CB 3.38Å; K1066-A1070 PolarHBondContact O-N 3.23Å
1067L96.5Very high95.8Very high2 Ų257.4 Ų57.41%0.0130%0.301CS..Hα-helixtrans-64.8-19.8178.2-78.1172.6000114.5I1063 Q1064 Q1065 K1075 V1078 V1098 K1101 F1102I1063-L1067 HydrophobicContact CG2-CD1 3.65Å; I1063-L1067 HydrophobicContact CG2-CG 4.1Å; I1063-L1067 WeakPolarHBondContact O-CB 3.45Å; I1063-L1067 WeakPolarHBondContact O-CG 3.32Å; I1063-L1067 PolarHBondContact O-N 3.02Å; Q1064-L1067 PolarHBondContact O-N 3.07Å; Q1065-L1067 VanDerWaalsContact C-N 3.35Å; Q1065-L1067 PolarHBondContact O-N 2.73Å; L1067-K1075 HydrophobicContact CD2-CG 3.95Å; L1067-K1075 WeakPolarHBondContact O-CE 3.44Å; L1067-K1075 PolarHBondContact O-NZ 3.42Å; L1067-V1078 HydrophobicContact CD2-CG1 4.34Å; L1067-V1098 HydrophobicContact CD1-CG1 4.19Å; L1067-K1101 HydrophobicContact CD1-CB 4.06Å; L1067-F1102 HydrophobicContact CD1-CD2 3.97Å; L1067-F1102 HydrophobicContact CD1-CE2 3.54Å; L1067-F1102 HydrophobicContact CD1-CZ 4.18Å; L1067-F1102 HydrophobicContact CD2-CE1 4.26Å; L1067-F1102 HydrophobicContact CD2-CE2 3.82Å; L1067-F1102 HydrophobicContact CD2-CZ 3.57Å; L1067-F1102 HydrophobicContact CG-CE2 4.36Å
1068E95.6Very high95.8Very high90 Ų9052.9 Ų52.942%0.42128%0.28SS..Hα-helixtrans-72-38.5176.9-52.3-167148.700111.2Q1064 Q1065 K1066 K1101 F1105Q1064-E1068 WeakPolarHBondContact O-CG 3.32Å; Q1065-E1068 PolarHBondContact O-N 2.89Å; K1066-E1068 PolarHBondContact O-N 3.15Å; E1068-K1101 HydrophobicContact CG-CD 4.39Å; E1068-K1101 WeakPolarHBondContact OE1-CE 3.37Å; E1068-K1101 IonicContact OE1-NZ 3.87Å; E1068-K1101 PolarHBondContact OE1-NZ 3.01Å; E1068-F1105 HydrophobicContact CB-CE2 4.33Å; E1068-F1105 HydrophobicContact CG-CD2 4.18Å; E1068-F1105 HydrophobicContact CG-CE2 3.7Å; E1068-F1105 HydrophobicContact CG-CZ 4.28Å
1069T94.3Very high96Very high124 Ų12449.2 Ų49.276%0.76126%0.263SS*.Hα-helixtrans-103.2-12.8-178.552.70000114.6K1066K1066-T1069 PolarHBondContact O-N 3.34Å
1070A94Very high96.1Very high11 Ų1154.5 Ų54.59%0.09129%0.291CS..  trans-59.2141.2-177.800000113.7L1043 K1066 E1074 K1075L1043-A1070 HydrophobicContact CD1-CB 3.7Å; K1066-A1070 WeakPolarHBondContact O-CA 3.5Å; K1066-A1070 WeakPolarHBondContact O-CB 3.38Å; K1066-A1070 PolarHBondContact O-N 3.23Å; A1070-E1074 HydrophobicContact CB-CB 4.03Å; A1070-K1075 HydrophobicContact CB-CG 3.98Å; A1070-K1075 WeakPolarHBondContact O-CE 3.17Å
1071T95.8Very high96.1Very high79 Ų7956 Ų5649%0.48530%0.298SS..  trans-63.2159.4171.863.30000111.8A1073 E1074 K1075T1071-A1073 PolarHBondContact O-N 3.48Å; T1071-E1074 WeakPolarHBondContact CB-OE2 3.44Å; T1071-E1074 WeakPolarHBondContact CG2-OE2 3.14Å; T1071-E1074 PolarHBondContact N-OE2 3.1Å; T1071-E1074 PolarHBondContact O-N 2.97Å; T1071-E1074 WeakPolarHBondContact OG1-CG 3.34Å; T1071-E1074 PolarHBondContact OG1-N 3.34Å; T1071-E1074 PolarHBondContact OG1-OE2 3.34Å; T1071-K1075 WeakPolarHBondContact O-CB 3.11Å; T1071-K1075 WeakPolarHBondContact O-CG 3.5Å; T1071-K1075 PolarHBondContact O-N 3.44Å
1072T96Very high96.2Very high87 Ų8748.6 Ų48.653%0.53427%0.27SS..Hα-helixtrans-56-32.6174.1-48.40000112.5N1076 T1107T1072-N1076 WeakPolarHBondContact O-CB 3.27Å; T1072-N1076 PolarHBondContact O-N 3.25Å; T1072-N1076 PolarHBondContact O-ND2 2.86Å; T1072-T1107 HydrophobicContact CG2-CG2 3.77Å
1073A95.6Very high96.3Very high73 Ų7349.8 Ų49.860%0.60328%0.277SS*.Hα-helixtrans-69.1-46.2177.500000112.4T1071 N1076 S1077T1071-A1073 PolarHBondContact O-N 3.48Å; A1073-N1076 PolarHBondContact O-N 3.28Å; A1073-S1077 PolarHBondContact O-N 3Å
1074E95.7Very high96.3Very high50 Ų5053.6 Ų53.623%0.23430%0.302CS..Hα-helixtrans-63.2-44.9174.2-71.1163.111200111.2L1043 A1070 T1071 N1076 S1077 V1078L1043-E1074 HydrophobicContact CD1-CB 4.23Å; A1070-E1074 HydrophobicContact CB-CB 4.03Å; T1071-E1074 WeakPolarHBondContact CB-OE2 3.44Å; T1071-E1074 WeakPolarHBondContact CG2-OE2 3.14Å; T1071-E1074 PolarHBondContact N-OE2 3.1Å; T1071-E1074 PolarHBondContact O-N 2.97Å; T1071-E1074 WeakPolarHBondContact OG1-CG 3.34Å; T1071-E1074 PolarHBondContact OG1-N 3.34Å; T1071-E1074 PolarHBondContact OG1-OE2 3.34Å; E1074-N1076 VanDerWaalsContact C-N 3.31Å; E1074-N1076 PolarHBondContact O-N 2.69Å; E1074-S1077 WeakPolarHBondContact O-CB 3.27Å; E1074-S1077 PolarHBondContact O-N 2.76Å; E1074-S1077 VanDerWaalsContact O-N 3.1Å; E1074-V1078 WeakPolarHBondContact O-CG2 3.34Å; E1074-V1078 PolarHBondContact O-N 3.35Å
1075K96.9Very high96.4Very high27 Ų2755.9 Ų55.912%0.11731%0.312CS..Hα-helixtrans-55.8-44.9174.6-73.8174.9173.9177.20111.6L1067 A1070 T1071 V1078 F1079 F1102 F1105L1067-K1075 HydrophobicContact CD2-CG 3.95Å; L1067-K1075 WeakPolarHBondContact O-CE 3.44Å; L1067-K1075 PolarHBondContact O-NZ 3.42Å; A1070-K1075 HydrophobicContact CB-CG 3.98Å; A1070-K1075 WeakPolarHBondContact O-CE 3.17Å; T1071-K1075 WeakPolarHBondContact O-CB 3.11Å; T1071-K1075 WeakPolarHBondContact O-CG 3.5Å; T1071-K1075 PolarHBondContact O-N 3.44Å; K1075-V1078 PolarHBondContact O-N 2.97Å; K1075-F1079 WeakPolarHBondContact O-CB 3.16Å; K1075-F1079 PolarHBondContact O-N 2.94Å; K1075-F1102 HydrophobicContact CB-CE1 4.31Å; K1075-F1105 PolarHBondContact NZ-O 3.22Å
1076N96.9Very high96.5Very high63 Ų6349.6 Ų49.634%0.33728%0.283SS..Hα-helixtrans-62.5-41.1175.2-77.4-13.2000112.5T1072 A1073 E1074 F1079 N1080 Q1110T1072-N1076 WeakPolarHBondContact O-CB 3.27Å; T1072-N1076 PolarHBondContact O-N 3.25Å; T1072-N1076 PolarHBondContact O-ND2 2.86Å; A1073-N1076 PolarHBondContact O-N 3.28Å; E1074-N1076 VanDerWaalsContact C-N 3.31Å; E1074-N1076 PolarHBondContact O-N 2.69Å; N1076-F1079 PolarHBondContact O-N 2.79Å; N1076-N1080 PolarHBondContact O-N 3.13Å; N1076-N1080 PolarHBondContact O-ND2 3.12Å; N1076-Q1110 PolarHBondContact OD1-NE2 2.89Å
1077S95.5Very high96.6Very high38 Ų3848.2 Ų48.227%0.26628%0.283SS..Hα-helixtrans-60.9-50.7176.8-163.40000111.4A1073 E1074 F1079 N1080A1073-S1077 PolarHBondContact O-N 3Å; E1074-S1077 WeakPolarHBondContact O-CB 3.27Å; E1074-S1077 PolarHBondContact O-N 2.76Å; E1074-S1077 VanDerWaalsContact O-N 3.1Å; S1077-F1079 VanDerWaalsContact C-N 3.33Å; S1077-F1079 PolarHBondContact O-N 3.18Å; S1077-N1080 PolarHBondContact O-N 3.23Å
1078V97.2Very high96.7Very high0 Ų055.6 Ų55.60%032%0.315CS..Hα-helixtrans-58.3-45.7175.8175.50000110.9L1043 M1050 I1063 L1067 E1074 K1075 N1080 E1081 I1082 F1102L1043-V1078 HydrophobicContact CB-CG2 4.04Å; L1043-V1078 HydrophobicContact CD1-CG2 3.95Å; L1043-V1078 HydrophobicContact CD2-CG2 3.92Å; L1043-V1078 HydrophobicContact CG-CG2 4.19Å; M1050-V1078 HydrophobicContact CE-CB 4.36Å; M1050-V1078 HydrophobicContact CE-CG2 3.72Å; M1050-V1078 HydrophobicContact CG-CB 4.41Å; M1050-V1078 HydrophobicContact CG-CG1 3.85Å; M1050-V1078 HydrophobicContact SD-CB 4.23Å; M1050-V1078 HydrophobicContact SD-CG1 3.84Å; M1050-V1078 HydrophobicContact SD-CG2 3.82Å; I1063-V1078 HydrophobicContact CG2-CG1 4.39Å; L1067-V1078 HydrophobicContact CD2-CG1 4.34Å; E1074-V1078 WeakPolarHBondContact O-CG2 3.34Å; E1074-V1078 PolarHBondContact O-N 3.35Å; K1075-V1078 PolarHBondContact O-N 2.97Å; V1078-N1080 PolarHBondContact O-N 3.22Å; V1078-E1081 PolarHBondContact O-N 3.11Å; V1078-I1082 HydrophobicContact CG1-CD1 4.5Å; V1078-I1082 WeakPolarHBondContact O-CG1 3.41Å; V1078-I1082 PolarHBondContact O-N 3.42Å; V1078-F1102 HydrophobicContact CB-CE2 4.41Å; V1078-F1102 HydrophobicContact CB-CZ 3.94Å; V1078-F1102 HydrophobicContact CG1-CE2 3.63Å; V1078-F1102 HydrophobicContact CG1-CZ 3.68Å
1079F98Very high96.8Very high4 Ų451.3 Ų51.32%0.01830%0.295CS..Hα-helixtrans-61.4-43.3-175.4-167.9-107.5000112.7K1075 N1076 S1077 E1081 I1082 L1083 F1102 Q1110 L1113 L1114K1075-F1079 WeakPolarHBondContact O-CB 3.16Å; K1075-F1079 PolarHBondContact O-N 2.94Å; N1076-F1079 PolarHBondContact O-N 2.79Å; S1077-F1079 VanDerWaalsContact C-N 3.33Å; S1077-F1079 PolarHBondContact O-N 3.18Å; F1079-E1081 VanDerWaalsContact C-N 3.28Å; F1079-E1081 PolarHBondContact O-N 3.26Å; F1079-I1082 WeakPolarHBondContact O-CG1 3.21Å; F1079-I1082 PolarHBondContact O-N 3.37Å; F1079-L1083 HydrophobicContact CD1-CB 4.42Å; F1079-L1083 HydrophobicContact CD1-CD2 4.38Å; F1079-L1083 HydrophobicContact CE1-CB 4.26Å; F1079-L1083 HydrophobicContact CE1-CD1 4.1Å; F1079-L1083 HydrophobicContact CE1-CD2 3.78Å; F1079-L1083 HydrophobicContact CE1-CG 4.26Å; F1079-L1083 HydrophobicContact CZ-CD1 3.86Å; F1079-L1083 HydrophobicContact CZ-CD2 4.39Å; F1079-L1083 HydrophobicContact CZ-CG 4.48Å; F1079-L1083 VanDerWaalsContact O-CB 3.25Å; F1079-L1083 WeakPolarHBondContact O-CB 3.48Å; F1079-L1083 PolarHBondContact O-N 2.85Å; F1079-F1102 HydrophobicContact CB-CE1 3.78Å; F1079-F1102 HydrophobicContact CB-CZ 3.98Å; F1079-F1102 AromaticContact CD2-CD1 3.51Å; F1079-F1102 HydrophobicContact CD2-CD1 3.51Å; F1079-F1102 HydrophobicContact CD2-CD2 4.43Å; F1079-F1102 AromaticContact CD2-CE1 3.63Å; F1079-F1102 HydrophobicContact CD2-CE1 3.63Å; F1079-F1102 AromaticContact CD2-CG 3.93Å; F1079-F1102 HydrophobicContact CD2-CG 3.93Å; F1079-F1102 HydrophobicContact CD2-CZ 4.16Å; F1079-F1102 HydrophobicContact CE2-CD1 4.12Å; F1079-F1102 HydrophobicContact CE2-CG 4.35Å; F1079-F1102 HydrophobicContact CG-CD1 4.4Å; F1079-F1102 HydrophobicContact CG-CE1 4.14Å; F1079-Q1110 HydrophobicContact CB-CG 4.48Å; F1079-Q1110 HydrophobicContact CD1-CB 4.43Å; F1079-Q1110 HydrophobicContact CD1-CG 3.78Å; F1079-Q1110 HydrophobicContact CD2-CB 4.12Å; F1079-Q1110 HydrophobicContact CD2-CG 3.98Å; F1079-Q1110 HydrophobicContact CE1-CB 4.09Å; F1079-Q1110 HydrophobicContact CE1-CG 3.86Å; F1079-Q1110 HydrophobicContact CE2-CB 3.75Å; F1079-Q1110 HydrophobicContact CE2-CG 4.07Å; F1079-Q1110 HydrophobicContact CG-CB 4.43Å; F1079-Q1110 HydrophobicContact CG-CG 3.82Å; F1079-Q1110 HydrophobicContact CZ-CB 3.73Å; F1079-Q1110 HydrophobicContact CZ-CG 4Å; F1079-Q1110 VanDerWaalsContact CZ-O 3.29Å; F1079-Q1110 WeakPolarHBondContact CZ-O 3.45Å; F1079-L1113 HydrophobicContact CE1-CB 4.14Å; F1079-L1113 HydrophobicContact CE1-CD1 3.89Å; F1079-L1113 HydrophobicContact CZ-CB 4.03Å; F1079-L1114 HydrophobicContact CE2-CD1 3.96Å; F1079-L1114 HydrophobicContact CE2-CD2 4.1Å; F1079-L1114 HydrophobicContact CE2-CG 3.74Å; F1079-L1114 HydrophobicContact CZ-CD2 4.41Å; F1079-L1114 HydrophobicContact CZ-CG 4Å
1080N97.4Very high97Very high110 Ų11045.4 Ų45.459%0.58826%0.259SS*.Hα-helixtrans-61.9-34.6-178.2-71.2-18.7000112.7N1076 S1077 V1078 P1084N1076-N1080 PolarHBondContact O-N 3.13Å; N1076-N1080 PolarHBondContact O-ND2 3.12Å; S1077-N1080 PolarHBondContact O-N 3.23Å; V1078-N1080 PolarHBondContact O-N 3.22Å; N1080-P1084 WeakPolarHBondContact O-CD 3.44Å
1081E97.6Very high97.3Very high34 Ų3446.8 Ų46.816%0.15927%0.266CS..Hα-helixtrans-76.7-37.3178.2-64.7-179.4-130.800112.3D1048 M1050 V1051 V1078 F1079 H1085D1048-E1081 WeakPolarHBondContact CA-OE2 3.44Å; D1048-E1081 PolarHBondContact N-OE2 3.05Å; M1050-E1081 HydrophobicContact CB-CB 3.88Å; M1050-E1081 HydrophobicContact CB-CG 4.44Å; M1050-E1081 WeakPolarHBondContact CB-OE2 3.3Å; M1050-E1081 HydrophobicContact CG-CB 4.44Å; V1051-E1081 VanDerWaalsContact CG2-O 3.3Å; V1051-E1081 WeakPolarHBondContact CG2-O 3.49Å; V1078-E1081 PolarHBondContact O-N 3.11Å; F1079-E1081 VanDerWaalsContact C-N 3.28Å; F1079-E1081 PolarHBondContact O-N 3.26Å; E1081-H1085 PolarHBondContact O-ND1 2.96Å
1082I97.8Very high97.4Very high0 Ų044 Ų440%025%0.248CC..Hα-helixtrans-86-26.4-177.470.6172.6000114.3M1050 V1051 V1078 F1079 H1085 S1086 L1089 V1098 I1099 F1102M1050-I1082 HydrophobicContact CG-CG2 3.96Å; V1051-I1082 HydrophobicContact CG2-CG2 4.39Å; V1078-I1082 HydrophobicContact CG1-CD1 4.5Å; V1078-I1082 WeakPolarHBondContact O-CG1 3.41Å; V1078-I1082 PolarHBondContact O-N 3.42Å; F1079-I1082 WeakPolarHBondContact O-CG1 3.21Å; F1079-I1082 PolarHBondContact O-N 3.37Å; I1082-H1085 CarbonylContact O-C 3.48Å; I1082-H1085 WeakPolarHBondContact O-CA 3.39Å; I1082-H1085 PolarHBondContact O-N 3.42Å; I1082-S1086 PolarHBondContact O-N 3.19Å; I1082-L1089 HydrophobicContact CB-CD1 3.65Å; I1082-L1089 HydrophobicContact CG2-CD1 3.96Å; I1082-V1098 HydrophobicContact CD1-CG1 3.92Å; I1082-I1099 HydrophobicContact CD1-CD1 4.14Å; I1082-F1102 HydrophobicContact CD1-CD2 3.54Å; I1082-F1102 HydrophobicContact CD1-CE2 3.41Å; I1082-F1102 VanDerWaalsContact CD1-CE2 3.41Å; I1082-F1102 HydrophobicContact CD1-CZ 4.32Å
1083L98.1Very high97.5Very high36 Ų3642.5 Ų42.519%0.18824%0.238CC..THydrogen-bonded Turntrans-59.8-41.3-174.4178.366.8000114.3F1079 H1085 S1086 L1113 L1114 R1117F1079-L1083 HydrophobicContact CD1-CB 4.42Å; F1079-L1083 HydrophobicContact CD1-CD2 4.38Å; F1079-L1083 HydrophobicContact CE1-CB 4.26Å; F1079-L1083 HydrophobicContact CE1-CD1 4.1Å; F1079-L1083 HydrophobicContact CE1-CD2 3.78Å; F1079-L1083 HydrophobicContact CE1-CG 4.26Å; F1079-L1083 HydrophobicContact CZ-CD1 3.86Å; F1079-L1083 HydrophobicContact CZ-CD2 4.39Å; F1079-L1083 HydrophobicContact CZ-CG 4.48Å; F1079-L1083 VanDerWaalsContact O-CB 3.25Å; F1079-L1083 WeakPolarHBondContact O-CB 3.48Å; F1079-L1083 PolarHBondContact O-N 2.85Å; L1083-H1085 PolarHBondContact O-N 3.26Å; L1083-S1086 WeakPolarHBondContact O-CB 3.47Å; L1083-S1086 PolarHBondContact O-N 2.98Å; L1083-S1086 PolarHBondContact O-OG 3.49Å; L1083-S1086 VanDerWaalsContact O-OG 3.08Å; L1083-L1113 HydrophobicContact CD1-CB 4.38Å; L1083-L1113 HydrophobicContact CD2-CD1 4.4Å; L1083-L1114 HydrophobicContact CD1-CD2 4.26Å; L1083-R1117 HydrophobicContact CD1-CG 3.83Å; L1083-R1117 PolarHBondContact O-NE 3.07Å
1084P97.4Very high97.6Very high81 Ų8141.8 Ų41.853%0.52622%0.222SC..THydrogen-bonded Turntrans-59.5-39.8172.9-23.334.4000111.5N1080 R1117N1080-P1084 WeakPolarHBondContact O-CD 3.44Å; P1084-R1117 PolarHBondContact O-NH2 3.29Å
1085H97.7Very high97.8Very high82 Ų8239.4 Ų39.438%0.3821%0.211SC..THydrogen-bonded Turntrans-86.2-2.1-174.6-58101.3000114.3V1051 E1081 I1082 L1083 G1087 K1088 L1089V1051-H1085 HydrophobicContact CG1-CB 3.98Å; V1051-H1085 HydrophobicContact CG2-CB 4.31Å; V1051-H1085 WeakPolarHBondContact CG2-ND1 3.43Å; E1081-H1085 PolarHBondContact O-ND1 2.96Å; I1082-H1085 CarbonylContact O-C 3.48Å; I1082-H1085 WeakPolarHBondContact O-CA 3.39Å; I1082-H1085 PolarHBondContact O-N 3.42Å; L1083-H1085 PolarHBondContact O-N 3.26Å; H1085-G1087 PolarHBondContact O-N 3Å; H1085-K1088 WeakPolarHBondContact O-CB 3.5Å; H1085-K1088 PolarHBondContact O-N 2.82Å; H1085-L1089 HydrophobicContact CB-CD1 4.3Å; H1085-L1089 PolarHBondContact O-N 3.05Å
1086S98Very high97.8Very high0 Ų038.1 Ų38.10%021%0.205CC..Hα-helixtrans-53.2-47.5-165.161.50000114I1082 L1083 K1088 L1089 M1090 R1117I1082-S1086 PolarHBondContact O-N 3.19Å; L1083-S1086 WeakPolarHBondContact O-CB 3.47Å; L1083-S1086 PolarHBondContact O-N 2.98Å; L1083-S1086 PolarHBondContact O-OG 3.49Å; L1083-S1086 VanDerWaalsContact O-OG 3.08Å; S1086-K1088 VanDerWaalsContact C-N 3.26Å; S1086-K1088 PolarHBondContact O-N 3Å; S1086-L1089 CarbonylContact O-C 3.36Å; S1086-L1089 WeakPolarHBondContact O-CA 3.24Å; S1086-L1089 PolarHBondContact O-N 3.46Å; S1086-M1090 WeakPolarHBondContact O-CG 3.33Å; S1086-M1090 PolarHBondContact O-N 3.45Å; S1086-R1117 PolarHBondContact OG-NE 3.19Å
1087G97.4Very high97.9Very high21 Ų2140.2 Ų40.222%0.21621%0.209CC..Hα-helixtrans-60.4-29.917900000114.8H1085 T1091H1085-G1087 PolarHBondContact O-N 3Å; G1087-T1091 PolarHBondContact O-OG1 3.47Å
1088K97.9Very high98.1Very high157 Ų15738.4 Ų38.468%0.68320%0.197SC*.Hα-helixtrans-73.5-42.2171.4-67.4-177.8178.11780110.9H1085 S1086 T1091 D1092H1085-K1088 WeakPolarHBondContact O-CB 3.5Å; H1085-K1088 PolarHBondContact O-N 2.82Å; S1086-K1088 VanDerWaalsContact C-N 3.26Å; S1086-K1088 PolarHBondContact O-N 3Å; K1088-T1091 PolarHBondContact O-N 3.44Å; K1088-T1091 PolarHBondContact O-OG1 3.24Å; K1088-T1091 VanDerWaalsContact O-OG1 3.12Å; K1088-D1092 WeakPolarHBondContact O-CB 3.34Å; K1088-D1092 PolarHBondContact O-N 3.37Å; K1088-D1092 VanDerWaalsContact O-N 3.12Å
1089L98.6Very high98.1Very high1 Ų138.4 Ų38.41%0.00520%0.197CC..Hα-helixtrans-66.1-39.1178-64.7171.6000111.8A1054 R1055 I1082 H1085 S1086 T1091 D1092 G1095 N1096 I1099A1054-L1089 HydrophobicContact CB-CD2 3.98Å; R1055-L1089 HydrophobicContact CG-CD2 3.48Å; R1055-L1089 VanDerWaalsContact CG-CD2 3.48Å; I1082-L1089 HydrophobicContact CB-CD1 3.65Å; I1082-L1089 HydrophobicContact CG2-CD1 3.96Å; H1085-L1089 HydrophobicContact CB-CD1 4.3Å; H1085-L1089 PolarHBondContact O-N 3.05Å; S1086-L1089 CarbonylContact O-C 3.36Å; S1086-L1089 WeakPolarHBondContact O-CA 3.24Å; S1086-L1089 PolarHBondContact O-N 3.46Å; L1089-T1091 PolarHBondContact O-N 3.27Å; L1089-T1091 VanDerWaalsContact O-N 3.13Å; L1089-D1092 PolarHBondContact O-N 2.84Å; L1089-D1092 VanDerWaalsContact O-N 3.12Å; L1089-G1095 CarbonylContact O-C 3.06Å; L1089-N1096 VanDerWaalsContact O-CA 3.27Å; L1089-N1096 WeakPolarHBondContact O-CA 3.21Å; L1089-N1096 PolarHBondContact O-N 2.72Å; L1089-I1099 HydrophobicContact CB-CD1 4Å; L1089-I1099 HydrophobicContact CB-CG1 3.82Å; L1089-I1099 HydrophobicContact CD1-CD1 4.25Å
1090M98.6Very high98.2Very high0 Ų039.7 Ų39.70%020%0.203CC..Hα-helixtrans-56.7-27.7175-71.2171172.900113.4S1086 I1099 L1114 L1118 F1125 Y1130 G1131 V1134S1086-M1090 WeakPolarHBondContact O-CG 3.33Å; S1086-M1090 PolarHBondContact O-N 3.45Å; M1090-I1099 HydrophobicContact CE-CG2 3.83Å; M1090-I1099 HydrophobicContact CG-CB 4.36Å; M1090-I1099 HydrophobicContact CG-CG1 4.11Å; M1090-I1099 HydrophobicContact CG-CG2 3.9Å; M1090-L1114 HydrophobicContact CE-CD2 4.2Å; M1090-L1118 HydrophobicContact CE-CD2 3.58Å; M1090-L1118 HydrophobicContact CE-CG 4.17Å; M1090-L1118 HydrophobicContact SD-CD2 3.59Å; M1090-L1118 VanDerWaalsContact SD-CD2 3.59Å; M1090-F1125 HydrophobicContact CB-CD1 4.25Å; M1090-F1125 HydrophobicContact CB-CE1 4.02Å; M1090-F1125 HydrophobicContact SD-CD2 4.48Å; M1090-F1125 HydrophobicContact SD-CE1 4.23Å; M1090-F1125 HydrophobicContact SD-CE2 3.96Å; M1090-F1125 HydrophobicContact SD-CZ 3.84Å; M1090-Y1130 CarbonylContact O-C 3.07Å; M1090-G1131 VanDerWaalsContact O-CA 3.31Å; M1090-G1131 WeakPolarHBondContact O-CA 3.04Å; M1090-G1131 PolarHBondContact O-N 3.34Å; M1090-V1134 HydrophobicContact CB-CG2 4.21Å; M1090-V1134 HydrophobicContact CE-CG1 4.36Å; M1090-V1134 HydrophobicContact CG-CG1 4.09Å; M1090-V1134 HydrophobicContact CG-CG2 4.23Å
1091T98.4Very high98.2Very high40 Ų4036 Ų3625%0.24518%0.181CC..THydrogen-bonded Turntrans-107.41.9-177.849.90000113.4G1087 K1088 L1089 F1125 Q1128 Y1130G1087-T1091 PolarHBondContact O-OG1 3.47Å; K1088-T1091 PolarHBondContact O-N 3.44Å; K1088-T1091 PolarHBondContact O-OG1 3.24Å; K1088-T1091 VanDerWaalsContact O-OG1 3.12Å; L1089-T1091 PolarHBondContact O-N 3.27Å; L1089-T1091 VanDerWaalsContact O-N 3.13Å; T1091-F1125 HydrophobicContact CG2-CD1 3.73Å; T1091-F1125 HydrophobicContact CG2-CE1 3.76Å; T1091-Q1128 HydrophobicContact CG2-CG 3.96Å; T1091-Q1128 PolarHBondContact O-NE2 2.86Å; T1091-Q1128 VanDerWaalsContact O-NE2 3.09Å; T1091-Y1130 WeakPolarHBondContact O-CD2 3.38Å
1092D98.6Very high98.3Very high19 Ų1934.4 Ų34.410%0.10217%0.174CC..SBendtrans-91.3142.5179-173.6104.6000111.5R1055 K1088 L1089 F1094 G1095 N1096R1055-D1092 IonicContact CZ-OD1 3.12Å; R1055-D1092 IonicContact NE-OD1 2.71Å; R1055-D1092 PolarHBondContact NE-OD1 3.09Å; R1055-D1092 IonicContact NH2-OD1 2.78Å; R1055-D1092 PolarHBondContact NH2-OD1 2.78Å; K1088-D1092 WeakPolarHBondContact O-CB 3.34Å; K1088-D1092 PolarHBondContact O-N 3.37Å; K1088-D1092 VanDerWaalsContact O-N 3.12Å; L1089-D1092 PolarHBondContact O-N 2.84Å; L1089-D1092 VanDerWaalsContact O-N 3.12Å; D1092-F1094 PolarHBondContact O-N 3.41Å; D1092-F1094 PolarHBondContact OD2-N 3.33Å; D1092-G1095 PolarHBondContact OD2-N 3.15Å; D1092-N1096 WeakPolarHBondContact O-CB 3.3Å; D1092-N1096 PolarHBondContact O-N 2.79Å; D1092-N1096 PolarHBondContact O-ND2 3.39Å
1093V98.2Very high98.3Very high56 Ų5634.4 Ų34.434%0.33917%0.174SC..THydrogen-bonded Turntrans-60.2-28.9-176.359.80000113.7N1096 Y1097 Y1130V1093-N1096 PolarHBondContact O-ND2 2.84Å; V1093-N1096 VanDerWaalsContact O-ND2 3.12Å; V1093-Y1097 VanDerWaalsContact O-CE2 3.32Å; V1093-Y1097 WeakPolarHBondContact O-CE2 3.27Å; V1093-Y1130 HydrophobicContact CB-CE1 4.05Å; V1093-Y1130 HydrophobicContact CB-CE2 3.97Å; V1093-Y1130 WeakPolarHBondContact CB-OH 3.43Å; V1093-Y1130 HydrophobicContact CG2-CE1 3.87Å; V1093-Y1130 WeakPolarHBondContact CG2-OH 3.44Å
1094F98.4Very high98.3Very high59 Ų5934.9 Ų34.926%0.25918%0.175SC..THydrogen-bonded Turntrans-112.2-31.4176.4-52.8-53.7000112.3A1054 R1055 Q1057 S1060 D1092 N1096A1054-F1094 CarbonylContact O-C 3.41Å; A1054-F1094 VanDerWaalsContact O-C 3.25Å; R1055-F1094 WeakPolarHBondContact O-CD2 3.23Å; Q1057-F1094 HydrophobicContact CB-CD1 4.22Å; Q1057-F1094 HydrophobicContact CB-CD2 4.35Å; Q1057-F1094 HydrophobicContact CB-CE1 3.81Å; Q1057-F1094 HydrophobicContact CB-CE2 3.94Å; Q1057-F1094 HydrophobicContact CB-CG 4.49Å; Q1057-F1094 HydrophobicContact CB-CZ 3.65Å; Q1057-F1094 HydrophobicContact CG-CD1 4.35Å; Q1057-F1094 HydrophobicContact CG-CE1 3.76Å; Q1057-F1094 HydrophobicContact CG-CZ 3.98Å; S1060-F1094 PolarHBondContact OG-O 3.39Å; D1092-F1094 PolarHBondContact O-N 3.41Å; D1092-F1094 PolarHBondContact OD2-N 3.33Å; F1094-N1096 VanDerWaalsContact C-N 3.3Å; F1094-N1096 PolarHBondContact O-N 2.71Å
1095G98.5Very high98.2Very high0 Ų033.9 Ų33.90%016%0.163CC..Hα-helixtrans-64.3-30.2-179.200000114.4A1054 L1089 D1092 Y1097 V1098 I1099A1054-G1095 WeakPolarHBondContact O-CA 3.28Å; A1054-G1095 PolarHBondContact O-N 3.37Å; L1089-G1095 CarbonylContact O-C 3.06Å; D1092-G1095 PolarHBondContact OD2-N 3.15Å; G1095-Y1097 PolarHBondContact O-N 3.32Å; G1095-V1098 PolarHBondContact O-N 3.34Å; G1095-V1098 VanDerWaalsContact O-N 3.15Å; G1095-I1099 PolarHBondContact O-N 2.92Å
1096N98.7Very high98.2Very high0 Ų030.5 Ų30.50%015%0.15CC..Hα-helixtrans-63.7-30.9-174.774.788.6000112.4L1089 D1092 V1093 F1094 I1099 Q1100 V1134L1089-N1096 VanDerWaalsContact O-CA 3.27Å; L1089-N1096 WeakPolarHBondContact O-CA 3.21Å; L1089-N1096 PolarHBondContact O-N 2.72Å; D1092-N1096 WeakPolarHBondContact O-CB 3.3Å; D1092-N1096 PolarHBondContact O-N 2.79Å; D1092-N1096 PolarHBondContact O-ND2 3.39Å; V1093-N1096 PolarHBondContact O-ND2 2.84Å; V1093-N1096 VanDerWaalsContact O-ND2 3.12Å; F1094-N1096 VanDerWaalsContact C-N 3.3Å; F1094-N1096 PolarHBondContact O-N 2.71Å; N1096-I1099 PolarHBondContact O-N 3.39Å; N1096-Q1100 WeakPolarHBondContact O-CG 3.45Å; N1096-Q1100 PolarHBondContact O-N 2.74Å; N1096-Q1100 PolarHBondContact O-NE2 2.73Å; N1096-Q1100 PolarHBondContact OD1-NE2 3.12Å; N1096-V1134 HydrophobicContact CB-CG2 4.06Å
1097Y98.7Very high98.1Very high107 Ų10732.4 Ų32.442%0.4216%0.161SC..Hα-helixtrans-70.8-34.1178.5-60.3-75.8000112.5Q1064 V1093 G1095 Q1100 K1101Q1064-Y1097 VanDerWaalsContact NE2-CB 3.32Å; V1093-Y1097 VanDerWaalsContact O-CE2 3.32Å; V1093-Y1097 WeakPolarHBondContact O-CE2 3.27Å; G1095-Y1097 PolarHBondContact O-N 3.32Å; Y1097-Q1100 PolarHBondContact O-N 2.75Å; Y1097-K1101 WeakPolarHBondContact O-CG 3.2Å; Y1097-K1101 PolarHBondContact O-N 2.81Å
1098V98.6Very high98Very high0 Ų038.4 Ų38.40%018%0.182CC..Hα-helixtrans-65.2-43.9174.4179.80000110.1A1054 I1063 L1067 I1082 G1095 Q1100 K1101 F1102A1054-V1098 HydrophobicContact CB-CB 4.49Å; A1054-V1098 HydrophobicContact CB-CG2 3.97Å; I1063-V1098 HydrophobicContact CB-CG2 4.29Å; I1063-V1098 HydrophobicContact CG2-CB 4.5Å; I1063-V1098 HydrophobicContact CG2-CG1 3.75Å; I1063-V1098 HydrophobicContact CG2-CG2 3.95Å; L1067-V1098 HydrophobicContact CD1-CG1 4.19Å; I1082-V1098 HydrophobicContact CD1-CG1 3.92Å; G1095-V1098 PolarHBondContact O-N 3.34Å; G1095-V1098 VanDerWaalsContact O-N 3.15Å; V1098-Q1100 VanDerWaalsContact C-N 3.34Å; V1098-Q1100 PolarHBondContact O-N 2.86Å; V1098-K1101 PolarHBondContact O-N 2.96Å; V1098-F1102 HydrophobicContact CG1-CD2 4.33Å; V1098-F1102 HydrophobicContact CG1-CE2 4.29Å; V1098-F1102 WeakPolarHBondContact O-CD2 3.36Å; V1098-F1102 PolarHBondContact O-N 2.7Å; V1098-F1102 VanDerWaalsContact O-N 3.14Å
1099I98.7Very high97.9Very high0 Ų037 Ų370%018%0.177CC..Hα-helixtrans-63.7-39.9175.4-54.4-63.8000111.2I1082 L1089 M1090 G1095 N1096 K1101 F1102 F1103 L1114 V1134I1082-I1099 HydrophobicContact CD1-CD1 4.14Å; L1089-I1099 HydrophobicContact CB-CD1 4Å; L1089-I1099 HydrophobicContact CB-CG1 3.82Å; L1089-I1099 HydrophobicContact CD1-CD1 4.25Å; M1090-I1099 HydrophobicContact CE-CG2 3.83Å; M1090-I1099 HydrophobicContact CG-CB 4.36Å; M1090-I1099 HydrophobicContact CG-CG1 4.11Å; M1090-I1099 HydrophobicContact CG-CG2 3.9Å; G1095-I1099 PolarHBondContact O-N 2.92Å; N1096-I1099 PolarHBondContact O-N 3.39Å; I1099-K1101 PolarHBondContact O-N 3.22Å; I1099-F1102 PolarHBondContact O-N 3.37Å; I1099-F1103 HydrophobicContact CG2-CD2 4.11Å; I1099-F1103 HydrophobicContact CG2-CE2 3.97Å; I1099-F1103 WeakPolarHBondContact O-CD2 3.33Å; I1099-F1103 PolarHBondContact O-N 3.1Å; I1099-L1114 HydrophobicContact CD1-CD2 4.45Å; I1099-L1114 HydrophobicContact CG2-CD1 4.17Å; I1099-L1114 HydrophobicContact CG2-CD2 4.28Å; I1099-V1134 HydrophobicContact CG2-CG1 3.73Å
1100Q98.7Very high97.9Very high31 Ų3137.1 Ų37.115%0.14518%0.178CC..Hα-helixtrans-60.7-41.7173.2-75.4178.784.400112.3N1096 Y1097 V1098 F1102 F1103 E1104 V1134 K1137N1096-Q1100 WeakPolarHBondContact O-CG 3.45Å; N1096-Q1100 PolarHBondContact O-N 2.74Å; N1096-Q1100 PolarHBondContact O-NE2 2.73Å; N1096-Q1100 PolarHBondContact OD1-NE2 3.12Å; Y1097-Q1100 PolarHBondContact O-N 2.75Å; V1098-Q1100 VanDerWaalsContact C-N 3.34Å; V1098-Q1100 PolarHBondContact O-N 2.86Å; Q1100-F1102 VanDerWaalsContact C-N 3.28Å; Q1100-F1102 PolarHBondContact O-N 3.21Å; Q1100-F1103 PolarHBondContact O-N 3.23Å; Q1100-F1103 VanDerWaalsContact O-N 3.16Å; Q1100-E1104 WeakPolarHBondContact O-CB 3.3Å; Q1100-E1104 PolarHBondContact O-N 2.93Å; Q1100-V1134 HydrophobicContact CG-CG2 4.3Å; Q1100-K1137 HydrophobicContact CB-CB 4.33Å; Q1100-K1137 HydrophobicContact CB-CG 4.05Å; Q1100-K1137 HydrophobicContact CG-CB 3.88Å; Q1100-K1137 HydrophobicContact CG-CG 4.17Å
1101K98.5Very high97.8Very high31 Ų3138.8 Ų38.814%0.13519%0.185CC..Hα-helixtrans-65.1-27.3175.9-73.6-72.6163.7-1640113.5Q1064 L1067 E1068 Y1097 V1098 I1099 E1104 F1105Q1064-K1101 HydrophobicContact CB-CG 4.11Å; Q1064-K1101 HydrophobicContact CG-CG 3.96Å; L1067-K1101 HydrophobicContact CD1-CB 4.06Å; E1068-K1101 HydrophobicContact CG-CD 4.39Å; E1068-K1101 WeakPolarHBondContact OE1-CE 3.37Å; E1068-K1101 IonicContact OE1-NZ 3.87Å; E1068-K1101 PolarHBondContact OE1-NZ 3.01Å; Y1097-K1101 WeakPolarHBondContact O-CG 3.2Å; Y1097-K1101 PolarHBondContact O-N 2.81Å; V1098-K1101 PolarHBondContact O-N 2.96Å; I1099-K1101 PolarHBondContact O-N 3.22Å; K1101-E1104 WeakPolarHBondContact CD-OE2 3.32Å; K1101-E1104 WeakPolarHBondContact CE-OE2 3.33Å; K1101-E1104 IonicContact NZ-OE1 2.74Å; K1101-E1104 IonicContact NZ-OE2 2.66Å; K1101-E1104 PolarHBondContact NZ-OE2 2.77Å; K1101-E1104 PolarHBondContact O-N 2.9Å; K1101-F1105 HydrophobicContact CD-CD2 3.83Å; K1101-F1105 HydrophobicContact CD-CE2 3.72Å; K1101-F1105 PolarHBondContact O-N 3.25Å
1102F98.5Very high97.7Very high2 Ų240.1 Ų40.11%0.00919%0.189CC..Hα-helixtrans-75.6-36.1169.6-86.3-78.2000113.6L1067 K1075 V1078 F1079 I1082 V1098 I1099 Q1100 E1104 G1106 L1114L1067-F1102 HydrophobicContact CD1-CD2 3.97Å; L1067-F1102 HydrophobicContact CD1-CE2 3.54Å; L1067-F1102 HydrophobicContact CD1-CZ 4.18Å; L1067-F1102 HydrophobicContact CD2-CE1 4.26Å; L1067-F1102 HydrophobicContact CD2-CE2 3.82Å; L1067-F1102 HydrophobicContact CD2-CZ 3.57Å; L1067-F1102 HydrophobicContact CG-CE2 4.36Å; K1075-F1102 HydrophobicContact CB-CE1 4.31Å; V1078-F1102 HydrophobicContact CB-CE2 4.41Å; V1078-F1102 HydrophobicContact CB-CZ 3.94Å; V1078-F1102 HydrophobicContact CG1-CE2 3.63Å; V1078-F1102 HydrophobicContact CG1-CZ 3.68Å; F1079-F1102 HydrophobicContact CB-CE1 3.78Å; F1079-F1102 HydrophobicContact CB-CZ 3.98Å; F1079-F1102 AromaticContact CD2-CD1 3.51Å; F1079-F1102 HydrophobicContact CD2-CD1 3.51Å; F1079-F1102 HydrophobicContact CD2-CD2 4.43Å; F1079-F1102 AromaticContact CD2-CE1 3.63Å; F1079-F1102 HydrophobicContact CD2-CE1 3.63Å; F1079-F1102 AromaticContact CD2-CG 3.93Å; F1079-F1102 HydrophobicContact CD2-CG 3.93Å; F1079-F1102 HydrophobicContact CD2-CZ 4.16Å; F1079-F1102 HydrophobicContact CE2-CD1 4.12Å; F1079-F1102 HydrophobicContact CE2-CG 4.35Å; F1079-F1102 HydrophobicContact CG-CD1 4.4Å; F1079-F1102 HydrophobicContact CG-CE1 4.14Å; I1082-F1102 HydrophobicContact CD1-CD2 3.54Å; I1082-F1102 HydrophobicContact CD1-CE2 3.41Å; I1082-F1102 VanDerWaalsContact CD1-CE2 3.41Å; I1082-F1102 HydrophobicContact CD1-CZ 4.32Å; V1098-F1102 HydrophobicContact CG1-CD2 4.33Å; V1098-F1102 HydrophobicContact CG1-CE2 4.29Å; V1098-F1102 WeakPolarHBondContact O-CD2 3.36Å; V1098-F1102 PolarHBondContact O-N 2.7Å; V1098-F1102 VanDerWaalsContact O-N 3.14Å; I1099-F1102 PolarHBondContact O-N 3.37Å; Q1100-F1102 VanDerWaalsContact C-N 3.28Å; Q1100-F1102 PolarHBondContact O-N 3.21Å; F1102-E1104 VanDerWaalsContact C-N 3.26Å; F1102-E1104 PolarHBondContact O-N 3.41Å; F1102-G1106 VanDerWaalsContact O-CA 3.25Å; F1102-G1106 WeakPolarHBondContact O-CA 3.36Å; F1102-G1106 PolarHBondContact O-N 3.17Å; F1102-L1114 HydrophobicContact CB-CD1 3.66Å
1103F98.2Very high97.6Very high0 Ų041.7 Ų41.70%020%0.197CC..Hα-helixtrans-63.7-33.3168-81.2-64.8000112I1099 Q1100 K1111 L1114 L1118 V1134 K1137 A1138 S1141 V1142I1099-F1103 HydrophobicContact CG2-CD2 4.11Å; I1099-F1103 HydrophobicContact CG2-CE2 3.97Å; I1099-F1103 WeakPolarHBondContact O-CD2 3.33Å; I1099-F1103 PolarHBondContact O-N 3.1Å; Q1100-F1103 PolarHBondContact O-N 3.23Å; Q1100-F1103 VanDerWaalsContact O-N 3.16Å; F1103-K1111 WeakPolarHBondContact O-CD 3.38Å; F1103-K1111 WeakPolarHBondContact O-CE 3.29Å; F1103-K1111 PolarHBondContact O-NZ 3Å; F1103-L1114 HydrophobicContact CD2-CD1 4.17Å; F1103-L1114 HydrophobicContact CE1-CB 3.81Å; F1103-L1114 HydrophobicContact CE2-CB 3.94Å; F1103-L1114 HydrophobicContact CE2-CD1 4.06Å; F1103-L1114 HydrophobicContact CG-CD1 4.48Å; F1103-L1114 HydrophobicContact CZ-CB 3.41Å; F1103-L1114 VanDerWaalsContact CZ-CB 3.41Å; F1103-L1114 HydrophobicContact CZ-CD1 4.26Å; F1103-L1114 HydrophobicContact CZ-CG 4.46Å; F1103-L1118 HydrophobicContact CE2-CD1 4.44Å; F1103-L1118 HydrophobicContact CZ-CD1 3.86Å; F1103-V1134 HydrophobicContact CD2-CG1 3.94Å; F1103-V1134 HydrophobicContact CE2-CG1 3.58Å; F1103-K1137 HydrophobicContact CB-CG 3.92Å; F1103-A1138 HydrophobicContact CD1-CB 3.94Å; F1103-A1138 HydrophobicContact CD2-CB 4.24Å; F1103-A1138 HydrophobicContact CE1-CB 3.7Å; F1103-A1138 HydrophobicContact CE2-CB 4.01Å; F1103-A1138 HydrophobicContact CG-CB 4.2Å; F1103-A1138 HydrophobicContact CZ-CB 3.72Å; F1103-S1141 WeakPolarHBondContact O-CB 3.47Å; F1103-S1141 PolarHBondContact O-OG 3.26Å; F1103-V1142 HydrophobicContact CD1-CG1 3.82Å; F1103-V1142 HydrophobicContact CE1-CG1 3.75Å
1104E97.5Very high97.6Very high45 Ų4539 Ų3921%0.2118%0.181CC..Hα-helixtrans-73.8-65.1176.4-162.8173.2-166.600112Q255 Q1100 K1101 F1102 K1111Q255-E1104 PolarHBondContact NE2-OE1 2.97Å; Q1100-E1104 WeakPolarHBondContact O-CB 3.3Å; Q1100-E1104 PolarHBondContact O-N 2.93Å; K1101-E1104 WeakPolarHBondContact CD-OE2 3.32Å; K1101-E1104 WeakPolarHBondContact CE-OE2 3.33Å; K1101-E1104 IonicContact NZ-OE1 2.74Å; K1101-E1104 IonicContact NZ-OE2 2.66Å; K1101-E1104 PolarHBondContact NZ-OE2 2.77Å; K1101-E1104 PolarHBondContact O-N 2.9Å; F1102-E1104 VanDerWaalsContact C-N 3.26Å; F1102-E1104 PolarHBondContact O-N 3.41Å; E1104-K1111 PolarHBondContact O-NZ 3.2Å
1105F96.7Very high97.5Very high61 Ų6137 Ų3727%0.26817%0.174SC..Hα-helixtrans-110.35.5-167.5-56.9-69.8000116E1068 K1075 K1101E1068-F1105 HydrophobicContact CB-CE2 4.33Å; E1068-F1105 HydrophobicContact CG-CD2 4.18Å; E1068-F1105 HydrophobicContact CG-CE2 3.7Å; E1068-F1105 HydrophobicContact CG-CZ 4.28Å; K1075-F1105 PolarHBondContact NZ-O 3.22Å; K1101-F1105 HydrophobicContact CD-CD2 3.83Å; K1101-F1105 HydrophobicContact CD-CE2 3.72Å; K1101-F1105 PolarHBondContact O-N 3.25Å
1106G96.9Very high97.3Very high11 Ų1142.7 Ų42.711%0.11320%0.2CC..SBendtrans-74.5165.6175.600000113.4F1102 K1111F1102-G1106 VanDerWaalsContact O-CA 3.25Å; F1102-G1106 WeakPolarHBondContact O-CA 3.36Å; F1102-G1106 PolarHBondContact O-N 3.17Å; G1106-K1111 WeakPolarHBondContact O-CE 3.31Å
1107T96.2Very high97.2Very high39 Ų3947 Ų4724%0.23922%0.217CC..  trans-68.2162.5174.474.40000111.4T1072 E1109 Q1110 K1111T1072-T1107 HydrophobicContact CG2-CG2 3.77Å; T1107-E1109 VanDerWaalsContact C-N 3.27Å; T1107-E1109 PolarHBondContact O-N 3.46Å; T1107-Q1110 PolarHBondContact O-N 3.27Å; T1107-Q1110 VanDerWaalsContact O-N 3.11Å; T1107-Q1110 VanDerWaalsContact OG1-CG 3.31Å; T1107-Q1110 WeakPolarHBondContact OG1-CG 3.4Å; T1107-Q1110 PolarHBondContact OG1-N 3.12Å; T1107-Q1110 VanDerWaalsContact OG1-N 3.15Å; T1107-K1111 WeakPolarHBondContact O-CG 3.46Å; T1107-K1111 PolarHBondContact O-N 3.12Å
1108K95.3Very high97.1Very high148 Ų14842 Ų4264%0.64320%0.197SC*.Hα-helixtrans-51.6-47.8174.7178.7179167-179.80111.6Q1110 K1111 E1112K1108-Q1110 PolarHBondContact O-N 2.95Å; K1108-K1111 PolarHBondContact O-N 2.95Å; K1108-E1112 WeakPolarHBondContact CE-OE1 3.09Å; K1108-E1112 IonicContact NZ-OE1 3.4Å; K1108-E1112 WeakPolarHBondContact O-CG 3.36Å; K1108-E1112 PolarHBondContact O-N 3.09Å
1109E96.1Very high96.9Very high127 Ų12748.1 Ų48.159%0.59323%0.226SC*.Hα-helixtrans-59.5-44.1176.4179.9-178.4-163.700112.6T1107 K1111 E1112 L1113T1107-E1109 VanDerWaalsContact C-N 3.27Å; T1107-E1109 PolarHBondContact O-N 3.46Å; E1109-K1111 VanDerWaalsContact C-N 3.34Å; E1109-K1111 PolarHBondContact O-N 2.97Å; E1109-E1112 PolarHBondContact O-N 3.14Å; E1109-L1113 HydrophobicContact CG-CD1 4.05Å; E1109-L1113 WeakPolarHBondContact O-CB 3.42Å; E1109-L1113 VanDerWaalsContact O-CG 3.32Å; E1109-L1113 WeakPolarHBondContact O-CG 3.32Å; E1109-L1113 PolarHBondContact O-N 3.01Å
1110Q97.5Very high96.8Very high3 Ų351.1 Ų51.11%0.01426%0.257CS..Hα-helixtrans-62.4-40.1176.1-70.4170.8-5.600112N1076 F1079 T1107 K1108 L1114N1076-Q1110 PolarHBondContact OD1-NE2 2.89Å; F1079-Q1110 HydrophobicContact CB-CG 4.48Å; F1079-Q1110 HydrophobicContact CD1-CB 4.43Å; F1079-Q1110 HydrophobicContact CD1-CG 3.78Å; F1079-Q1110 HydrophobicContact CD2-CB 4.12Å; F1079-Q1110 HydrophobicContact CD2-CG 3.98Å; F1079-Q1110 HydrophobicContact CE1-CB 4.09Å; F1079-Q1110 HydrophobicContact CE1-CG 3.86Å; F1079-Q1110 HydrophobicContact CE2-CB 3.75Å; F1079-Q1110 HydrophobicContact CE2-CG 4.07Å; F1079-Q1110 HydrophobicContact CG-CB 4.43Å; F1079-Q1110 HydrophobicContact CG-CG 3.82Å; F1079-Q1110 HydrophobicContact CZ-CB 3.73Å; F1079-Q1110 HydrophobicContact CZ-CG 4Å; F1079-Q1110 VanDerWaalsContact CZ-O 3.29Å; F1079-Q1110 WeakPolarHBondContact CZ-O 3.45Å; T1107-Q1110 PolarHBondContact O-N 3.27Å; T1107-Q1110 VanDerWaalsContact O-N 3.11Å; T1107-Q1110 VanDerWaalsContact OG1-CG 3.31Å; T1107-Q1110 WeakPolarHBondContact OG1-CG 3.4Å; T1107-Q1110 PolarHBondContact OG1-N 3.12Å; T1107-Q1110 VanDerWaalsContact OG1-N 3.15Å; K1108-Q1110 PolarHBondContact O-N 2.95Å; Q1110-L1114 WeakPolarHBondContact O-CG 3.49Å; Q1110-L1114 PolarHBondContact O-N 2.96Å
1111K97.5Very high96.8Very high35 Ų3553.9 Ų53.915%0.15227%0.269CS..Hα-helixtrans-66.2-42.3175.9-62.8-176.4-165.1-154.30111.3F1103 E1104 G1106 T1107 K1108 E1109 L1114 S1115F1103-K1111 WeakPolarHBondContact O-CD 3.38Å; F1103-K1111 WeakPolarHBondContact O-CE 3.29Å; F1103-K1111 PolarHBondContact O-NZ 3Å; E1104-K1111 PolarHBondContact O-NZ 3.2Å; G1106-K1111 WeakPolarHBondContact O-CE 3.31Å; T1107-K1111 WeakPolarHBondContact O-CG 3.46Å; T1107-K1111 PolarHBondContact O-N 3.12Å; K1108-K1111 PolarHBondContact O-N 2.95Å; E1109-K1111 VanDerWaalsContact C-N 3.34Å; E1109-K1111 PolarHBondContact O-N 2.97Å; K1111-L1114 PolarHBondContact O-N 3.36Å; K1111-S1115 PolarHBondContact O-N 2.96Å; K1111-S1115 PolarHBondContact O-OG 3.38Å
1112E95.2Very high96.8Very high68 Ų6852.4 Ų52.432%0.31826%0.263SS..Hα-helixtrans-64.1-43.7176.4-73.6168165.700112.1K1108 E1109 L1114 S1115 Q1116K1108-E1112 WeakPolarHBondContact CE-OE1 3.09Å; K1108-E1112 IonicContact NZ-OE1 3.4Å; K1108-E1112 WeakPolarHBondContact O-CG 3.36Å; K1108-E1112 PolarHBondContact O-N 3.09Å; E1109-E1112 PolarHBondContact O-N 3.14Å; E1112-L1114 PolarHBondContact O-N 2.85Å; E1112-S1115 WeakPolarHBondContact O-CB 3.34Å; E1112-S1115 PolarHBondContact O-N 3.39Å; E1112-Q1116 WeakPolarHBondContact O-CG 3.43Å; E1112-Q1116 PolarHBondContact O-N 3.49Å
1113L96.7Very high96.7Very high53 Ų5353.1 Ų53.128%0.27727%0.268SS..Hα-helixtrans-63.2-39.5174.2-72.9169.3000112F1079 L1083 E1109 Q1116 R1117F1079-L1113 HydrophobicContact CE1-CB 4.14Å; F1079-L1113 HydrophobicContact CE1-CD1 3.89Å; F1079-L1113 HydrophobicContact CZ-CB 4.03Å; L1083-L1113 HydrophobicContact CD1-CB 4.38Å; L1083-L1113 HydrophobicContact CD2-CD1 4.4Å; E1109-L1113 HydrophobicContact CG-CD1 4.05Å; E1109-L1113 WeakPolarHBondContact O-CB 3.42Å; E1109-L1113 VanDerWaalsContact O-CG 3.32Å; E1109-L1113 WeakPolarHBondContact O-CG 3.32Å; E1109-L1113 PolarHBondContact O-N 3.01Å; L1113-Q1116 PolarHBondContact O-N 3.36Å; L1113-R1117 WeakPolarHBondContact O-CG 3.46Å; L1113-R1117 PolarHBondContact O-N 3.21Å; L1113-R1117 VanDerWaalsContact O-N 3.17Å
1114L97.7Very high96.7Very high0 Ų058.7 Ų58.70%029%0.294CS..Hα-helixtrans-67-38.7172.6-72.9176000112.5F1079 L1083 M1090 I1099 F1102 F1103 Q1110 K1111 E1112 Q1116 R1117 L1118F1079-L1114 HydrophobicContact CE2-CD1 3.96Å; F1079-L1114 HydrophobicContact CE2-CD2 4.1Å; F1079-L1114 HydrophobicContact CE2-CG 3.74Å; F1079-L1114 HydrophobicContact CZ-CD2 4.41Å; F1079-L1114 HydrophobicContact CZ-CG 4Å; L1083-L1114 HydrophobicContact CD1-CD2 4.26Å; M1090-L1114 HydrophobicContact CE-CD2 4.2Å; I1099-L1114 HydrophobicContact CD1-CD2 4.45Å; I1099-L1114 HydrophobicContact CG2-CD1 4.17Å; I1099-L1114 HydrophobicContact CG2-CD2 4.28Å; F1102-L1114 HydrophobicContact CB-CD1 3.66Å; F1103-L1114 HydrophobicContact CD2-CD1 4.17Å; F1103-L1114 HydrophobicContact CE1-CB 3.81Å; F1103-L1114 HydrophobicContact CE2-CB 3.94Å; F1103-L1114 HydrophobicContact CE2-CD1 4.06Å; F1103-L1114 HydrophobicContact CG-CD1 4.48Å; F1103-L1114 HydrophobicContact CZ-CB 3.41Å; F1103-L1114 VanDerWaalsContact CZ-CB 3.41Å; F1103-L1114 HydrophobicContact CZ-CD1 4.26Å; F1103-L1114 HydrophobicContact CZ-CG 4.46Å; Q1110-L1114 WeakPolarHBondContact O-CG 3.49Å; Q1110-L1114 PolarHBondContact O-N 2.96Å; K1111-L1114 PolarHBondContact O-N 3.36Å; E1112-L1114 PolarHBondContact O-N 2.85Å; L1114-Q1116 VanDerWaalsContact C-N 3.33Å; L1114-Q1116 PolarHBondContact O-N 3.37Å; L1114-R1117 WeakPolarHBondContact O-CB 3.29Å; L1114-R1117 PolarHBondContact O-N 3.43Å; L1114-L1118 PolarHBondContact O-N 2.81Å; L1114-L1118 VanDerWaalsContact O-N 3.14Å
1115S96.5Very high96.8Very high17 Ų1757 Ų5712%0.11929%0.285CS..Hα-helixtrans-60.3-40.3172.8-74.50000112.3K1111 E1112 R1117 L1118 Q1119K1111-S1115 PolarHBondContact O-N 2.96Å; K1111-S1115 PolarHBondContact O-OG 3.38Å; E1112-S1115 WeakPolarHBondContact O-CB 3.34Å; E1112-S1115 PolarHBondContact O-N 3.39Å; S1115-R1117 VanDerWaalsContact C-N 3.26Å; S1115-R1117 PolarHBondContact O-N 3.16Å; S1115-L1118 WeakPolarHBondContact O-CB 3.4Å; S1115-L1118 PolarHBondContact O-N 3.08Å; S1115-L1118 VanDerWaalsContact O-N 3.08Å; S1115-Q1119 PolarHBondContact O-N 3.07Å
1116Q95Very high96.8Very high118 Ų11854 Ų5455%0.55127%0.273SS*.Hα-helixtrans-61.8-33.4172.5-68.1167.428.100112.2E1112 L1113 L1114 L1118 Q1119E1112-Q1116 WeakPolarHBondContact O-CG 3.43Å; E1112-Q1116 PolarHBondContact O-N 3.49Å; L1113-Q1116 PolarHBondContact O-N 3.36Å; L1114-Q1116 VanDerWaalsContact C-N 3.33Å; L1114-Q1116 PolarHBondContact O-N 3.37Å; Q1116-L1118 VanDerWaalsContact C-N 3.3Å; Q1116-L1118 PolarHBondContact O-N 3.37Å; Q1116-Q1119 WeakPolarHBondContact O-CB 3.38Å; Q1116-Q1119 PolarHBondContact O-N 3.22Å
1117R96Very high96.9Very high92 Ų9254.8 Ų54.835%0.34728%0.275SS..Hα-helixtrans-74.3-17.1174.9-60.2-70.4-75.2112.1-9.3113.5L1083 P1084 S1086 L1113 L1114 S1115L1083-R1117 HydrophobicContact CD1-CG 3.83Å; L1083-R1117 PolarHBondContact O-NE 3.07Å; P1084-R1117 PolarHBondContact O-NH2 3.29Å; S1086-R1117 PolarHBondContact OG-NE 3.19Å; L1113-R1117 WeakPolarHBondContact O-CG 3.46Å; L1113-R1117 PolarHBondContact O-N 3.21Å; L1113-R1117 VanDerWaalsContact O-N 3.17Å; L1114-R1117 WeakPolarHBondContact O-CB 3.29Å; L1114-R1117 PolarHBondContact O-N 3.43Å; S1115-R1117 VanDerWaalsContact C-N 3.26Å; S1115-R1117 PolarHBondContact O-N 3.16Å
1118L96.6Very high97Very high0 Ų055.6 Ų55.60%028%0.276CS..Hα-helixtrans-82.3-25.1171.3-63.7177.7000112.9M1090 F1103 L1114 S1115 Q1116 G1120 H1121 V1122 F1125 I1135 A1138 I1150M1090-L1118 HydrophobicContact CE-CD2 3.58Å; M1090-L1118 HydrophobicContact CE-CG 4.17Å; M1090-L1118 HydrophobicContact SD-CD2 3.59Å; M1090-L1118 VanDerWaalsContact SD-CD2 3.59Å; F1103-L1118 HydrophobicContact CE2-CD1 4.44Å; F1103-L1118 HydrophobicContact CZ-CD1 3.86Å; L1114-L1118 PolarHBondContact O-N 2.81Å; L1114-L1118 VanDerWaalsContact O-N 3.14Å; S1115-L1118 WeakPolarHBondContact O-CB 3.4Å; S1115-L1118 PolarHBondContact O-N 3.08Å; S1115-L1118 VanDerWaalsContact O-N 3.08Å; Q1116-L1118 VanDerWaalsContact C-N 3.3Å; Q1116-L1118 PolarHBondContact O-N 3.37Å; L1118-G1120 PolarHBondContact O-N 2.77Å; L1118-H1121 CarbonylContact O-C 3.47Å; L1118-H1121 WeakPolarHBondContact O-CA 3.47Å; L1118-H1121 PolarHBondContact O-N 2.82Å; L1118-V1122 HydrophobicContact CB-CG2 4.33Å; L1118-V1122 PolarHBondContact O-N 3.28Å; L1118-F1125 HydrophobicContact CD2-CD2 3.62Å; L1118-F1125 HydrophobicContact CD2-CE2 3.87Å; L1118-F1125 HydrophobicContact CD2-CG 4.45Å; L1118-I1135 HydrophobicContact CD1-CD1 3.82Å; L1118-I1135 HydrophobicContact CD2-CD1 3.7Å; L1118-I1135 HydrophobicContact CG-CD1 4.26Å; L1118-A1138 HydrophobicContact CD1-CB 4.04Å; L1118-I1150 HydrophobicContact CD1-CD1 4.1Å
1119Q94.9Very high97.2Very high130 Ų13053.3 Ų53.361%0.60727%0.269SS*.THydrogen-bonded Turntrans-60.3134.7-172.8-167.3177.63.900112.1S1115 Q1116 H1121 E1153S1115-Q1119 PolarHBondContact O-N 3.07Å; Q1116-Q1119 WeakPolarHBondContact O-CB 3.38Å; Q1116-Q1119 PolarHBondContact O-N 3.22Å; Q1119-H1121 PolarHBondContact O-N 2.83Å; Q1119-H1121 PolarHBondContact O-ND1 2.99Å; Q1119-E1153 WeakPolarHBondContact CA-OE1 3.24Å; Q1119-E1153 WeakPolarHBondContact CG-OE1 3.45Å
1120G96.6Very high97.3Very high63 Ų6350 Ų5065%0.64925%0.251SS*.THydrogen-bonded Turntrans76.8-7.2-173.100000114.8L1118 E1153L1118-G1120 PolarHBondContact O-N 2.77Å; G1120-E1153 WeakPolarHBondContact CA-OE2 3.23Å; G1120-E1153 VanDerWaalsContact N-CD 3.26Å; G1120-E1153 PolarHBondContact N-OE1 3.35Å; G1120-E1153 PolarHBondContact N-OE2 3.02Å; G1120-E1153 VanDerWaalsContact N-OE2 3.09Å
1121H97.7Very high97.3Very high88 Ų8849.9 Ų49.941%0.40725%0.251SS..THydrogen-bonded Turntrans-125.83-171.9-5681.3000112.6L1118 Q1119 V1123 E1124 F1125 E1153L1118-H1121 CarbonylContact O-C 3.47Å; L1118-H1121 WeakPolarHBondContact O-CA 3.47Å; L1118-H1121 PolarHBondContact O-N 2.82Å; Q1119-H1121 PolarHBondContact O-N 2.83Å; Q1119-H1121 PolarHBondContact O-ND1 2.99Å; H1121-V1123 PolarHBondContact O-N 3.15Å; H1121-V1123 VanDerWaalsContact O-N 3.16Å; H1121-E1124 IonicContact CD2-OE2 3.8Å; H1121-E1124 WeakPolarHBondContact O-CB 3.47Å; H1121-E1124 PolarHBondContact O-N 3.07Å; H1121-E1124 VanDerWaalsContact O-N 3.07Å; H1121-F1125 HydrophobicContact CB-CD2 3.87Å; H1121-F1125 HydrophobicContact CB-CE2 3.49Å; H1121-F1125 VanDerWaalsContact CB-CE2 3.49Å; H1121-F1125 HydrophobicContact CB-CZ 4.23Å; H1121-F1125 VanDerWaalsContact O-CD2 3.32Å; H1121-F1125 WeakPolarHBondContact O-CD2 3.08Å; H1121-F1125 PolarHBondContact O-N 2.78Å; H1121-F1125 VanDerWaalsContact O-N 3.08Å; H1121-E1153 PolarHBondContact N-OE2 2.74Å
1122V98.3Very high97.4Very high1 Ų148.2 Ų48.21%0.00624%0.243CC..Hα-helixtrans-56.7-39.4-173.4175.40000111.7L1118 A1126 I1135 I1150 E1153 L1154L1118-V1122 HydrophobicContact CB-CG2 4.33Å; L1118-V1122 PolarHBondContact O-N 3.28Å; V1122-A1126 WeakPolarHBondContact O-CB 3.44Å; V1122-A1126 PolarHBondContact O-N 3.42Å; V1122-I1135 HydrophobicContact CG1-CD1 4.27Å; V1122-I1150 HydrophobicContact CG1-CG2 3.77Å; V1122-I1150 HydrophobicContact CG2-CB 4.47Å; V1122-I1150 HydrophobicContact CG2-CG2 4.09Å; V1122-E1153 HydrophobicContact CB-CB 3.98Å; V1122-E1153 WeakPolarHBondContact CB-OE2 3.32Å; V1122-E1153 HydrophobicContact CG2-CB 4.24Å; V1122-E1153 HydrophobicContact CG2-CG 4.39Å; V1122-E1153 VanDerWaalsContact CG2-OE2 3.3Å; V1122-E1153 WeakPolarHBondContact CG2-OE2 3.47Å; V1122-E1153 PolarHBondContact N-OE2 3.02Å; V1122-L1154 HydrophobicContact CG1-CD2 3.92Å; V1122-L1154 HydrophobicContact CG1-CG 4.16Å
1123V97.9Very high97.5Very high17 Ų1750.4 Ų50.410%0.10325%0.249CC..Hα-helixtrans-71.1-34-178-177.60000112.1H1121 T1127 L1154 F1157H1121-V1123 PolarHBondContact O-N 3.15Å; H1121-V1123 VanDerWaalsContact O-N 3.16Å; V1123-T1127 PolarHBondContact O-N 3.45Å; V1123-T1127 PolarHBondContact O-OG1 2.99Å; V1123-L1154 HydrophobicContact CG2-CD2 4.11Å; V1123-F1157 HydrophobicContact CB-CD2 4.19Å; V1123-F1157 HydrophobicContact CB-CE2 4.5Å; V1123-F1157 HydrophobicContact CG1-CB 4.06Å; V1123-F1157 HydrophobicContact CG1-CD1 4.3Å; V1123-F1157 HydrophobicContact CG1-CD2 3.84Å; V1123-F1157 HydrophobicContact CG1-CE2 4.32Å; V1123-F1157 HydrophobicContact CG1-CG 3.81Å; V1123-F1157 HydrophobicContact CG2-CB 4.41Å; V1123-F1157 HydrophobicContact CG2-CD2 3.35Å; V1123-F1157 HydrophobicContact CG2-CE2 3.81Å; V1123-F1157 HydrophobicContact CG2-CG 4.1Å
1124E98Very high97.6Very high117 Ų11747.9 Ų47.955%0.54724%0.235SC..Hα-helixtrans-65.3-56.4174-175.3-175.5157.500109.4H1121 A1126 T1127 Q1128H1121-E1124 IonicContact CD2-OE2 3.8Å; H1121-E1124 WeakPolarHBondContact O-CB 3.47Å; H1121-E1124 PolarHBondContact O-N 3.07Å; H1121-E1124 VanDerWaalsContact O-N 3.07Å; E1124-A1126 VanDerWaalsContact C-N 3.35Å; E1124-A1126 PolarHBondContact O-N 3.25Å; E1124-T1127 PolarHBondContact O-N 2.88Å; E1124-T1127 PolarHBondContact O-OG1 2.69Å; E1124-Q1128 PolarHBondContact O-N 2.95Å
1125F98.5Very high97.7Very high8 Ų847.9 Ų47.94%0.03524%0.235CC..Hα-helixtrans-60.7-42178.4-63.2-51.4000112.2M1090 T1091 L1118 H1121 T1127 Q1128 G1131 C1132 I1135M1090-F1125 HydrophobicContact CB-CD1 4.25Å; M1090-F1125 HydrophobicContact CB-CE1 4.02Å; M1090-F1125 HydrophobicContact SD-CD2 4.48Å; M1090-F1125 HydrophobicContact SD-CE1 4.23Å; M1090-F1125 HydrophobicContact SD-CE2 3.96Å; M1090-F1125 HydrophobicContact SD-CZ 3.84Å; T1091-F1125 HydrophobicContact CG2-CD1 3.73Å; T1091-F1125 HydrophobicContact CG2-CE1 3.76Å; L1118-F1125 HydrophobicContact CD2-CD2 3.62Å; L1118-F1125 HydrophobicContact CD2-CE2 3.87Å; L1118-F1125 HydrophobicContact CD2-CG 4.45Å; H1121-F1125 HydrophobicContact CB-CD2 3.87Å; H1121-F1125 HydrophobicContact CB-CE2 3.49Å; H1121-F1125 VanDerWaalsContact CB-CE2 3.49Å; H1121-F1125 HydrophobicContact CB-CZ 4.23Å; H1121-F1125 VanDerWaalsContact O-CD2 3.32Å; H1121-F1125 WeakPolarHBondContact O-CD2 3.08Å; H1121-F1125 PolarHBondContact O-N 2.78Å; H1121-F1125 VanDerWaalsContact O-N 3.08Å; F1125-T1127 PolarHBondContact O-N 3.4Å; F1125-Q1128 PolarHBondContact O-N 2.81Å; F1125-G1131 CarbonylContact O-C 3.46Å; F1125-G1131 WeakPolarHBondContact O-CA 3.43Å; F1125-C1132 PolarHBondContact O-N 3.12Å; F1125-I1135 HydrophobicContact CB-CD1 3.93Å; F1125-I1135 HydrophobicContact CB-CG1 3.82Å
1126A98.6Very high97.8Very high0 Ų048.2 Ų48.20%024%0.235CC..Hα-helixtrans-61.9-28.8179.900000113.8V1122 E1124 C1132 L1154 N1166 G1167 V1170V1122-A1126 WeakPolarHBondContact O-CB 3.44Å; V1122-A1126 PolarHBondContact O-N 3.42Å; E1124-A1126 VanDerWaalsContact C-N 3.35Å; E1124-A1126 PolarHBondContact O-N 3.25Å; A1126-C1132 WeakPolarHBondContact O-CB 3.45Å; A1126-L1154 HydrophobicContact CB-CD2 4.24Å; A1126-N1166 CarbonylContact O-C 3.59Å; A1126-G1167 VanDerWaalsContact O-CA 3.26Å; A1126-G1167 WeakPolarHBondContact O-CA 3.41Å; A1126-G1167 PolarHBondContact O-N 3.39Å; A1126-G1167 VanDerWaalsContact O-N 3.12Å; A1126-V1170 HydrophobicContact CB-CB 4.14Å; A1126-V1170 HydrophobicContact CB-CG1 4.03Å; A1126-V1170 HydrophobicContact CB-CG2 3.85Å
1127T98.3Very high97.9Very high26 Ų2644.8 Ų44.816%0.1622%0.218CC..Hα-helixtrans-94.4-1.4175.954.70000113.6V1123 E1124 F1125 D1164 N1166V1123-T1127 PolarHBondContact O-N 3.45Å; V1123-T1127 PolarHBondContact O-OG1 2.99Å; E1124-T1127 PolarHBondContact O-N 2.88Å; E1124-T1127 PolarHBondContact O-OG1 2.69Å; F1125-T1127 PolarHBondContact O-N 3.4Å; T1127-D1164 HydrophobicContact CG2-CB 4.17Å; T1127-N1166 PolarHBondContact O-ND2 2.83Å
1128Q98.4Very high98Very high56 Ų5640.4 Ų40.426%0.26220%0.202SC..SBendtrans-95143177.5-152.6-87.42.400111.5T1091 E1124 F1125 Y1130 G1131 C1132T1091-Q1128 HydrophobicContact CG2-CG 3.96Å; T1091-Q1128 PolarHBondContact O-NE2 2.86Å; T1091-Q1128 VanDerWaalsContact O-NE2 3.09Å; E1124-Q1128 PolarHBondContact O-N 2.95Å; F1125-Q1128 PolarHBondContact O-N 2.81Å; Q1128-Y1130 VanDerWaalsContact C-N 3.32Å; Q1128-Y1130 PolarHBondContact O-N 3.17Å; Q1128-G1131 PolarHBondContact O-N 2.81Å; Q1128-C1132 VanDerWaalsContact O-CB 3.27Å; Q1128-C1132 WeakPolarHBondContact O-CB 3.46Å; Q1128-C1132 PolarHBondContact O-N 3.21Å; Q1128-C1132 PolarHBondContact O-SG 3.24Å
1129M98.2Very high98.1Very high100 Ų10040.4 Ų40.449%0.49320%0.202SC..THydrogen-bonded Turntrans-63.1-29.3-167.7-170.1168.969.900115.5N1166M1129-N1166 WeakPolarHBondContact CA-OD1 3.32Å; M1129-N1166 PolarHBondContact N-ND2 3.05Å
1130Y98.5Very high98.2Very high59 Ų5937.6 Ų37.623%0.23119%0.189CC..THydrogen-bonded Turntrans-104.8-38.8175.9-50-65.6000111.1M1090 T1091 V1093 Q1128 C1132 R1133 V1134M1090-Y1130 CarbonylContact O-C 3.07Å; T1091-Y1130 WeakPolarHBondContact O-CD2 3.38Å; V1093-Y1130 HydrophobicContact CB-CE1 4.05Å; V1093-Y1130 HydrophobicContact CB-CE2 3.97Å; V1093-Y1130 WeakPolarHBondContact CB-OH 3.43Å; V1093-Y1130 HydrophobicContact CG2-CE1 3.87Å; V1093-Y1130 WeakPolarHBondContact CG2-OH 3.44Å; Q1128-Y1130 VanDerWaalsContact C-N 3.32Å; Q1128-Y1130 PolarHBondContact O-N 3.17Å; Y1130-C1132 PolarHBondContact O-N 3.08Å; Y1130-R1133 VanDerWaalsContact O-CB 3.29Å; Y1130-R1133 WeakPolarHBondContact O-CB 3.25Å; Y1130-R1133 PolarHBondContact O-N 3.04Å; Y1130-V1134 PolarHBondContact O-N 3.31Å
1131G98.6Very high98.2Very high0 Ų036.3 Ų36.30%017%0.17CC..Hα-helixtrans-56.6-35.4177.100000112.9M1090 F1125 Q1128 R1133 V1134 I1135M1090-G1131 VanDerWaalsContact O-CA 3.31Å; M1090-G1131 WeakPolarHBondContact O-CA 3.04Å; M1090-G1131 PolarHBondContact O-N 3.34Å; F1125-G1131 CarbonylContact O-C 3.46Å; F1125-G1131 WeakPolarHBondContact O-CA 3.43Å; Q1128-G1131 PolarHBondContact O-N 2.81Å; G1131-R1133 PolarHBondContact O-N 3.2Å; G1131-V1134 WeakPolarHBondContact O-CB 3.25Å; G1131-V1134 PolarHBondContact O-N 2.96Å; G1131-V1134 VanDerWaalsContact O-N 3.1Å; G1131-I1135 PolarHBondContact O-N 3.13Å
1132C98.6Very high98.1Very high0 Ų032.4 Ų32.40%015%0.152CC..Hα-helixtrans-63.7-29178.274.20000112.2F1125 A1126 Q1128 Y1130 Q1136 N1166 V1170F1125-C1132 PolarHBondContact O-N 3.12Å; A1126-C1132 WeakPolarHBondContact O-CB 3.45Å; Q1128-C1132 VanDerWaalsContact O-CB 3.27Å; Q1128-C1132 WeakPolarHBondContact O-CB 3.46Å; Q1128-C1132 PolarHBondContact O-N 3.21Å; Q1128-C1132 PolarHBondContact O-SG 3.24Å; Y1130-C1132 PolarHBondContact O-N 3.08Å; C1132-Q1136 VanDerWaalsContact C-NE2 3.34Å; C1132-Q1136 WeakPolarHBondContact O-CB 3.32Å; C1132-Q1136 VanDerWaalsContact O-CG 3.29Å; C1132-Q1136 WeakPolarHBondContact O-CG 3.15Å; C1132-Q1136 PolarHBondContact O-N 2.97Å; C1132-Q1136 PolarHBondContact O-NE2 3.31Å; C1132-N1166 HydrophobicContact CB-CB 3.85Å; C1132-V1170 HydrophobicContact CB-CG2 4Å
1133R98.7Very high97.9Very high113 Ų11335.2 Ų35.243%0.42617%0.171SC..Hα-helixtrans-71.8-39.7175.6-52.3-59.5178.2167.6-0.4110.8Y1130 G1131 Q1136 K1137Y1130-R1133 VanDerWaalsContact O-CB 3.29Å; Y1130-R1133 WeakPolarHBondContact O-CB 3.25Å; Y1130-R1133 PolarHBondContact O-N 3.04Å; G1131-R1133 PolarHBondContact O-N 3.2Å; R1133-Q1136 PolarHBondContact O-N 3.01Å; R1133-K1137 PolarHBondContact O-N 3.2Å
1134V98.7Very high97.6Very high0 Ų037.1 Ų37.10%019%0.188CC..Hα-helixtrans-62.5-47.1172.4-174.50000111.2M1090 N1096 I1099 Q1100 F1103 Y1130 G1131 Q1136 K1137 A1138M1090-V1134 HydrophobicContact CB-CG2 4.21Å; M1090-V1134 HydrophobicContact CE-CG1 4.36Å; M1090-V1134 HydrophobicContact CG-CG1 4.09Å; M1090-V1134 HydrophobicContact CG-CG2 4.23Å; N1096-V1134 HydrophobicContact CB-CG2 4.06Å; I1099-V1134 HydrophobicContact CG2-CG1 3.73Å; Q1100-V1134 HydrophobicContact CG-CG2 4.3Å; F1103-V1134 HydrophobicContact CD2-CG1 3.94Å; F1103-V1134 HydrophobicContact CE2-CG1 3.58Å; Y1130-V1134 PolarHBondContact O-N 3.31Å; G1131-V1134 WeakPolarHBondContact O-CB 3.25Å; G1131-V1134 PolarHBondContact O-N 2.96Å; G1131-V1134 VanDerWaalsContact O-N 3.1Å; V1134-Q1136 VanDerWaalsContact C-N 3.32Å; V1134-Q1136 PolarHBondContact O-N 3.42Å; V1134-K1137 PolarHBondContact O-N 2.96Å; V1134-A1138 WeakPolarHBondContact O-CB 3.33Å; V1134-A1138 PolarHBondContact O-N 2.95Å
1135I98.6Very high97.4Very high0 Ų038.3 Ų38.30%019%0.193CC..Hα-helixtrans-60.5-42.4176.8-60.1-57.8000111.1L1118 V1122 F1125 G1131 A1138 L1139 I1150 V1170L1118-I1135 HydrophobicContact CD1-CD1 3.82Å; L1118-I1135 HydrophobicContact CD2-CD1 3.7Å; L1118-I1135 HydrophobicContact CG-CD1 4.26Å; V1122-I1135 HydrophobicContact CG1-CD1 4.27Å; F1125-I1135 HydrophobicContact CB-CD1 3.93Å; F1125-I1135 HydrophobicContact CB-CG1 3.82Å; G1131-I1135 PolarHBondContact O-N 3.13Å; I1135-A1138 PolarHBondContact O-N 3.27Å; I1135-L1139 HydrophobicContact CG2-CD1 4.05Å; I1135-L1139 HydrophobicContact CG2-CG 4.43Å; I1135-L1139 WeakPolarHBondContact O-CG 3.18Å; I1135-L1139 PolarHBondContact O-N 3.33Å; I1135-I1150 HydrophobicContact CG2-CG2 4.27Å; I1135-V1170 HydrophobicContact CB-CG2 4.05Å; I1135-V1170 HydrophobicContact CG2-CB 4.45Å; I1135-V1170 HydrophobicContact CG2-CG1 3.58Å; I1135-V1170 HydrophobicContact CG2-CG2 3.99Å
1136Q98.7Very high97.1Very high24 Ų2438.7 Ų38.711%0.11220%0.198CC..Hα-helixtrans-60-49.2175.6-77.8163.48400111.9C1132 R1133 V1134 A1138 L1139 E1140 V1170 K1173C1132-Q1136 VanDerWaalsContact C-NE2 3.34Å; C1132-Q1136 WeakPolarHBondContact O-CB 3.32Å; C1132-Q1136 VanDerWaalsContact O-CG 3.29Å; C1132-Q1136 WeakPolarHBondContact O-CG 3.15Å; C1132-Q1136 PolarHBondContact O-N 2.97Å; C1132-Q1136 PolarHBondContact O-NE2 3.31Å; R1133-Q1136 PolarHBondContact O-N 3.01Å; V1134-Q1136 VanDerWaalsContact C-N 3.32Å; V1134-Q1136 PolarHBondContact O-N 3.42Å; Q1136-A1138 VanDerWaalsContact C-N 3.33Å; Q1136-A1138 PolarHBondContact O-N 3.22Å; Q1136-L1139 PolarHBondContact O-N 3.22Å; Q1136-E1140 WeakPolarHBondContact O-CG 3.38Å; Q1136-E1140 PolarHBondContact O-N 3.31Å; Q1136-E1140 VanDerWaalsContact O-N 3.11Å; Q1136-V1170 HydrophobicContact CG-CG2 4.34Å; Q1136-K1173 HydrophobicContact CB-CG 4.18Å; Q1136-K1173 HydrophobicContact CG-CB 3.9Å; Q1136-K1173 HydrophobicContact CG-CG 4.08Å
1137K98.5Very high97Very high46 Ų4640.3 Ų40.320%0.221%0.205CC..Hα-helixtrans-65.4-34.9178.5-172.555.960.7-166.70112.5Q1100 F1103 R1133 V1134 E1140 S1141Q1100-K1137 HydrophobicContact CB-CB 4.33Å; Q1100-K1137 HydrophobicContact CB-CG 4.05Å; Q1100-K1137 HydrophobicContact CG-CB 3.88Å; Q1100-K1137 HydrophobicContact CG-CG 4.17Å; F1103-K1137 HydrophobicContact CB-CG 3.92Å; R1133-K1137 PolarHBondContact O-N 3.2Å; V1134-K1137 PolarHBondContact O-N 2.96Å; K1137-E1140 WeakPolarHBondContact CE-OE2 3.49Å; K1137-E1140 IonicContact NZ-OE2 2.75Å; K1137-E1140 PolarHBondContact NZ-OE2 2.94Å; K1137-E1140 PolarHBondContact O-N 3.3Å; K1137-S1141 WeakPolarHBondContact O-CB 3.33Å; K1137-S1141 PolarHBondContact O-N 3.11Å; K1137-S1141 VanDerWaalsContact O-N 3.1Å; K1137-S1141 PolarHBondContact O-OG 3.37Å; K1137-S1141 VanDerWaalsContact O-OG 3.1Å
1138A98.3Very high96.8Very high0 Ų042 Ų420%021%0.212CC..Hα-helixtrans-61.3-51.2172.300000111F1103 L1118 V1134 I1135 Q1136 E1140 S1141 V1142 I1150F1103-A1138 HydrophobicContact CD1-CB 3.94Å; F1103-A1138 HydrophobicContact CD2-CB 4.24Å; F1103-A1138 HydrophobicContact CE1-CB 3.7Å; F1103-A1138 HydrophobicContact CE2-CB 4.01Å; F1103-A1138 HydrophobicContact CG-CB 4.2Å; F1103-A1138 HydrophobicContact CZ-CB 3.72Å; L1118-A1138 HydrophobicContact CD1-CB 4.04Å; V1134-A1138 WeakPolarHBondContact O-CB 3.33Å; V1134-A1138 PolarHBondContact O-N 2.95Å; I1135-A1138 PolarHBondContact O-N 3.27Å; Q1136-A1138 VanDerWaalsContact C-N 3.33Å; Q1136-A1138 PolarHBondContact O-N 3.22Å; A1138-E1140 PolarHBondContact O-N 2.88Å; A1138-E1140 VanDerWaalsContact O-N 3.16Å; A1138-S1141 PolarHBondContact O-N 2.95Å; A1138-V1142 HydrophobicContact CB-CG1 4.4Å; A1138-V1142 WeakPolarHBondContact O-CG1 3.38Å; A1138-V1142 VanDerWaalsContact O-CG2 3.28Å; A1138-V1142 WeakPolarHBondContact O-CG2 3.5Å; A1138-V1142 PolarHBondContact O-N 2.9Å; A1138-I1150 HydrophobicContact CB-CD1 4.32Å
1139L97.9Very high96.6Very high0 Ų045.1 Ų45.10%023%0.227CC..Hα-helixtrans-59.2-27177.5-70.9169.5000113.6I1135 Q1136 K1147 I1150 V1151 V1170 K1173 C1174 C1177I1135-L1139 HydrophobicContact CG2-CD1 4.05Å; I1135-L1139 HydrophobicContact CG2-CG 4.43Å; I1135-L1139 WeakPolarHBondContact O-CG 3.18Å; I1135-L1139 PolarHBondContact O-N 3.33Å; Q1136-L1139 PolarHBondContact O-N 3.22Å; L1139-K1147 HydrophobicContact CD2-CB 4.36Å; L1139-K1147 WeakPolarHBondContact O-CD 3.49Å; L1139-K1147 WeakPolarHBondContact O-CE 3.24Å; L1139-K1147 PolarHBondContact O-NZ 3.29Å; L1139-I1150 HydrophobicContact CD2-CB 4.42Å; L1139-I1150 HydrophobicContact CD2-CG2 4.02Å; L1139-I1150 HydrophobicContact CG-CG2 4.46Å; L1139-V1151 HydrophobicContact CD2-CG2 3.69Å; L1139-V1170 HydrophobicContact CD1-CG1 4.31Å; L1139-K1173 HydrophobicContact CB-CG 4.03Å; L1139-K1173 HydrophobicContact CD1-CB 4.29Å; L1139-K1173 HydrophobicContact CD1-CG 4.19Å; L1139-C1174 VanDerWaalsContact CD1-SG 3.59Å; L1139-C1177 WeakPolarHBondContact O-CB 3.46Å
1140E97.8Very high96.5Very high72 Ų7240.6 Ų40.634%0.33621%0.205SC..Hα-helixtrans-75-38.1172.7-69.3169.917100112.2Q1136 K1137 A1138 K1173Q1136-E1140 WeakPolarHBondContact O-CG 3.38Å; Q1136-E1140 PolarHBondContact O-N 3.31Å; Q1136-E1140 VanDerWaalsContact O-N 3.11Å; K1137-E1140 WeakPolarHBondContact CE-OE2 3.49Å; K1137-E1140 IonicContact NZ-OE2 2.75Å; K1137-E1140 PolarHBondContact NZ-OE2 2.94Å; K1137-E1140 PolarHBondContact O-N 3.3Å; A1138-E1140 PolarHBondContact O-N 2.88Å; A1138-E1140 VanDerWaalsContact O-N 3.16Å; E1140-K1173 HydrophobicContact CG-CD 3.86Å; E1140-K1173 WeakPolarHBondContact OE1-CE 3.26Å; E1140-K1173 IonicContact OE1-NZ 2.88Å; E1140-K1173 PolarHBondContact OE1-NZ 3.05Å
1141S96.3Very high96.4Very high35 Ų3537.9 Ų37.925%0.24519%0.194CC..Hα-helixtrans-113.1-7.3-161.3-53.10000117.5F1103 K1137 A1138F1103-S1141 WeakPolarHBondContact O-CB 3.47Å; F1103-S1141 PolarHBondContact O-OG 3.26Å; K1137-S1141 WeakPolarHBondContact O-CB 3.33Å; K1137-S1141 PolarHBondContact O-N 3.11Å; K1137-S1141 VanDerWaalsContact O-N 3.1Å; K1137-S1141 PolarHBondContact O-OG 3.37Å; K1137-S1141 VanDerWaalsContact O-OG 3.1Å; A1138-S1141 PolarHBondContact O-N 2.95Å
1142V95.5Very high96.3Very high7 Ų739.5 Ų39.54%0.04221%0.211CC..SBendtrans-94.7154.5178.8-55.20000112.3F1103 A1138 A1146 K1147 I1150F1103-V1142 HydrophobicContact CD1-CG1 3.82Å; F1103-V1142 HydrophobicContact CE1-CG1 3.75Å; A1138-V1142 HydrophobicContact CB-CG1 4.4Å; A1138-V1142 WeakPolarHBondContact O-CG1 3.38Å; A1138-V1142 VanDerWaalsContact O-CG2 3.28Å; A1138-V1142 WeakPolarHBondContact O-CG2 3.5Å; A1138-V1142 PolarHBondContact O-N 2.9Å; V1142-A1146 HydrophobicContact CB-CB 3.98Å; V1142-A1146 HydrophobicContact CG2-CB 3.77Å; V1142-K1147 HydrophobicContact CG2-CB 4.48Å; V1142-K1147 HydrophobicContact CG2-CG 3.61Å; V1142-K1147 WeakPolarHBondContact O-CE 3.27Å; V1142-I1150 HydrophobicContact CG2-CD1 4.36Å
1143P92.9Very high96.3Very high60 Ų6041.8 Ų41.839%0.3922%0.222SC..  trans-60.6156.2174.925.5-36000112.6E1145 A1146 K1147P1143-E1145 VanDerWaalsContact C-N 3.32Å; P1143-E1145 PolarHBondContact O-N 3.2Å; P1143-A1146 HydrophobicContact CG-CB 4.23Å; P1143-A1146 WeakPolarHBondContact O-CB 3.26Å; P1143-A1146 PolarHBondContact O-N 2.88Å; P1143-K1147 PolarHBondContact O-N 3.36Å; P1143-K1147 VanDerWaalsContact O-N 3.09Å
1144A92.9Very high96.3Very high56 Ų5636.5 Ų36.546%0.46320%0.202SC..Hα-helixtrans-53.7-42.1-170.800000114.2A1146 K1147 I1148A1144-A1146 PolarHBondContact O-N 3.39Å; A1144-K1147 WeakPolarHBondContact O-CB 3.39Å; A1144-K1147 PolarHBondContact O-N 2.87Å; A1144-K1147 VanDerWaalsContact O-N 3.1Å; A1144-I1148 WeakPolarHBondContact O-CG1 3.45Å; A1144-I1148 PolarHBondContact O-N 2.71Å
1145E92.6Very high96.2Very high142 Ų14243.2 Ų43.266%0.66423%0.227SC*.Hα-helixtrans-55.2-48.4174.8-178.1174.9-153.800112.2P1143 K1147 I1148 H1149P1143-E1145 VanDerWaalsContact C-N 3.32Å; P1143-E1145 PolarHBondContact O-N 3.2Å; E1145-K1147 VanDerWaalsContact C-N 3.32Å; E1145-K1147 PolarHBondContact O-N 2.84Å; E1145-I1148 PolarHBondContact O-N 3.03Å; E1145-H1149 PolarHBondContact O-CD2 3.27Å; E1145-H1149 PolarHBondContact O-N 3.1Å
1146A93.3Very high96.1Very high17 Ų1748.2 Ų48.214%0.1426%0.26CS..Hα-helixtrans-65.9-32.6176.400000112.5V1142 P1143 A1144 I1150V1142-A1146 HydrophobicContact CB-CB 3.98Å; V1142-A1146 HydrophobicContact CG2-CB 3.77Å; P1143-A1146 HydrophobicContact CG-CB 4.23Å; P1143-A1146 WeakPolarHBondContact O-CB 3.26Å; P1143-A1146 PolarHBondContact O-N 2.88Å; A1144-A1146 PolarHBondContact O-N 3.39Å; A1146-I1150 VanDerWaalsContact O-CG1 3.3Å; A1146-I1150 WeakPolarHBondContact O-CG1 3.46Å; A1146-I1150 PolarHBondContact O-N 2.92Å; A1146-I1150 VanDerWaalsContact O-N 3.12Å
1147K95.6Very high96.1Very high33 Ų3351 Ų5114%0.14327%0.272CS..Hα-helixtrans-62.3-47.7171-55-169.7-170.5-155.90110.8L1139 V1142 P1143 A1144 E1145 H1149 I1150 V1151 C1177 V1178L1139-K1147 HydrophobicContact CD2-CB 4.36Å; L1139-K1147 WeakPolarHBondContact O-CD 3.49Å; L1139-K1147 WeakPolarHBondContact O-CE 3.24Å; L1139-K1147 PolarHBondContact O-NZ 3.29Å; V1142-K1147 HydrophobicContact CG2-CB 4.48Å; V1142-K1147 HydrophobicContact CG2-CG 3.61Å; V1142-K1147 WeakPolarHBondContact O-CE 3.27Å; P1143-K1147 PolarHBondContact O-N 3.36Å; P1143-K1147 VanDerWaalsContact O-N 3.09Å; A1144-K1147 WeakPolarHBondContact O-CB 3.39Å; A1144-K1147 PolarHBondContact O-N 2.87Å; A1144-K1147 VanDerWaalsContact O-N 3.1Å; E1145-K1147 VanDerWaalsContact C-N 3.32Å; E1145-K1147 PolarHBondContact O-N 2.84Å; K1147-H1149 VanDerWaalsContact C-N 3.33Å; K1147-H1149 PolarHBondContact O-N 3.41Å; K1147-I1150 PolarHBondContact O-N 3.35Å; K1147-V1151 WeakPolarHBondContact O-CB 3.48Å; K1147-V1151 WeakPolarHBondContact O-CG2 3.46Å; K1147-V1151 PolarHBondContact O-N 2.85Å; K1147-C1177 VanDerWaalsContact CD-O 3.26Å; K1147-C1177 WeakPolarHBondContact CD-O 3.38Å; K1147-C1177 PolarHBondContact NZ-O 3.46Å; K1147-V1178 HydrophobicContact CB-CG2 4.26Å; K1147-V1178 HydrophobicContact CD-CG2 4.48Å
1148I94.6Very high96.1Very high61 Ų6148.9 Ų48.931%0.31326%0.263SS..Hα-helixtrans-60.3-42.2-179.4-66.6168.5000110.8A1144 E1145 V1151 G1152 E1182A1144-I1148 WeakPolarHBondContact O-CG1 3.45Å; A1144-I1148 PolarHBondContact O-N 2.71Å; E1145-I1148 PolarHBondContact O-N 3.03Å; I1148-V1151 PolarHBondContact O-N 2.66Å; I1148-G1152 PolarHBondContact O-N 3.39Å; I1148-E1182 HydrophobicContact CD1-CG 3.98Å; I1148-E1182 HydrophobicContact CG1-CG 4Å
1149H94.4Very high96Very high122 Ų12251.1 Ų51.157%0.56528%0.276SS*.Hα-helixtrans-61.3-48.6174.4-73.8-61.8000113E1145 K1147 V1151 G1152E1145-H1149 PolarHBondContact O-CD2 3.27Å; E1145-H1149 PolarHBondContact O-N 3.1Å; K1147-H1149 VanDerWaalsContact C-N 3.33Å; K1147-H1149 PolarHBondContact O-N 3.41Å; H1149-V1151 VanDerWaalsContact C-N 3.35Å; H1149-V1151 PolarHBondContact O-N 3.15Å; H1149-G1152 PolarHBondContact O-N 2.86Å
1150I96.1Very high96Very high6 Ų658 Ų583%0.03130%0.302CS..Hα-helixtrans-60.1-45.5177.4-68.5167.1000110.7L1118 V1122 I1135 A1138 L1139 V1142 A1146 K1147 G1152 E1153L1118-I1150 HydrophobicContact CD1-CD1 4.1Å; V1122-I1150 HydrophobicContact CG1-CG2 3.77Å; V1122-I1150 HydrophobicContact CG2-CB 4.47Å; V1122-I1150 HydrophobicContact CG2-CG2 4.09Å; I1135-I1150 HydrophobicContact CG2-CG2 4.27Å; A1138-I1150 HydrophobicContact CB-CD1 4.32Å; L1139-I1150 HydrophobicContact CD2-CB 4.42Å; L1139-I1150 HydrophobicContact CD2-CG2 4.02Å; L1139-I1150 HydrophobicContact CG-CG2 4.46Å; V1142-I1150 HydrophobicContact CG2-CD1 4.36Å; A1146-I1150 VanDerWaalsContact O-CG1 3.3Å; A1146-I1150 WeakPolarHBondContact O-CG1 3.46Å; A1146-I1150 PolarHBondContact O-N 2.92Å; A1146-I1150 VanDerWaalsContact O-N 3.12Å; K1147-I1150 PolarHBondContact O-N 3.35Å; I1150-G1152 VanDerWaalsContact C-N 3.33Å; I1150-G1152 PolarHBondContact O-N 2.81Å; I1150-E1153 PolarHBondContact O-N 3.09Å
1151V96.8Very high96.1Very high2 Ų254.6 Ų54.61%0.01229%0.286CS..Hα-helixtrans-67.2-331801700000112L1139 K1147 I1148 H1149 E1153 L1154 C1174 V1178 L1183 F1185L1139-V1151 HydrophobicContact CD2-CG2 3.69Å; K1147-V1151 WeakPolarHBondContact O-CB 3.48Å; K1147-V1151 WeakPolarHBondContact O-CG2 3.46Å; K1147-V1151 PolarHBondContact O-N 2.85Å; I1148-V1151 PolarHBondContact O-N 2.66Å; H1149-V1151 VanDerWaalsContact C-N 3.35Å; H1149-V1151 PolarHBondContact O-N 3.15Å; V1151-E1153 VanDerWaalsContact C-N 3.35Å; V1151-E1153 PolarHBondContact O-N 3.4Å; V1151-L1154 WeakPolarHBondContact O-CB 3.34Å; V1151-L1154 PolarHBondContact O-N 3.05Å; V1151-C1174 HydrophobicContact CG2-CB 4.15Å; V1151-V1178 HydrophobicContact CG2-CG2 3.74Å; V1151-L1183 HydrophobicContact CG1-CD2 4.41Å; V1151-F1185 HydrophobicContact CG1-CE1 3.7Å; V1151-F1185 HydrophobicContact CG1-CZ 3.53Å; V1151-F1185 WeakPolarHBondContact O-CZ 3.32Å
1152G96.7Very high96.2Very high34 Ų3452.9 Ų52.935%0.35127%0.274SS..Hα-helixtrans-59.9-38.6177.500000113.8I1148 H1149 I1150 L1154 R1155I1148-G1152 PolarHBondContact O-N 3.39Å; H1149-G1152 PolarHBondContact O-N 2.86Å; I1150-G1152 VanDerWaalsContact C-N 3.33Å; I1150-G1152 PolarHBondContact O-N 2.81Å; G1152-L1154 PolarHBondContact O-N 2.97Å; G1152-R1155 WeakPolarHBondContact O-CB 3.37Å; G1152-R1155 PolarHBondContact O-N 3.23Å; G1152-R1155 VanDerWaalsContact O-N 3.15Å
1153E97.5Very high96.3Very high48 Ų4856.2 Ų56.222%0.22429%0.288CS..Hα-helixtrans-64.7-25.5177.6-73.1-173.5-152.700113.5Q1119 G1120 H1121 V1122 I1150 V1151 R1155Q1119-E1153 WeakPolarHBondContact CA-OE1 3.24Å; Q1119-E1153 WeakPolarHBondContact CG-OE1 3.45Å; G1120-E1153 WeakPolarHBondContact CA-OE2 3.23Å; G1120-E1153 VanDerWaalsContact N-CD 3.26Å; G1120-E1153 PolarHBondContact N-OE1 3.35Å; G1120-E1153 PolarHBondContact N-OE2 3.02Å; G1120-E1153 VanDerWaalsContact N-OE2 3.09Å; H1121-E1153 PolarHBondContact N-OE2 2.74Å; V1122-E1153 HydrophobicContact CB-CB 3.98Å; V1122-E1153 WeakPolarHBondContact CB-OE2 3.32Å; V1122-E1153 HydrophobicContact CG2-CB 4.24Å; V1122-E1153 HydrophobicContact CG2-CG 4.39Å; V1122-E1153 VanDerWaalsContact CG2-OE2 3.3Å; V1122-E1153 WeakPolarHBondContact CG2-OE2 3.47Å; V1122-E1153 PolarHBondContact N-OE2 3.02Å; I1150-E1153 PolarHBondContact O-N 3.09Å; V1151-E1153 VanDerWaalsContact C-N 3.35Å; V1151-E1153 PolarHBondContact O-N 3.4Å; E1153-R1155 PolarHBondContact O-N 3.42Å
1154L97.8Very high96.6Very high1 Ų155.2 Ų55.21%0.00528%0.28CS..THydrogen-bonded Turntrans-74.7-12.6177.8-59.5174.9000112.9V1122 V1123 A1126 V1151 G1152 F1157 V1158 V1170 I1171V1122-L1154 HydrophobicContact CG1-CD2 3.92Å; V1122-L1154 HydrophobicContact CG1-CG 4.16Å; V1123-L1154 HydrophobicContact CG2-CD2 4.11Å; A1126-L1154 HydrophobicContact CB-CD2 4.24Å; V1151-L1154 WeakPolarHBondContact O-CB 3.34Å; V1151-L1154 PolarHBondContact O-N 3.05Å; G1152-L1154 PolarHBondContact O-N 2.97Å; L1154-F1157 CarbonylContact O-C 3.54Å; L1154-F1157 WeakPolarHBondContact O-CA 3.47Å; L1154-F1157 PolarHBondContact O-N 2.82Å; L1154-V1158 WeakPolarHBondContact O-CG2 3.24Å; L1154-V1158 PolarHBondContact O-N 3.19Å; L1154-V1170 HydrophobicContact CD1-CG1 3.81Å; L1154-I1171 HydrophobicContact CD1-CD1 4.13Å
1155R97.3Very high96.9Very high141 Ų14158 Ų5853%0.53228%0.283SS..G310 helixtrans-52.8-50.8-170.2-178170-65.6-136.32.8115.4G1152 E1153 F1157 F1185G1152-R1155 WeakPolarHBondContact O-CB 3.37Å; G1152-R1155 PolarHBondContact O-N 3.23Å; G1152-R1155 VanDerWaalsContact O-N 3.15Å; E1153-R1155 PolarHBondContact O-N 3.42Å; R1155-F1157 PolarHBondContact O-N 3.29Å; R1155-F1185 HydrophobicContact CB-CD2 3.75Å; R1155-F1185 HydrophobicContact CB-CE2 3.95Å; R1155-F1185 HydrophobicContact CB-CG 4.28Å; R1155-F1185 HydrophobicContact CG-CB 3.96Å; R1155-F1185 HydrophobicContact CG-CD2 3.71Å; R1155-F1185 HydrophobicContact CG-CE2 4.42Å; R1155-F1185 HydrophobicContact CG-CG 3.92Å; R1155-F1185 VanDerWaalsContact NH2-CD1 3.31Å
1156P96.8Very high97.1Very high106 Ų10652 Ų5269%0.68826%0.256SS*.G310 helixtrans-77.7-3.2176.429.3-31.8000113.9
1157F97.9Very high97.4Very high82 Ų8251.2 Ų51.236%0.3625%0.249SC..G310 helixtrans-118.53.3-172.7-58.3-70.7000115V1123 L1154 R1155 T1159 R1160 C1161V1123-F1157 HydrophobicContact CB-CD2 4.19Å; V1123-F1157 HydrophobicContact CB-CE2 4.5Å; V1123-F1157 HydrophobicContact CG1-CB 4.06Å; V1123-F1157 HydrophobicContact CG1-CD1 4.3Å; V1123-F1157 HydrophobicContact CG1-CD2 3.84Å; V1123-F1157 HydrophobicContact CG1-CE2 4.32Å; V1123-F1157 HydrophobicContact CG1-CG 3.81Å; V1123-F1157 HydrophobicContact CG2-CB 4.41Å; V1123-F1157 HydrophobicContact CG2-CD2 3.35Å; V1123-F1157 HydrophobicContact CG2-CE2 3.81Å; V1123-F1157 HydrophobicContact CG2-CG 4.1Å; L1154-F1157 CarbonylContact O-C 3.54Å; L1154-F1157 WeakPolarHBondContact O-CA 3.47Å; L1154-F1157 PolarHBondContact O-N 2.82Å; R1155-F1157 PolarHBondContact O-N 3.29Å; F1157-T1159 PolarHBondContact O-N 2.86Å; F1157-R1160 WeakPolarHBondContact O-CA 3.45Å; F1157-R1160 WeakPolarHBondContact O-CB 3.45Å; F1157-R1160 PolarHBondContact O-N 2.87Å; F1157-C1161 PolarHBondContact O-N 2.9Å; F1157-C1161 PolarHBondContact O-SG 3.48Å; F1157-C1161 VanDerWaalsContact O-SG 3.37Å
1158V98.5Very high97.5Very high2 Ų249.6 Ų49.61%0.01224%0.242CC..Hα-helixtrans-47.8-54.5-176178.40000112.3L1154 R1160 C1161 V1162 I1171 F1185 I1186 A1189L1154-V1158 WeakPolarHBondContact O-CG2 3.24Å; L1154-V1158 PolarHBondContact O-N 3.19Å; V1158-R1160 PolarHBondContact O-N 3.32Å; V1158-C1161 PolarHBondContact O-N 2.93Å; V1158-V1162 HydrophobicContact CG1-CG2 3.94Å; V1158-V1162 WeakPolarHBondContact O-CB 3.39Å; V1158-V1162 VanDerWaalsContact O-CG2 3.26Å; V1158-V1162 WeakPolarHBondContact O-CG2 3.46Å; V1158-V1162 PolarHBondContact O-N 3.15Å; V1158-I1171 HydrophobicContact CG1-CD1 4.44Å; V1158-F1185 HydrophobicContact CG2-CD2 3.66Å; V1158-F1185 HydrophobicContact CG2-CE2 3.52Å; V1158-I1186 HydrophobicContact CG1-CB 4.46Å; V1158-I1186 HydrophobicContact CG1-CG2 4.02Å; V1158-I1186 HydrophobicContact CG2-CG1 4.28Å; V1158-A1189 HydrophobicContact CB-CB 3.82Å; V1158-A1189 HydrophobicContact CG1-CB 3.81Å; V1158-A1189 HydrophobicContact CG2-CB 4.44Å
1159T97.7Very high97.7Very high46 Ų4649.2 Ų49.228%0.28224%0.239SC..Hα-helixtrans-61.3-29.2-178.9-55.60000113.5F1157 K1163 Q1193F1157-T1159 PolarHBondContact O-N 2.86Å; T1159-K1163 HydrophobicContact CG2-CD 4.31Å; T1159-K1163 WeakPolarHBondContact O-CG 3.32Å; T1159-K1163 PolarHBondContact O-N 3.45Å; T1159-Q1193 PolarHBondContact OG1-NE2 3.42Å; T1159-Q1193 VanDerWaalsContact OG1-NE2 3.11Å
1160R97.9Very high97.9Very high145 Ų14543.4 Ų43.455%0.54721%0.212SC..Hα-helixtrans-72-48.6172.5175.3-178.1170.5-170.9-5.9110.2F1157 V1158 K1163 D1164F1157-R1160 WeakPolarHBondContact O-CA 3.45Å; F1157-R1160 WeakPolarHBondContact O-CB 3.45Å; F1157-R1160 PolarHBondContact O-N 2.87Å; V1158-R1160 PolarHBondContact O-N 3.32Å; R1160-K1163 PolarHBondContact O-N 3.22Å; R1160-D1164 WeakPolarHBondContact O-CB 3.39Å; R1160-D1164 PolarHBondContact O-N 2.89Å
1161C98.6Very high98.1Very high0 Ų043.1 Ų43.10%021%0.21CC..Hα-helixtrans-64-43.8-178.8-59.40000111.8F1157 V1158 K1163 D1164 G1167 N1168 I1171F1157-C1161 PolarHBondContact O-N 2.9Å; F1157-C1161 PolarHBondContact O-SG 3.48Å; F1157-C1161 VanDerWaalsContact O-SG 3.37Å; V1158-C1161 PolarHBondContact O-N 2.93Å; C1161-K1163 PolarHBondContact O-N 3.38Å; C1161-D1164 PolarHBondContact O-N 3.07Å; C1161-G1167 CarbonylContact O-C 3.04Å; C1161-G1167 WeakPolarHBondContact O-CA 3.46Å; C1161-N1168 PolarHBondContact O-N 2.61Å; C1161-I1171 HydrophobicContact CB-CD1 3.93Å; C1161-I1171 HydrophobicContact CB-CG1 3.61Å
1162V98.7Very high98.2Very high0 Ų043.6 Ų43.60%021%0.213CC..Hα-helixtrans-58-31.4175170.90000112.7V1158 I1171 F1190 L1197 Y1202 V1206V1158-V1162 HydrophobicContact CG1-CG2 3.94Å; V1158-V1162 WeakPolarHBondContact O-CB 3.39Å; V1158-V1162 VanDerWaalsContact O-CG2 3.26Å; V1158-V1162 WeakPolarHBondContact O-CG2 3.46Å; V1158-V1162 PolarHBondContact O-N 3.15Å; V1162-I1171 HydrophobicContact CG2-CB 4.38Å; V1162-I1171 HydrophobicContact CG2-CG1 4.19Å; V1162-I1171 HydrophobicContact CG2-CG2 3.94Å; V1162-F1190 HydrophobicContact CG1-CE1 4.48Å; V1162-F1190 HydrophobicContact CG1-CE2 4.42Å; V1162-F1190 HydrophobicContact CG1-CZ 3.75Å; V1162-F1190 HydrophobicContact CG2-CE2 3.79Å; V1162-F1190 HydrophobicContact CG2-CZ 3.9Å; V1162-L1197 HydrophobicContact CG1-CD1 4.4Å; V1162-L1197 HydrophobicContact CG1-CD2 3.81Å; V1162-Y1202 WeakPolarHBondContact O-CB 3.43Å; V1162-V1206 HydrophobicContact CG1-CG2 4.26Å; V1162-V1206 HydrophobicContact CG2-CG1 4.27Å; V1162-V1206 HydrophobicContact CG2-CG2 4.3Å
1163K98.3Very high98.2Very high76 Ų7643.4 Ų43.433%0.3320%0.202SC..Hα-helixtrans-93-6.9179.1-66177-170.9174.70113.4T1159 R1160 C1161 L1197T1159-K1163 HydrophobicContact CG2-CD 4.31Å; T1159-K1163 WeakPolarHBondContact O-CG 3.32Å; T1159-K1163 PolarHBondContact O-N 3.45Å; R1160-K1163 PolarHBondContact O-N 3.22Å; C1161-K1163 PolarHBondContact O-N 3.38Å; K1163-L1197 HydrophobicContact CD-CD2 4.39Å; K1163-L1197 HydrophobicContact CG-CD2 4.14Å
1164D98.6Very high98.3Very high39 Ų3941.1 Ų41.121%0.20919%0.191CC..SBendtrans-89.5145.7178.9-179.264.9000112.7T1127 R1160 C1161 N1166 G1167 N1168T1127-D1164 HydrophobicContact CG2-CB 4.17Å; R1160-D1164 WeakPolarHBondContact O-CB 3.39Å; R1160-D1164 PolarHBondContact O-N 2.89Å; C1161-D1164 PolarHBondContact O-N 3.07Å; D1164-N1166 PolarHBondContact O-N 3.05Å; D1164-N1166 WeakPolarHBondContact OD2-CA 3.4Å; D1164-N1166 WeakPolarHBondContact OD2-CB 3.26Å; D1164-N1166 PolarHBondContact OD2-N 3.47Å; D1164-G1167 PolarHBondContact OD2-N 3.21Å; D1164-N1168 WeakPolarHBondContact O-CB 3.49Å; D1164-N1168 PolarHBondContact O-N 3.23Å; D1164-N1168 PolarHBondContact O-ND2 2.92Å
1165Q98.3Very high98.3Very high115 Ų11541.3 Ų41.354%0.53719%0.192SC..THydrogen-bonded Turntrans-65-25.4-17866.4-177.1-8.700113.8N1168 Y1202Q1165-N1168 VanDerWaalsContact C-ND2 3.31Å; Q1165-N1168 PolarHBondContact O-ND2 3.06Å; Q1165-Y1202 HydrophobicContact CB-CE2 3.93Å
1166N98.5Very high98.4Very high16 Ų1638 Ų389%0.08618%0.183CC..THydrogen-bonded Turntrans-102.5-46.7178.4-58-49.2000110.6A1126 T1127 M1129 C1132 D1164 N1168 H1169A1126-N1166 CarbonylContact O-C 3.59Å; T1127-N1166 PolarHBondContact O-ND2 2.83Å; M1129-N1166 WeakPolarHBondContact CA-OD1 3.32Å; M1129-N1166 PolarHBondContact N-ND2 3.05Å; C1132-N1166 HydrophobicContact CB-CB 3.85Å; D1164-N1166 PolarHBondContact O-N 3.05Å; D1164-N1166 WeakPolarHBondContact OD2-CA 3.4Å; D1164-N1166 WeakPolarHBondContact OD2-CB 3.26Å; D1164-N1166 PolarHBondContact OD2-N 3.47Å; N1166-N1168 VanDerWaalsContact C-N 3.26Å; N1166-N1168 PolarHBondContact O-N 3.2Å; N1166-H1169 WeakPolarHBondContact O-CB 3.48Å; N1166-H1169 PolarHBondContact O-N 3.06Å; N1166-H1169 VanDerWaalsContact O-N 3.08Å
1167G98.6Very high98.4Very high0 Ų034.5 Ų34.50%016%0.161CC..Hα-helixtrans-61.1-28.7-175.800000114.2A1126 C1161 D1164 H1169 V1170 I1171A1126-G1167 VanDerWaalsContact O-CA 3.26Å; A1126-G1167 WeakPolarHBondContact O-CA 3.41Å; A1126-G1167 PolarHBondContact O-N 3.39Å; A1126-G1167 VanDerWaalsContact O-N 3.12Å; C1161-G1167 CarbonylContact O-C 3.04Å; C1161-G1167 WeakPolarHBondContact O-CA 3.46Å; D1164-G1167 PolarHBondContact OD2-N 3.21Å; G1167-H1169 VanDerWaalsContact C-N 3.25Å; G1167-H1169 PolarHBondContact O-N 3.21Å; G1167-V1170 PolarHBondContact O-N 2.96Å; G1167-I1171 WeakPolarHBondContact O-CG1 3.32Å; G1167-I1171 PolarHBondContact O-N 2.78Å
1168N98.7Very high98.3Very high0 Ų031 Ų310%015%0.146CC..Hα-helixtrans-65.3-30.5177.778.793.3000112.3C1161 D1164 Q1165 N1166 Q1172 Y1202 V1206C1161-N1168 PolarHBondContact O-N 2.61Å; D1164-N1168 WeakPolarHBondContact O-CB 3.49Å; D1164-N1168 PolarHBondContact O-N 3.23Å; D1164-N1168 PolarHBondContact O-ND2 2.92Å; Q1165-N1168 VanDerWaalsContact C-ND2 3.31Å; Q1165-N1168 PolarHBondContact O-ND2 3.06Å; N1166-N1168 VanDerWaalsContact C-N 3.26Å; N1166-N1168 PolarHBondContact O-N 3.2Å; N1168-Q1172 WeakPolarHBondContact O-CB 3.22Å; N1168-Q1172 VanDerWaalsContact O-CG 3.26Å; N1168-Q1172 WeakPolarHBondContact O-CG 3.46Å; N1168-Q1172 PolarHBondContact O-N 2.96Å; N1168-Q1172 PolarHBondContact O-NE2 3.11Å; N1168-Q1172 PolarHBondContact OD1-NE2 2.8Å; N1168-Y1202 HydrophobicContact CB-CG 4.38Å; N1168-V1206 HydrophobicContact CB-CG2 4.46Å
1169H98.7Very high98.2Very high52 Ų5233.9 Ų33.924%0.24116%0.164CC..Hα-helixtrans-72.8-35.3175.4-70.4-79.8000111.5N1166 G1167 K1173N1166-H1169 WeakPolarHBondContact O-CB 3.48Å; N1166-H1169 PolarHBondContact O-N 3.06Å; N1166-H1169 VanDerWaalsContact O-N 3.08Å; G1167-H1169 VanDerWaalsContact C-N 3.25Å; G1167-H1169 PolarHBondContact O-N 3.21Å; H1169-K1173 WeakPolarHBondContact O-CB 3.46Å; H1169-K1173 PolarHBondContact O-N 2.89Å
1170V98.7Very high98.2Very high0 Ų033.4 Ų33.40%016%0.162CC..Hα-helixtrans-65.6-46.4172.2173.90000111A1126 C1132 I1135 Q1136 L1139 L1154 G1167 Q1172 K1173 C1174A1126-V1170 HydrophobicContact CB-CB 4.14Å; A1126-V1170 HydrophobicContact CB-CG1 4.03Å; A1126-V1170 HydrophobicContact CB-CG2 3.85Å; C1132-V1170 HydrophobicContact CB-CG2 4Å; I1135-V1170 HydrophobicContact CB-CG2 4.05Å; I1135-V1170 HydrophobicContact CG2-CB 4.45Å; I1135-V1170 HydrophobicContact CG2-CG1 3.58Å; I1135-V1170 HydrophobicContact CG2-CG2 3.99Å; Q1136-V1170 HydrophobicContact CG-CG2 4.34Å; L1139-V1170 HydrophobicContact CD1-CG1 4.31Å; L1154-V1170 HydrophobicContact CD1-CG1 3.81Å; G1167-V1170 PolarHBondContact O-N 2.96Å; V1170-Q1172 PolarHBondContact O-N 2.81Å; V1170-K1173 PolarHBondContact O-N 3.24Å; V1170-K1173 VanDerWaalsContact O-N 3.14Å; V1170-C1174 PolarHBondContact O-N 2.89Å; V1170-C1174 PolarHBondContact O-SG 3.4Å
1171I98.7Very high98.1Very high0 Ų029.8 Ų29.80%016%0.159CC..Hα-helixtrans-62.9-40.4178.5-62.9-67.5000111.7L1154 V1158 C1161 V1162 G1167 C1174 I1175 I1186 V1206L1154-I1171 HydrophobicContact CD1-CD1 4.13Å; V1158-I1171 HydrophobicContact CG1-CD1 4.44Å; C1161-I1171 HydrophobicContact CB-CD1 3.93Å; C1161-I1171 HydrophobicContact CB-CG1 3.61Å; V1162-I1171 HydrophobicContact CG2-CB 4.38Å; V1162-I1171 HydrophobicContact CG2-CG1 4.19Å; V1162-I1171 HydrophobicContact CG2-CG2 3.94Å; G1167-I1171 WeakPolarHBondContact O-CG1 3.32Å; G1167-I1171 PolarHBondContact O-N 2.78Å; I1171-C1174 WeakPolarHBondContact O-CB 3.41Å; I1171-C1174 PolarHBondContact O-N 2.98Å; I1171-I1175 HydrophobicContact CG2-CD1 4.15Å; I1171-I1175 WeakPolarHBondContact O-CD1 3.36Å; I1171-I1175 WeakPolarHBondContact O-CG1 3.37Å; I1171-I1175 PolarHBondContact O-N 3.43Å; I1171-I1186 HydrophobicContact CG2-CD1 4.45Å; I1171-I1186 HydrophobicContact CG2-CG2 4.26Å; I1171-V1206 HydrophobicContact CG2-CG1 3.68Å; I1171-V1206 HydrophobicContact CG2-CG2 4.24Å
1172Q98.8Very high98Very high13 Ų1333.1 Ų33.16%0.06118%0.175CC..Hα-helixtrans-59.3-47.3171.6-74.1171.292.900111.4N1168 V1170 C1174 I1175 E1176 V1206 R1209N1168-Q1172 WeakPolarHBondContact O-CB 3.22Å; N1168-Q1172 VanDerWaalsContact O-CG 3.26Å; N1168-Q1172 WeakPolarHBondContact O-CG 3.46Å; N1168-Q1172 PolarHBondContact O-N 2.96Å; N1168-Q1172 PolarHBondContact O-NE2 3.11Å; N1168-Q1172 PolarHBondContact OD1-NE2 2.8Å; V1170-Q1172 PolarHBondContact O-N 2.81Å; Q1172-C1174 VanDerWaalsContact C-N 3.32Å; Q1172-C1174 PolarHBondContact O-N 3.5Å; Q1172-I1175 WeakPolarHBondContact O-CA 3Å; Q1172-I1175 WeakPolarHBondContact O-CB 3.27Å; Q1172-I1175 PolarHBondContact O-N 3.14Å; Q1172-E1176 WeakPolarHBondContact O-CG 3.48Å; Q1172-E1176 PolarHBondContact O-N 2.79Å; Q1172-V1206 HydrophobicContact CG-CG2 3.98Å; Q1172-R1209 HydrophobicContact CB-CG 3.81Å; Q1172-R1209 HydrophobicContact CG-CG 3.62Å
1173K98.6Very high98Very high30 Ų3033.1 Ų33.113%0.1318%0.175CC..Hα-helixtrans-64.3-33.3178.6-168.359.960175.80113.3Q1136 L1139 E1140 H1169 V1170 I1175 E1176 C1177Q1136-K1173 HydrophobicContact CB-CG 4.18Å; Q1136-K1173 HydrophobicContact CG-CB 3.9Å; Q1136-K1173 HydrophobicContact CG-CG 4.08Å; L1139-K1173 HydrophobicContact CB-CG 4.03Å; L1139-K1173 HydrophobicContact CD1-CB 4.29Å; L1139-K1173 HydrophobicContact CD1-CG 4.19Å; E1140-K1173 HydrophobicContact CG-CD 3.86Å; E1140-K1173 WeakPolarHBondContact OE1-CE 3.26Å; E1140-K1173 IonicContact OE1-NZ 2.88Å; E1140-K1173 PolarHBondContact OE1-NZ 3.05Å; H1169-K1173 WeakPolarHBondContact O-CB 3.46Å; H1169-K1173 PolarHBondContact O-N 2.89Å; V1170-K1173 PolarHBondContact O-N 3.24Å; V1170-K1173 VanDerWaalsContact O-N 3.14Å; K1173-I1175 VanDerWaalsContact C-N 3.31Å; K1173-I1175 PolarHBondContact O-N 3.45Å; K1173-E1176 WeakPolarHBondContact CD-OE2 3.38Å; K1173-E1176 WeakPolarHBondContact CE-OE2 3.26Å; K1173-E1176 IonicContact NZ-OE2 3.63Å; K1173-E1176 PolarHBondContact NZ-OE2 3.31Å; K1173-E1176 PolarHBondContact O-N 3.11Å; K1173-C1177 WeakPolarHBondContact CD-SG 3.34Å; K1173-C1177 VanDerWaalsContact O-CB 3.24Å; K1173-C1177 WeakPolarHBondContact O-CB 3.36Å; K1173-C1177 PolarHBondContact O-N 3.19Å
1174C98.5Very high97.9Very high0 Ų033.7 Ų33.70%018%0.182CC..Hα-helixtrans-59.3-43.5169.7-64.80000111.2L1139 V1151 V1170 I1171 Q1172 V1178 I1186L1139-C1174 VanDerWaalsContact CD1-SG 3.59Å; V1151-C1174 HydrophobicContact CG2-CB 4.15Å; V1170-C1174 PolarHBondContact O-N 2.89Å; V1170-C1174 PolarHBondContact O-SG 3.4Å; I1171-C1174 WeakPolarHBondContact O-CB 3.41Å; I1171-C1174 PolarHBondContact O-N 2.98Å; Q1172-C1174 VanDerWaalsContact C-N 3.32Å; Q1172-C1174 PolarHBondContact O-N 3.5Å; C1174-V1178 WeakPolarHBondContact O-CB 3.45Å; C1174-V1178 VanDerWaalsContact O-CG2 3.23Å; C1174-V1178 WeakPolarHBondContact O-CG2 3.25Å; C1174-V1178 PolarHBondContact O-N 3.13Å; C1174-I1186 HydrophobicContact CB-CD1 4.35Å
1175I98.4Very high97.9Very high4 Ų432.7 Ų32.72%0.02118%0.175CC..Hα-helixtrans-69.3-35179.7-62.7156.2000111.9I1171 Q1172 K1173 L1183 I1186 V1206 R1209 I1210 H1213I1171-I1175 HydrophobicContact CG2-CD1 4.15Å; I1171-I1175 WeakPolarHBondContact O-CD1 3.36Å; I1171-I1175 WeakPolarHBondContact O-CG1 3.37Å; I1171-I1175 PolarHBondContact O-N 3.43Å; Q1172-I1175 WeakPolarHBondContact O-CA 3Å; Q1172-I1175 WeakPolarHBondContact O-CB 3.27Å; Q1172-I1175 PolarHBondContact O-N 3.14Å; K1173-I1175 VanDerWaalsContact C-N 3.31Å; K1173-I1175 PolarHBondContact O-N 3.45Å; I1175-L1183 HydrophobicContact CB-CD1 4.35Å; I1175-L1183 HydrophobicContact CG1-CD1 4.25Å; I1175-L1183 HydrophobicContact CG2-CD1 4.46Å; I1175-I1186 HydrophobicContact CG1-CD1 4.3Å; I1175-V1206 HydrophobicContact CD1-CG1 3.77Å; I1175-R1209 HydrophobicContact CB-CB 4.13Å; I1175-R1209 HydrophobicContact CD1-CB 4.11Å; I1175-R1209 HydrophobicContact CG2-CB 3.81Å; I1175-R1209 WeakPolarHBondContact CG2-O 3.49Å; I1175-I1210 HydrophobicContact CD1-CG1 3.76Å; I1175-H1213 HydrophobicContact CG2-CB 3.76Å
1176E98.2Very high97.9Very high73 Ų7327.2 Ų27.234%0.34115%0.15SC..Hα-helixtrans-72.9-33.2176.9-67.7160.6-14700114Q1172 K1173Q1172-E1176 WeakPolarHBondContact O-CG 3.48Å; Q1172-E1176 PolarHBondContact O-N 2.79Å; K1173-E1176 WeakPolarHBondContact CD-OE2 3.38Å; K1173-E1176 WeakPolarHBondContact CE-OE2 3.26Å; K1173-E1176 IonicContact NZ-OE2 3.63Å; K1173-E1176 PolarHBondContact NZ-OE2 3.31Å; K1173-E1176 PolarHBondContact O-N 3.11Å
1177C97.3Very high97.9Very high32 Ų3226.6 Ų26.622%0.21615%0.146CC..Hα-helixtrans-116.3-0.3-162.5-72.20000116.3L1139 K1147 K1173L1139-C1177 WeakPolarHBondContact O-CB 3.46Å; K1147-C1177 VanDerWaalsContact CD-O 3.26Å; K1147-C1177 WeakPolarHBondContact CD-O 3.38Å; K1147-C1177 PolarHBondContact NZ-O 3.46Å; K1173-C1177 WeakPolarHBondContact CD-SG 3.34Å; K1173-C1177 VanDerWaalsContact O-CB 3.24Å; K1173-C1177 WeakPolarHBondContact O-CB 3.36Å; K1173-C1177 PolarHBondContact O-N 3.19Å
1178V97Very high97.8Very high9 Ų929.6 Ų29.66%0.05517%0.168CC..SBendtrans-124.3142.9-173.9-175.60000109.5K1147 V1151 C1174 E1182 L1183K1147-V1178 HydrophobicContact CB-CG2 4.26Å; K1147-V1178 HydrophobicContact CD-CG2 4.48Å; V1151-V1178 HydrophobicContact CG2-CG2 3.74Å; C1174-V1178 WeakPolarHBondContact O-CB 3.45Å; C1174-V1178 VanDerWaalsContact O-CG2 3.23Å; C1174-V1178 WeakPolarHBondContact O-CG2 3.25Å; C1174-V1178 PolarHBondContact O-N 3.13Å; V1178-E1182 HydrophobicContact CG1-CB 3.92Å; V1178-E1182 HydrophobicContact CG1-CG 4.34Å; V1178-L1183 HydrophobicContact CB-CD2 4.1Å; V1178-L1183 HydrophobicContact CG1-CD2 4.09Å
1179P95.7Very high97.8Very high61 Ų6130.9 Ų30.940%0.39618%0.178SC..  trans-53.9131.3175.7-26.835.7000112S1181 E1182P1179-S1181 PolarHBondContact O-N 2.64Å; P1179-E1182 PolarHBondContact O-N 2.83Å
1180P97.2Very high97.7Very high37 Ų3728.5 Ų28.524%0.2417%0.167CC..G310 helixtrans-54.6-28.9-176.9-33.138.7000115.4E1182 L1183 H1213 L1215 Q1218P1180-E1182 PolarHBondContact O-N 3.35Å; P1180-E1182 VanDerWaalsContact O-N 3.15Å; P1180-L1183 WeakPolarHBondContact O-CB 3.29Å; P1180-L1183 PolarHBondContact O-N 3.24Å; P1180-H1213 VanDerWaalsContact CG-O 3.27Å; P1180-H1213 WeakPolarHBondContact CG-O 3.4Å; P1180-L1215 HydrophobicContact CB-CD1 4.31Å; P1180-L1215 HydrophobicContact CB-CD2 4.29Å; P1180-L1215 HydrophobicContact CB-CG 3.83Å; P1180-Q1218 PolarHBondContact O-NE2 3.03Å
1181S96.7Very high97.6Very high69 Ų6935.6 Ų35.648%0.48319%0.194SC..G310 helixtrans-54.3-30.5174.7560000113.8P1179 L1183P1179-S1181 PolarHBondContact O-N 2.64Å; S1181-L1183 VanDerWaalsContact C-N 3.32Å
1182E96.8Very high97.5Very high69 Ų6938.9 Ų38.932%0.32223%0.227SC..G310 helixtrans-84.1-9.7-178.2-56.2-55.3129.900112.9I1148 V1178 P1179 P1180 F1185I1148-E1182 HydrophobicContact CD1-CG 3.98Å; I1148-E1182 HydrophobicContact CG1-CG 4Å; V1178-E1182 HydrophobicContact CG1-CB 3.92Å; V1178-E1182 HydrophobicContact CG1-CG 4.34Å; P1179-E1182 PolarHBondContact O-N 2.83Å; P1180-E1182 PolarHBondContact O-N 3.35Å; P1180-E1182 VanDerWaalsContact O-N 3.15Å; E1182-F1185 VanDerWaalsContact O-CD1 3.25Å; E1182-F1185 WeakPolarHBondContact O-CD1 3.42Å; E1182-F1185 VanDerWaalsContact O-CE1 3.25Å; E1182-F1185 WeakPolarHBondContact O-CE1 3.09Å
1183L97.5Very high97.4Very high0 Ų040 Ų400%023%0.232CC..G310 helixtrans-96.3-0.2-167.9-55.9-176.5000114.4V1151 I1175 V1178 P1180 S1181 F1185 I1186 I1187V1151-L1183 HydrophobicContact CG1-CD2 4.41Å; I1175-L1183 HydrophobicContact CB-CD1 4.35Å; I1175-L1183 HydrophobicContact CG1-CD1 4.25Å; I1175-L1183 HydrophobicContact CG2-CD1 4.46Å; V1178-L1183 HydrophobicContact CB-CD2 4.1Å; V1178-L1183 HydrophobicContact CG1-CD2 4.09Å; P1180-L1183 WeakPolarHBondContact O-CB 3.29Å; P1180-L1183 PolarHBondContact O-N 3.24Å; S1181-L1183 VanDerWaalsContact C-N 3.32Å; L1183-F1185 PolarHBondContact O-N 2.95Å; L1183-I1186 HydrophobicContact CD2-CD1 3.97Å; L1183-I1186 WeakPolarHBondContact O-CA 3.32Å; L1183-I1186 WeakPolarHBondContact O-CB 3.31Å; L1183-I1186 PolarHBondContact O-N 2.86Å; L1183-I1187 PolarHBondContact O-N 3.41Å
1184D97.4Very high97.4Very high89 Ų8938.5 Ų38.548%0.47623%0.226SC..Hα-helixtrans-51.4-30.4-178.9-91.9-6.1000114.3I1187 S1188 Q1218D1184-I1187 PolarHBondContact O-N 2.8Å; D1184-S1188 VanDerWaalsContact O-CB 3.26Å; D1184-S1188 WeakPolarHBondContact O-CB 3.45Å; D1184-S1188 PolarHBondContact O-N 3.37Å; D1184-S1188 PolarHBondContact O-OG 3.23Å; D1184-Q1218 PolarHBondContact OD1-NE2 2.71Å
1185F97.7Very high97.4Very high17 Ų1740.1 Ų40.18%0.07524%0.236CC..Hα-helixtrans-72.4-29.2177.276.2-87.5000113.1V1151 R1155 V1158 E1182 L1183 A1189V1151-F1185 HydrophobicContact CG1-CE1 3.7Å; V1151-F1185 HydrophobicContact CG1-CZ 3.53Å; V1151-F1185 WeakPolarHBondContact O-CZ 3.32Å; R1155-F1185 HydrophobicContact CB-CD2 3.75Å; R1155-F1185 HydrophobicContact CB-CE2 3.95Å; R1155-F1185 HydrophobicContact CB-CG 4.28Å; R1155-F1185 HydrophobicContact CG-CB 3.96Å; R1155-F1185 HydrophobicContact CG-CD2 3.71Å; R1155-F1185 HydrophobicContact CG-CE2 4.42Å; R1155-F1185 HydrophobicContact CG-CG 3.92Å; R1155-F1185 VanDerWaalsContact NH2-CD1 3.31Å; V1158-F1185 HydrophobicContact CG2-CD2 3.66Å; V1158-F1185 HydrophobicContact CG2-CE2 3.52Å; E1182-F1185 VanDerWaalsContact O-CD1 3.25Å; E1182-F1185 WeakPolarHBondContact O-CD1 3.42Å; E1182-F1185 VanDerWaalsContact O-CE1 3.25Å; E1182-F1185 WeakPolarHBondContact O-CE1 3.09Å; L1183-F1185 PolarHBondContact O-N 2.95Å; F1185-A1189 WeakPolarHBondContact O-CB 3.01Å; F1185-A1189 PolarHBondContact O-N 3.19Å; F1185-A1189 VanDerWaalsContact O-N 3.1Å
1186I98.1Very high97.4Very high1 Ų145.3 Ų45.31%0.00526%0.263CS..Hα-helixtrans-67.9-51.5171.3-56.8-177000108.2V1158 I1171 C1174 I1175 L1183 S1188 A1189 F1190 I1210V1158-I1186 HydrophobicContact CG1-CB 4.46Å; V1158-I1186 HydrophobicContact CG1-CG2 4.02Å; V1158-I1186 HydrophobicContact CG2-CG1 4.28Å; I1171-I1186 HydrophobicContact CG2-CD1 4.45Å; I1171-I1186 HydrophobicContact CG2-CG2 4.26Å; C1174-I1186 HydrophobicContact CB-CD1 4.35Å; I1175-I1186 HydrophobicContact CG1-CD1 4.3Å; L1183-I1186 HydrophobicContact CD2-CD1 3.97Å; L1183-I1186 WeakPolarHBondContact O-CA 3.32Å; L1183-I1186 WeakPolarHBondContact O-CB 3.31Å; L1183-I1186 PolarHBondContact O-N 2.86Å; I1186-S1188 VanDerWaalsContact C-N 3.27Å; I1186-S1188 PolarHBondContact O-N 2.86Å; I1186-A1189 WeakPolarHBondContact O-CB 3.47Å; I1186-A1189 PolarHBondContact O-N 2.9Å; I1186-F1190 HydrophobicContact CG2-CD2 4.27Å; I1186-F1190 HydrophobicContact CG2-CE2 4.11Å; I1186-F1190 WeakPolarHBondContact O-CD2 3.44Å; I1186-F1190 PolarHBondContact O-N 2.95Å; I1186-I1210 HydrophobicContact CG2-CD1 4.43Å
1187I97.7Very high97.4Very high2 Ų241.9 Ų41.91%0.0125%0.247CC..Hα-helixtrans-55-44.6176.9-50.3-59.6000111L1183 D1184 A1189 F1190 R1191 I1210 C1214 Q1218 I1222L1183-I1187 PolarHBondContact O-N 3.41Å; D1184-I1187 PolarHBondContact O-N 2.8Å; I1187-A1189 VanDerWaalsContact C-N 3.32Å; I1187-A1189 PolarHBondContact O-N 3.42Å; I1187-F1190 PolarHBondContact O-N 3.42Å; I1187-F1190 VanDerWaalsContact O-N 3.14Å; I1187-R1191 PolarHBondContact O-N 3.34Å; I1187-I1210 HydrophobicContact CD1-CD1 4.24Å; I1187-I1210 HydrophobicContact CD1-CG1 4.17Å; I1187-I1210 HydrophobicContact CD1-CG2 3.59Å; I1187-C1214 HydrophobicContact CD1-CB 4.28Å; I1187-Q1218 HydrophobicContact CD1-CB 4.17Å; I1187-Q1218 HydrophobicContact CG1-CB 4Å; I1187-Q1218 HydrophobicContact CG1-CG 4.24Å; I1187-Q1218 HydrophobicContact CG2-CB 4.48Å; I1187-Q1218 WeakPolarHBondContact CG2-O 3.33Å; I1187-I1222 HydrophobicContact CG2-CD1 4.32Å; I1187-I1222 HydrophobicContact CG2-CG1 4.47Å
1188S97.5Very high97.5Very high64 Ų6440.3 Ų40.345%0.44824%0.236SC..Hα-helixtrans-62.4-35.8177.8-620000113D1184 I1186 F1190D1184-S1188 VanDerWaalsContact O-CB 3.26Å; D1184-S1188 WeakPolarHBondContact O-CB 3.45Å; D1184-S1188 PolarHBondContact O-N 3.37Å; D1184-S1188 PolarHBondContact O-OG 3.23Å; I1186-S1188 VanDerWaalsContact C-N 3.27Å; I1186-S1188 PolarHBondContact O-N 2.86Å; S1188-F1190 VanDerWaalsContact C-N 3.29Å; S1188-F1190 PolarHBondContact O-N 3.41Å
1189A97.7Very high97.6Very high26 Ų2641.1 Ų41.122%0.21524%0.242CC..Hα-helixtrans-71.1-20.9176.200000113.6V1158 F1185 I1186 I1187 Q1193V1158-A1189 HydrophobicContact CB-CB 3.82Å; V1158-A1189 HydrophobicContact CG1-CB 3.81Å; V1158-A1189 HydrophobicContact CG2-CB 4.44Å; F1185-A1189 WeakPolarHBondContact O-CB 3.01Å; F1185-A1189 PolarHBondContact O-N 3.19Å; F1185-A1189 VanDerWaalsContact O-N 3.1Å; I1186-A1189 WeakPolarHBondContact O-CB 3.47Å; I1186-A1189 PolarHBondContact O-N 2.9Å; I1187-A1189 VanDerWaalsContact C-N 3.32Å; I1187-A1189 PolarHBondContact O-N 3.42Å; A1189-Q1193 PolarHBondContact O-NE2 2.83Å
1190F97.9Very high97.7Very high2 Ų240.4 Ų40.41%0.00923%0.233CC..Hα-helixtrans-82.8-27.8177.1-90.1-100.4000113.8V1162 I1186 I1187 S1188 G1192 Q1193 V1194 L1197 V1206 I1207 I1210 I1222V1162-F1190 HydrophobicContact CG1-CE1 4.48Å; V1162-F1190 HydrophobicContact CG1-CE2 4.42Å; V1162-F1190 HydrophobicContact CG1-CZ 3.75Å; V1162-F1190 HydrophobicContact CG2-CE2 3.79Å; V1162-F1190 HydrophobicContact CG2-CZ 3.9Å; I1186-F1190 HydrophobicContact CG2-CD2 4.27Å; I1186-F1190 HydrophobicContact CG2-CE2 4.11Å; I1186-F1190 WeakPolarHBondContact O-CD2 3.44Å; I1186-F1190 PolarHBondContact O-N 2.95Å; I1187-F1190 PolarHBondContact O-N 3.42Å; I1187-F1190 VanDerWaalsContact O-N 3.14Å; S1188-F1190 VanDerWaalsContact C-N 3.29Å; S1188-F1190 PolarHBondContact O-N 3.41Å; F1190-G1192 PolarHBondContact O-N 3.48Å; F1190-Q1193 CarbonylContact O-C 3.08Å; F1190-Q1193 WeakPolarHBondContact O-CG 3.43Å; F1190-Q1193 PolarHBondContact O-N 2.99Å; F1190-V1194 HydrophobicContact CB-CG2 4.37Å; F1190-V1194 WeakPolarHBondContact O-CG2 3.37Å; F1190-V1194 PolarHBondContact O-N 3.3Å; F1190-L1197 HydrophobicContact CD1-CB 4.18Å; F1190-L1197 HydrophobicContact CD1-CD1 3.36Å; F1190-L1197 HydrophobicContact CD1-CG 4.39Å; F1190-L1197 HydrophobicContact CD2-CD1 4.42Å; F1190-L1197 HydrophobicContact CE1-CB 3.83Å; F1190-L1197 HydrophobicContact CE1-CD1 3.35Å; F1190-L1197 HydrophobicContact CE1-CG 4.17Å; F1190-L1197 HydrophobicContact CE2-CD1 4.42Å; F1190-L1197 HydrophobicContact CG-CD1 3.94Å; F1190-L1197 HydrophobicContact CZ-CD1 3.9Å; F1190-V1206 HydrophobicContact CE1-CG1 4.44Å; F1190-V1206 HydrophobicContact CE2-CG1 3.72Å; F1190-V1206 HydrophobicContact CZ-CB 3.83Å; F1190-V1206 HydrophobicContact CZ-CG1 3.38Å; F1190-I1207 HydrophobicContact CD1-CD1 3.39Å; F1190-I1207 HydrophobicContact CD1-CG1 4.3Å; F1190-I1207 HydrophobicContact CE1-CD1 3.41Å; F1190-I1207 VanDerWaalsContact CE1-CD1 3.41Å; F1190-I1207 HydrophobicContact CE1-CG1 3.83Å; F1190-I1210 HydrophobicContact CD1-CD1 4.43Å; F1190-I1210 HydrophobicContact CD2-CD1 3.92Å; F1190-I1210 HydrophobicContact CE1-CD1 4.38Å; F1190-I1210 HydrophobicContact CE2-CD1 3.87Å; F1190-I1210 HydrophobicContact CG-CD1 4.21Å; F1190-I1210 HydrophobicContact CZ-CD1 4.12Å; F1190-I1222 HydrophobicContact CB-CD1 3.78Å
1191R95.5Very high97.8Very high150 Ų15040.4 Ų40.457%0.56623%0.233SC*.THydrogen-bonded Turntrans-55.2129.1-177.8-66.2-179.6-179.4-174.20.3111.6I1187 Q1193I1187-R1191 PolarHBondContact O-N 3.34Å; R1191-Q1193 VanDerWaalsContact C-N 3.31Å
1192G97.2Very high97.9Very high68 Ų6840.5 Ų40.570%0.70122%0.224SC*.THydrogen-bonded Turntrans81.3-0.5-178.400000115.3F1190 E1225F1190-G1192 PolarHBondContact O-N 3.48Å; G1192-E1225 VanDerWaalsContact C-OE1 3.27Å; G1192-E1225 WeakPolarHBondContact CA-OE2 3.48Å; G1192-E1225 PolarHBondContact N-OE2 2.92Å
1193Q97.9Very high97.9Very high36 Ų3637.2 Ų37.217%0.16821%0.209CC..  trans-138.119.9172.860.6167.4-22.800113.5T1159 A1189 F1190 R1191 V1195 L1196 L1197 E1225T1159-Q1193 PolarHBondContact OG1-NE2 3.42Å; T1159-Q1193 VanDerWaalsContact OG1-NE2 3.11Å; A1189-Q1193 PolarHBondContact O-NE2 2.83Å; F1190-Q1193 CarbonylContact O-C 3.08Å; F1190-Q1193 WeakPolarHBondContact O-CG 3.43Å; F1190-Q1193 PolarHBondContact O-N 2.99Å; R1191-Q1193 VanDerWaalsContact C-N 3.31Å; Q1193-V1195 PolarHBondContact O-N 2.92Å; Q1193-L1196 HydrophobicContact CB-CB 4.37Å; Q1193-L1196 HydrophobicContact CB-CD2 4.42Å; Q1193-L1196 PolarHBondContact O-N 3.13Å; Q1193-L1197 HydrophobicContact CG-CD1 3.72Å; Q1193-L1197 HydrophobicContact CG-CG 4.21Å; Q1193-L1197 WeakPolarHBondContact O-CB 3.5Å; Q1193-L1197 WeakPolarHBondContact O-CG 3.5Å; Q1193-L1197 PolarHBondContact O-N 3.08Å; Q1193-E1225 PolarHBondContact N-OE1 3.49Å; Q1193-E1225 VanDerWaalsContact N-OE1 3.14Å
1194V98.6Very high98Very high0 Ų037.6 Ų37.60%021%0.211CC..Hα-helixtrans-60.8-44.6-179.2175.80000111.2F1190 L1197 S1198 I1207 I1222 E1225 L1226F1190-V1194 HydrophobicContact CB-CG2 4.37Å; F1190-V1194 WeakPolarHBondContact O-CG2 3.37Å; F1190-V1194 PolarHBondContact O-N 3.3Å; V1194-L1197 PolarHBondContact O-N 3.12Å; V1194-S1198 VanDerWaalsContact O-CB 3.28Å; V1194-S1198 WeakPolarHBondContact O-CB 3.37Å; V1194-S1198 PolarHBondContact O-N 3.36Å; V1194-S1198 PolarHBondContact O-OG 3.16Å; V1194-I1207 HydrophobicContact CG1-CD1 3.97Å; V1194-I1222 HydrophobicContact CG1-CG2 3.75Å; V1194-I1222 HydrophobicContact CG2-CD1 3.8Å; V1194-I1222 HydrophobicContact CG2-CG2 4.31Å; V1194-E1225 HydrophobicContact CB-CB 3.83Å; V1194-E1225 HydrophobicContact CB-CG 3.9Å; V1194-E1225 WeakPolarHBondContact CB-OE1 3.45Å; V1194-E1225 HydrophobicContact CG1-CB 4.28Å; V1194-E1225 HydrophobicContact CG2-CB 3.92Å; V1194-E1225 HydrophobicContact CG2-CG 4.22Å; V1194-E1225 PolarHBondContact N-OE1 3.27Å; V1194-L1226 HydrophobicContact CG1-CD2 3.76Å; V1194-L1226 HydrophobicContact CG1-CG 3.75Å
1195V98.3Very high98.1Very high33 Ų3338 Ų3820%0.221%0.206CC..Hα-helixtrans-64.2-44.6178.3-177.50000110.6Q1193 L1197 S1198 S1199 E1225 L1233Q1193-V1195 PolarHBondContact O-N 2.92Å; V1195-L1197 PolarHBondContact O-N 3.01Å; V1195-S1198 PolarHBondContact O-N 3.02Å; V1195-S1199 PolarHBondContact O-N 2.59Å; V1195-S1199 VanDerWaalsContact O-N 3.11Å; V1195-S1199 PolarHBondContact O-OG 3.34Å; V1195-E1225 HydrophobicContact CG2-CG 4.47Å; V1195-L1233 HydrophobicContact CG1-CD1 4.42Å; V1195-L1233 HydrophobicContact CG1-CD2 4.08Å; V1195-L1233 HydrophobicContact CG1-CG 4.19Å
1196L98.2Very high98.1Very high113 Ų11337.2 Ų37.259%0.59220%0.202SC*.Hα-helixtrans-61.9-40.7177.3176.564.5000112.4Q1193 H1200Q1193-L1196 HydrophobicContact CB-CB 4.37Å; Q1193-L1196 HydrophobicContact CB-CD2 4.42Å; Q1193-L1196 PolarHBondContact O-N 3.13Å; L1196-H1200 PolarHBondContact O-N 3.46Å
1197L98.5Very high98.1Very high1 Ų137.2 Ų37.21%0.00520%0.202CC..Hα-helixtrans-75.8-29.9178.1-72.1175.9000112.3V1162 K1163 F1190 Q1193 V1194 V1195 S1199 H1200 G1203 C1204V1162-L1197 HydrophobicContact CG1-CD1 4.4Å; V1162-L1197 HydrophobicContact CG1-CD2 3.81Å; K1163-L1197 HydrophobicContact CD-CD2 4.39Å; K1163-L1197 HydrophobicContact CG-CD2 4.14Å; F1190-L1197 HydrophobicContact CD1-CB 4.18Å; F1190-L1197 HydrophobicContact CD1-CD1 3.36Å; F1190-L1197 HydrophobicContact CD1-CG 4.39Å; F1190-L1197 HydrophobicContact CD2-CD1 4.42Å; F1190-L1197 HydrophobicContact CE1-CB 3.83Å; F1190-L1197 HydrophobicContact CE1-CD1 3.35Å; F1190-L1197 HydrophobicContact CE1-CG 4.17Å; F1190-L1197 HydrophobicContact CE2-CD1 4.42Å; F1190-L1197 HydrophobicContact CG-CD1 3.94Å; F1190-L1197 HydrophobicContact CZ-CD1 3.9Å; Q1193-L1197 HydrophobicContact CG-CD1 3.72Å; Q1193-L1197 HydrophobicContact CG-CG 4.21Å; Q1193-L1197 WeakPolarHBondContact O-CB 3.5Å; Q1193-L1197 WeakPolarHBondContact O-CG 3.5Å; Q1193-L1197 PolarHBondContact O-N 3.08Å; V1194-L1197 PolarHBondContact O-N 3.12Å; V1195-L1197 PolarHBondContact O-N 3.01Å; L1197-S1199 VanDerWaalsContact C-N 3.32Å; L1197-H1200 VanDerWaalsContact O-CB 3.29Å; L1197-H1200 WeakPolarHBondContact O-CB 3.32Å; L1197-H1200 PolarHBondContact O-N 3Å; L1197-H1200 VanDerWaalsContact O-N 3.09Å; L1197-G1203 CarbonylContact O-C 3.55Å; L1197-G1203 WeakPolarHBondContact O-CA 3.2Å; L1197-C1204 PolarHBondContact O-N 2.84Å
1198S98.7Very high98.2Very high0 Ų038.9 Ų38.90%021%0.21CC..Hα-helixtrans-68.5-31.3173.9-60.10000112.4V1194 V1195 H1200 C1204 L1226 Y1238 G1239V1194-S1198 VanDerWaalsContact O-CB 3.28Å; V1194-S1198 WeakPolarHBondContact O-CB 3.37Å; V1194-S1198 PolarHBondContact O-N 3.36Å; V1194-S1198 PolarHBondContact O-OG 3.16Å; V1195-S1198 PolarHBondContact O-N 3.02Å; S1198-H1200 VanDerWaalsContact C-N 3.28Å; S1198-H1200 PolarHBondContact O-N 3.09Å; S1198-C1204 WeakPolarHBondContact O-CB 3.37Å; S1198-L1226 VanDerWaalsContact OG-CD2 3.24Å; S1198-L1226 WeakPolarHBondContact OG-CD2 3.43Å; S1198-Y1238 CarbonylContact O-C 3.58Å; S1198-G1239 WeakPolarHBondContact O-CA 3.48Å; S1198-G1239 PolarHBondContact O-N 3.15Å
1199S98.6Very high98.2Very high25 Ų2538.1 Ų38.118%0.17520%0.197CC..THydrogen-bonded Turntrans-86.212.6169.6-53.30000113.8V1195 L1197 H1232 L1233 D1236 Y1238V1195-S1199 PolarHBondContact O-N 2.59Å; V1195-S1199 VanDerWaalsContact O-N 3.11Å; V1195-S1199 PolarHBondContact O-OG 3.34Å; L1197-S1199 VanDerWaalsContact C-N 3.32Å; S1199-H1232 PolarHBondContact OG-CD2 2.89Å; S1199-H1232 PolarHBondContact OG-NE2 2.89Å; S1199-L1233 WeakPolarHBondContact OG-CD2 3.45Å; S1199-D1236 WeakPolarHBondContact CA-OD2 3.5Å; S1199-D1236 WeakPolarHBondContact CB-OD2 3.42Å; S1199-Y1238 WeakPolarHBondContact O-CD2 3.31Å
1200H98.5Very high98.3Very high46 Ų4636.9 Ų36.921%0.21319%0.187CC..SBendtrans-101.9133.6177.3-168.6-100.2000111L1196 L1197 S1198 Y1202 G1203 C1204L1196-H1200 PolarHBondContact O-N 3.46Å; L1197-H1200 VanDerWaalsContact O-CB 3.29Å; L1197-H1200 WeakPolarHBondContact O-CB 3.32Å; L1197-H1200 PolarHBondContact O-N 3Å; L1197-H1200 VanDerWaalsContact O-N 3.09Å; S1198-H1200 VanDerWaalsContact C-N 3.28Å; S1198-H1200 PolarHBondContact O-N 3.09Å; H1200-Y1202 AromaticContact CE1-CD2 3.75Å; H1200-Y1202 PolarHBondContact ND1-N 3.1Å; H1200-Y1202 PolarHBondContact O-N 3.42Å; H1200-G1203 PolarHBondContact ND1-N 2.7Å; H1200-G1203 PolarHBondContact O-N 3.47Å; H1200-C1204 PolarHBondContact O-N 3.28Å; H1200-C1204 PolarHBondContact O-SG 3.39Å; H1200-C1204 VanDerWaalsContact O-SG 3.41Å
1201P98.3Very high98.3Very high37 Ų3738.4 Ų38.424%0.2420%0.195CC..THydrogen-bonded Turntrans-54.4-28.3-175.517.9-32.5000115.1Y1238P1201-Y1238 HydrophobicContact CB-CD1 4.24Å; P1201-Y1238 HydrophobicContact CB-CD2 4.39Å; P1201-Y1238 HydrophobicContact CB-CE1 3.76Å; P1201-Y1238 HydrophobicContact CB-CE2 3.93Å; P1201-Y1238 HydrophobicContact CG-CE2 4.25Å
1202Y98.5Very high98.4Very high72 Ų7235.1 Ų35.128%0.28219%0.186SC..THydrogen-bonded Turntrans-105.3-27.3177.4-48.1-32.4000112.6V1162 Q1165 N1168 H1200 R1205 V1206V1162-Y1202 WeakPolarHBondContact O-CB 3.43Å; Q1165-Y1202 HydrophobicContact CB-CE2 3.93Å; N1168-Y1202 HydrophobicContact CB-CG 4.38Å; H1200-Y1202 AromaticContact CE1-CD2 3.75Å; H1200-Y1202 PolarHBondContact ND1-N 3.1Å; H1200-Y1202 PolarHBondContact O-N 3.42Å; Y1202-R1205 PolarHBondContact O-N 2.86Å; Y1202-V1206 PolarHBondContact O-N 3.12Å
1203G98.6Very high98.5Very high0 Ų035.8 Ų35.80%017%0.171CC..Hα-helixtrans-72.8-35.7-177.100000112L1197 H1200 R1205 V1206 I1207L1197-G1203 CarbonylContact O-C 3.55Å; L1197-G1203 WeakPolarHBondContact O-CA 3.2Å; H1200-G1203 PolarHBondContact ND1-N 2.7Å; H1200-G1203 PolarHBondContact O-N 3.47Å; G1203-R1205 PolarHBondContact O-N 3.45Å; G1203-V1206 PolarHBondContact O-N 2.75Å; G1203-V1206 VanDerWaalsContact O-N 3.15Å; G1203-I1207 WeakPolarHBondContact O-CG1 3.29Å; G1203-I1207 PolarHBondContact O-N 2.88Å
1204C98.6Very high98.5Very high7 Ų734.7 Ų34.75%0.04717%0.167CC..Hα-helixtrans-58.4-32.6175.167.90000112.5L1197 S1198 H1200 Q1208 V1242L1197-C1204 PolarHBondContact O-N 2.84Å; S1198-C1204 WeakPolarHBondContact O-CB 3.37Å; H1200-C1204 PolarHBondContact O-N 3.28Å; H1200-C1204 PolarHBondContact O-SG 3.39Å; H1200-C1204 VanDerWaalsContact O-SG 3.41Å; C1204-Q1208 WeakPolarHBondContact O-CG 3.4Å; C1204-Q1208 PolarHBondContact O-N 3.18Å; C1204-Q1208 PolarHBondContact O-NE2 3.45Å; C1204-V1242 HydrophobicContact CB-CG2 3.79Å
1205R98.7Very high98.4Very high99 Ų9937.9 Ų37.937%0.37418%0.184SC..Hα-helixtrans-73.1-41178.5-54.4-178.8175.6-177.1-7.4111.5Y1202 G1203 Q1208 R1209Y1202-R1205 PolarHBondContact O-N 2.86Å; G1203-R1205 PolarHBondContact O-N 3.45Å; R1205-Q1208 PolarHBondContact O-N 2.72Å; R1205-R1209 PolarHBondContact O-N 2.88Å; R1205-R1209 VanDerWaalsContact O-N 3.11Å
1206V98.7Very high98.4Very high0 Ų040.9 Ų40.90%020%0.204CC..Hα-helixtrans-67-39.9175.2-1780000111V1162 N1168 I1171 Q1172 I1175 F1190 Y1202 G1203 Q1208 R1209 I1210V1162-V1206 HydrophobicContact CG1-CG2 4.26Å; V1162-V1206 HydrophobicContact CG2-CG1 4.27Å; V1162-V1206 HydrophobicContact CG2-CG2 4.3Å; N1168-V1206 HydrophobicContact CB-CG2 4.46Å; I1171-V1206 HydrophobicContact CG2-CG1 3.68Å; I1171-V1206 HydrophobicContact CG2-CG2 4.24Å; Q1172-V1206 HydrophobicContact CG-CG2 3.98Å; I1175-V1206 HydrophobicContact CD1-CG1 3.77Å; F1190-V1206 HydrophobicContact CE1-CG1 4.44Å; F1190-V1206 HydrophobicContact CE2-CG1 3.72Å; F1190-V1206 HydrophobicContact CZ-CB 3.83Å; F1190-V1206 HydrophobicContact CZ-CG1 3.38Å; Y1202-V1206 PolarHBondContact O-N 3.12Å; G1203-V1206 PolarHBondContact O-N 2.75Å; G1203-V1206 VanDerWaalsContact O-N 3.15Å; V1206-Q1208 VanDerWaalsContact C-N 3.31Å; V1206-Q1208 PolarHBondContact O-N 2.99Å; V1206-R1209 PolarHBondContact O-N 3.19Å; V1206-I1210 HydrophobicContact CG1-CD1 4.13Å; V1206-I1210 WeakPolarHBondContact O-CG1 3.16Å; V1206-I1210 PolarHBondContact O-N 3.24Å
1207I98.6Very high98.4Very high0 Ų041.6 Ų41.60%020%0.204CC..Hα-helixtrans-56.2-45.9172.2-68.2-69.4000111F1190 V1194 G1203 I1210 L1211 I1222 L1226 V1242F1190-I1207 HydrophobicContact CD1-CD1 3.39Å; F1190-I1207 HydrophobicContact CD1-CG1 4.3Å; F1190-I1207 HydrophobicContact CE1-CD1 3.41Å; F1190-I1207 VanDerWaalsContact CE1-CD1 3.41Å; F1190-I1207 HydrophobicContact CE1-CG1 3.83Å; V1194-I1207 HydrophobicContact CG1-CD1 3.97Å; G1203-I1207 WeakPolarHBondContact O-CG1 3.29Å; G1203-I1207 PolarHBondContact O-N 2.88Å; I1207-I1210 WeakPolarHBondContact O-CB 3.44Å; I1207-I1210 PolarHBondContact O-N 2.91Å; I1207-L1211 HydrophobicContact CG2-CD1 3.93Å; I1207-L1211 HydrophobicContact CG2-CG 4.35Å; I1207-L1211 WeakPolarHBondContact O-CG 3.27Å; I1207-L1211 PolarHBondContact O-N 2.77Å; I1207-I1222 HydrophobicContact CD1-CG2 3.89Å; I1207-L1226 HydrophobicContact CG2-CD1 4.4Å; I1207-V1242 HydrophobicContact CB-CG2 4.48Å; I1207-V1242 HydrophobicContact CG2-CG1 3.55Å; I1207-V1242 HydrophobicContact CG2-CG2 4.26Å
1208Q98.7Very high98.3Very high37 Ų3741.8 Ų41.817%0.17321%0.205CC..Hα-helixtrans-61.2-47.1178.2-75.6163.187.600111.8C1204 R1205 V1206 I1210 L1211 E1212 H1245C1204-Q1208 WeakPolarHBondContact O-CG 3.4Å; C1204-Q1208 PolarHBondContact O-N 3.18Å; C1204-Q1208 PolarHBondContact O-NE2 3.45Å; R1205-Q1208 PolarHBondContact O-N 2.72Å; V1206-Q1208 VanDerWaalsContact C-N 3.31Å; V1206-Q1208 PolarHBondContact O-N 2.99Å; Q1208-I1210 VanDerWaalsContact C-N 3.3Å; Q1208-I1210 PolarHBondContact O-N 3.14Å; Q1208-L1211 PolarHBondContact O-N 2.75Å; Q1208-L1211 VanDerWaalsContact O-N 3.13Å; Q1208-E1212 WeakPolarHBondContact O-CB 3.46Å; Q1208-E1212 VanDerWaalsContact O-CG 3.24Å; Q1208-E1212 WeakPolarHBondContact O-CG 3.24Å; Q1208-E1212 PolarHBondContact O-N 3.14Å; Q1208-H1245 HydrophobicContact CG-CB 4.09Å
1209R98.7Very high98.3Very high49 Ų4942.6 Ų42.619%0.18521%0.21CC..Hα-helixtrans-58.4-39.4173.5-64.1-56.183.171.4-0.1112.8Q1172 I1175 R1205 V1206 E1212 H1213Q1172-R1209 HydrophobicContact CB-CG 3.81Å; Q1172-R1209 HydrophobicContact CG-CG 3.62Å; I1175-R1209 HydrophobicContact CB-CB 4.13Å; I1175-R1209 HydrophobicContact CD1-CB 4.11Å; I1175-R1209 HydrophobicContact CG2-CB 3.81Å; I1175-R1209 WeakPolarHBondContact CG2-O 3.49Å; R1205-R1209 PolarHBondContact O-N 2.88Å; R1205-R1209 VanDerWaalsContact O-N 3.11Å; V1206-R1209 PolarHBondContact O-N 3.19Å; R1209-E1212 IonicContact CZ-OE1 3.7Å; R1209-E1212 IonicContact CZ-OE2 3.46Å; R1209-E1212 IonicContact NE-OE1 3.9Å; R1209-E1212 IonicContact NE-OE2 3.5Å; R1209-E1212 PolarHBondContact NE-OE2 3.45Å; R1209-E1212 IonicContact NH2-OE1 3.4Å; R1209-E1212 PolarHBondContact NH2-OE1 3.04Å; R1209-E1212 IonicContact NH2-OE2 2.59Å; R1209-E1212 PolarHBondContact NH2-OE2 3.2Å; R1209-E1212 PolarHBondContact O-N 3.24Å; R1209-H1213 PolarHBondContact O-CD2 3.03Å; R1209-H1213 PolarHBondContact O-N 3.31Å
1210I98.6Very high98.3Very high0 Ų044.7 Ų44.70%021%0.214CC..Hα-helixtrans-61.1-45.8176-69.8168.5000110.6I1175 I1186 I1187 F1190 V1206 I1207 Q1208 E1212 C1214 T1219 I1222I1175-I1210 HydrophobicContact CD1-CG1 3.76Å; I1186-I1210 HydrophobicContact CG2-CD1 4.43Å; I1187-I1210 HydrophobicContact CD1-CD1 4.24Å; I1187-I1210 HydrophobicContact CD1-CG1 4.17Å; I1187-I1210 HydrophobicContact CD1-CG2 3.59Å; F1190-I1210 HydrophobicContact CD1-CD1 4.43Å; F1190-I1210 HydrophobicContact CD2-CD1 3.92Å; F1190-I1210 HydrophobicContact CE1-CD1 4.38Å; F1190-I1210 HydrophobicContact CE2-CD1 3.87Å; F1190-I1210 HydrophobicContact CG-CD1 4.21Å; F1190-I1210 HydrophobicContact CZ-CD1 4.12Å; V1206-I1210 HydrophobicContact CG1-CD1 4.13Å; V1206-I1210 WeakPolarHBondContact O-CG1 3.16Å; V1206-I1210 PolarHBondContact O-N 3.24Å; I1207-I1210 WeakPolarHBondContact O-CB 3.44Å; I1207-I1210 PolarHBondContact O-N 2.91Å; Q1208-I1210 VanDerWaalsContact C-N 3.3Å; Q1208-I1210 PolarHBondContact O-N 3.14Å; I1210-E1212 VanDerWaalsContact C-N 3.28Å; I1210-E1212 PolarHBondContact O-N 3.37Å; I1210-C1214 HydrophobicContact CG2-CB 4.21Å; I1210-C1214 VanDerWaalsContact O-CB 3.23Å; I1210-C1214 WeakPolarHBondContact O-CB 3.46Å; I1210-C1214 PolarHBondContact O-N 3.26Å; I1210-T1219 HydrophobicContact CG2-CG2 4.35Å; I1210-T1219 VanDerWaalsContact O-CG2 3.24Å; I1210-T1219 WeakPolarHBondContact O-CG2 3.36Å; I1210-I1222 HydrophobicContact CG2-CG1 4.2Å
1211L98.4Very high98.2Very high33 Ų3344.4 Ų44.417%0.17322%0.216CC..Hα-helixtrans-68.4-25.4179.2-65.4174.7000113.3I1207 Q1208 T1219 L1223 L1226 V1246I1207-L1211 HydrophobicContact CG2-CD1 3.93Å; I1207-L1211 HydrophobicContact CG2-CG 4.35Å; I1207-L1211 WeakPolarHBondContact O-CG 3.27Å; I1207-L1211 PolarHBondContact O-N 2.77Å; Q1208-L1211 PolarHBondContact O-N 2.75Å; Q1208-L1211 VanDerWaalsContact O-N 3.13Å; L1211-T1219 HydrophobicContact CD2-CG2 4.38Å; L1211-L1223 HydrophobicContact CD2-CD1 4.43Å; L1211-L1223 HydrophobicContact CD2-CD2 3.83Å; L1211-L1223 HydrophobicContact CD2-CG 3.88Å; L1211-L1226 HydrophobicContact CD1-CD1 4.21Å; L1211-V1246 HydrophobicContact CD1-CG2 3.81Å
1212E98.1Very high98.3Very high82 Ų8242.7 Ų42.738%0.38321%0.205SC..Hα-helixtrans-85.5-33.3-179.9-72161.9-160.600114.2Q1208 R1209 I1210 H1245Q1208-E1212 WeakPolarHBondContact O-CB 3.46Å; Q1208-E1212 VanDerWaalsContact O-CG 3.24Å; Q1208-E1212 WeakPolarHBondContact O-CG 3.24Å; Q1208-E1212 PolarHBondContact O-N 3.14Å; R1209-E1212 IonicContact CZ-OE1 3.7Å; R1209-E1212 IonicContact CZ-OE2 3.46Å; R1209-E1212 IonicContact NE-OE1 3.9Å; R1209-E1212 IonicContact NE-OE2 3.5Å; R1209-E1212 PolarHBondContact NE-OE2 3.45Å; R1209-E1212 IonicContact NH2-OE1 3.4Å; R1209-E1212 PolarHBondContact NH2-OE1 3.04Å; R1209-E1212 IonicContact NH2-OE2 2.59Å; R1209-E1212 PolarHBondContact NH2-OE2 3.2Å; R1209-E1212 PolarHBondContact O-N 3.24Å; I1210-E1212 VanDerWaalsContact C-N 3.28Å; I1210-E1212 PolarHBondContact O-N 3.37Å; E1212-H1245 WeakPolarHBondContact CG-CE1 3.4Å; E1212-H1245 IonicContact OE1-CE1 3.89Å; E1212-H1245 PolarHBondContact OE1-CE1 3.15Å; E1212-H1245 IonicContact OE1-ND1 3.32Å; E1212-H1245 IonicContact OE1-NE2 2.67Å
1213H97.9Very high98.3Very high81 Ų8140 Ų4038%0.37520%0.195SC..Hα-helixtrans-122.8-19.1-167.5-61.4-70.9000115.6I1175 P1180 R1209I1175-H1213 HydrophobicContact CG2-CB 3.76Å; P1180-H1213 VanDerWaalsContact CG-O 3.27Å; P1180-H1213 WeakPolarHBondContact CG-O 3.4Å; R1209-H1213 PolarHBondContact O-CD2 3.03Å; R1209-H1213 PolarHBondContact O-N 3.31Å
1214C98Very high98.2Very high14 Ų1442.3 Ų42.310%0.09521%0.208CC..SBendtrans-88.2158.5-177.4-61.60000112.3I1187 I1210 Q1218 T1219I1187-C1214 HydrophobicContact CD1-CB 4.28Å; I1210-C1214 HydrophobicContact CG2-CB 4.21Å; I1210-C1214 VanDerWaalsContact O-CB 3.23Å; I1210-C1214 WeakPolarHBondContact O-CB 3.46Å; I1210-C1214 PolarHBondContact O-N 3.26Å; C1214-Q1218 HydrophobicContact CB-CB 3.96Å; C1214-T1219 HydrophobicContact CB-CG2 4.03Å
1215L98Very high98.2Very high67 Ų6743.5 Ų43.535%0.35121%0.213SC..  trans-65.9155.5-175-58.2171000112.1P1180 E1217 Q1218 T1219P1180-L1215 HydrophobicContact CB-CD1 4.31Å; P1180-L1215 HydrophobicContact CB-CD2 4.29Å; P1180-L1215 HydrophobicContact CB-CG 3.83Å; L1215-E1217 VanDerWaalsContact C-N 3.26Å; L1215-E1217 HydrophobicContact CB-CG 4.14Å; L1215-E1217 PolarHBondContact O-N 2.78Å; L1215-Q1218 HydrophobicContact CB-CB 4.5Å; L1215-Q1218 HydrophobicContact CB-CG 4.23Å; L1215-Q1218 CarbonylContact O-C 3.36Å; L1215-Q1218 WeakPolarHBondContact O-CA 3.28Å; L1215-Q1218 WeakPolarHBondContact O-CB 3.36Å; L1215-Q1218 PolarHBondContact O-N 3.36Å; L1215-T1219 PolarHBondContact O-N 2.97Å; L1215-T1219 PolarHBondContact O-OG1 3.49Å
1216P97.5Very high98.2Very high95 Ų9539 Ų3962%0.61720%0.196SC*.Hα-helixtrans-51.9-40.4178.3-28.736.7000114.1Q1218 T1219 R1220P1216-Q1218 VanDerWaalsContact C-N 3.27Å; P1216-Q1218 PolarHBondContact O-N 2.76Å; P1216-T1219 WeakPolarHBondContact CA-OG1 3.45Å; P1216-T1219 PolarHBondContact O-N 2.76Å; P1216-T1219 PolarHBondContact O-OG1 3.27Å; P1216-R1220 VanDerWaalsContact O-CB 3.24Å; P1216-R1220 WeakPolarHBondContact O-CB 3.38Å; P1216-R1220 PolarHBondContact O-N 3.43Å
1217E97.4Very high98.2Very high128 Ų12840.3 Ų40.360%0.59820%0.202SC*.Hα-helixtrans-67.1-24.2175.759-90.8-145.900113.7L1215 P1221L1215-E1217 VanDerWaalsContact C-N 3.26Å; L1215-E1217 HydrophobicContact CB-CG 4.14Å; L1215-E1217 PolarHBondContact O-N 2.78Å; E1217-P1221 VanDerWaalsContact O-CD 3.25Å; E1217-P1221 WeakPolarHBondContact O-CD 3.06Å
1218Q98Very high98.1Very high6 Ų648.4 Ų48.43%0.02824%0.237CC..Hα-helixtrans-85.6-36174.6-67.6177.4-37.600111.8P1180 D1184 I1187 C1214 L1215 P1216 P1221P1180-Q1218 PolarHBondContact O-NE2 3.03Å; D1184-Q1218 PolarHBondContact OD1-NE2 2.71Å; I1187-Q1218 HydrophobicContact CD1-CB 4.17Å; I1187-Q1218 HydrophobicContact CG1-CB 4Å; I1187-Q1218 HydrophobicContact CG1-CG 4.24Å; I1187-Q1218 HydrophobicContact CG2-CB 4.48Å; I1187-Q1218 WeakPolarHBondContact CG2-O 3.33Å; C1214-Q1218 HydrophobicContact CB-CB 3.96Å; L1215-Q1218 HydrophobicContact CB-CB 4.5Å; L1215-Q1218 HydrophobicContact CB-CG 4.23Å; L1215-Q1218 CarbonylContact O-C 3.36Å; L1215-Q1218 WeakPolarHBondContact O-CA 3.28Å; L1215-Q1218 WeakPolarHBondContact O-CB 3.36Å; L1215-Q1218 PolarHBondContact O-N 3.36Å; P1216-Q1218 VanDerWaalsContact C-N 3.27Å; P1216-Q1218 PolarHBondContact O-N 2.76Å; Q1218-P1221 WeakPolarHBondContact O-CD 3.36Å; Q1218-P1221 WeakPolarHBondContact O-CG 3.39Å
1219T98.2Very high98Very high16 Ų1647 Ų4710%0.09823%0.233CC..Hα-helixtrans-82.9-34.2-178.7570000113.2I1210 L1211 C1214 L1215 P1216 I1222 L1223I1210-T1219 HydrophobicContact CG2-CG2 4.35Å; I1210-T1219 VanDerWaalsContact O-CG2 3.24Å; I1210-T1219 WeakPolarHBondContact O-CG2 3.36Å; L1211-T1219 HydrophobicContact CD2-CG2 4.38Å; C1214-T1219 HydrophobicContact CB-CG2 4.03Å; L1215-T1219 PolarHBondContact O-N 2.97Å; L1215-T1219 PolarHBondContact O-OG1 3.49Å; P1216-T1219 WeakPolarHBondContact CA-OG1 3.45Å; P1216-T1219 PolarHBondContact O-N 2.76Å; P1216-T1219 PolarHBondContact O-OG1 3.27Å; T1219-I1222 WeakPolarHBondContact O-CA 3.43Å; T1219-I1222 WeakPolarHBondContact O-CB 3.5Å; T1219-I1222 PolarHBondContact O-N 3.28Å; T1219-L1223 PolarHBondContact O-N 3.25Å
1220R97.8Very high98Very high70 Ų7044.9 Ų44.926%0.26423%0.225SC..Hα-helixtrans-48.2-51.2176.3-17269.9-94.5147.1-7.6114.4P1216 I1222 L1223 D1224 D1254P1216-R1220 VanDerWaalsContact O-CB 3.24Å; P1216-R1220 WeakPolarHBondContact O-CB 3.38Å; P1216-R1220 PolarHBondContact O-N 3.43Å; R1220-I1222 VanDerWaalsContact C-N 3.26Å; R1220-I1222 PolarHBondContact O-N 2.86Å; R1220-L1223 PolarHBondContact O-N 3.03Å; R1220-D1224 IonicContact CZ-OD1 3.34Å; R1220-D1224 IonicContact CZ-OD2 3.35Å; R1220-D1224 IonicContact NE-OD1 3.2Å; R1220-D1224 PolarHBondContact NE-OD1 3.36Å; R1220-D1224 IonicContact NE-OD2 2.69Å; R1220-D1224 PolarHBondContact NE-OD2 2.97Å; R1220-D1224 IonicContact NH2-OD1 2.77Å; R1220-D1224 PolarHBondContact NH2-OD1 3.4Å; R1220-D1224 IonicContact NH2-OD2 2.7Å; R1220-D1224 PolarHBondContact O-N 3.34Å; R1220-D1254 IonicContact CZ-OD1 3.01Å; R1220-D1254 IonicContact NH1-OD1 2.75Å; R1220-D1254 PolarHBondContact NH1-OD1 3.15Å; R1220-D1254 IonicContact NH1-OD2 2.71Å; R1220-D1254 PolarHBondContact NH1-OD2 3.27Å; R1220-D1254 IonicContact NH2-OD1 2.88Å; R1220-D1254 PolarHBondContact NH2-OD1 3.47Å
1221P97.8Very high97.9Very high40 Ų4049 Ų4926%0.2625%0.245SC..Hα-helixtrans-66.3-25.6177.926.4-35.9000113.7E1217 Q1218 E1225E1217-P1221 VanDerWaalsContact O-CD 3.25Å; E1217-P1221 WeakPolarHBondContact O-CD 3.06Å; Q1218-P1221 WeakPolarHBondContact O-CD 3.36Å; Q1218-P1221 WeakPolarHBondContact O-CG 3.39Å; P1221-E1225 PolarHBondContact O-N 2.93Å
1222I98.5Very high97.9Very high0 Ų052.2 Ų52.20%026%0.259CS..Hα-helixtrans-72.5-47.9173.3-54.4-61.6000109.5I1187 F1190 V1194 I1207 I1210 T1219 R1220 D1224 E1225 L1226I1187-I1222 HydrophobicContact CG2-CD1 4.32Å; I1187-I1222 HydrophobicContact CG2-CG1 4.47Å; F1190-I1222 HydrophobicContact CB-CD1 3.78Å; V1194-I1222 HydrophobicContact CG1-CG2 3.75Å; V1194-I1222 HydrophobicContact CG2-CD1 3.8Å; V1194-I1222 HydrophobicContact CG2-CG2 4.31Å; I1207-I1222 HydrophobicContact CD1-CG2 3.89Å; I1210-I1222 HydrophobicContact CG2-CG1 4.2Å; T1219-I1222 WeakPolarHBondContact O-CA 3.43Å; T1219-I1222 WeakPolarHBondContact O-CB 3.5Å; T1219-I1222 PolarHBondContact O-N 3.28Å; R1220-I1222 VanDerWaalsContact C-N 3.26Å; R1220-I1222 PolarHBondContact O-N 2.86Å; I1222-D1224 PolarHBondContact O-N 3.28Å; I1222-E1225 PolarHBondContact O-N 2.92Å; I1222-E1225 VanDerWaalsContact O-N 3.14Å; I1222-L1226 HydrophobicContact CG2-CD1 4.29Å; I1222-L1226 WeakPolarHBondContact O-CG 3.3Å; I1222-L1226 PolarHBondContact O-N 3.29Å
1223L98.6Very high97.9Very high15 Ų1548.3 Ų48.38%0.07924%0.241CC..Hα-helixtrans-58.3-44.6175.8-70.4164000111.9L1211 T1219 R1220 E1225 L1226 H1227 V1246L1211-L1223 HydrophobicContact CD2-CD1 4.43Å; L1211-L1223 HydrophobicContact CD2-CD2 3.83Å; L1211-L1223 HydrophobicContact CD2-CG 3.88Å; T1219-L1223 PolarHBondContact O-N 3.25Å; R1220-L1223 PolarHBondContact O-N 3.03Å; L1223-E1225 PolarHBondContact O-N 2.89Å; L1223-L1226 HydrophobicContact CD2-CD1 4.34Å; L1223-L1226 WeakPolarHBondContact O-CB 3.4Å; L1223-L1226 PolarHBondContact O-N 2.82Å; L1223-H1227 PolarHBondContact O-CD2 3.41Å; L1223-H1227 PolarHBondContact O-N 3.25Å; L1223-V1246 HydrophobicContact CD2-CG1 4.05Å; L1223-V1246 HydrophobicContact CD2-CG2 3.85Å
1224D98.2Very high98Very high50 Ų5044.5 Ų44.527%0.26722%0.223SC..Hα-helixtrans-71.4-10.9178.4-70.1-41.1000114.6R1220 I1222 K1228 R1257R1220-D1224 IonicContact CZ-OD1 3.34Å; R1220-D1224 IonicContact CZ-OD2 3.35Å; R1220-D1224 IonicContact NE-OD1 3.2Å; R1220-D1224 PolarHBondContact NE-OD1 3.36Å; R1220-D1224 IonicContact NE-OD2 2.69Å; R1220-D1224 PolarHBondContact NE-OD2 2.97Å; R1220-D1224 IonicContact NH2-OD1 2.77Å; R1220-D1224 PolarHBondContact NH2-OD1 3.4Å; R1220-D1224 IonicContact NH2-OD2 2.7Å; R1220-D1224 PolarHBondContact O-N 3.34Å; I1222-D1224 PolarHBondContact O-N 3.28Å; D1224-K1228 WeakPolarHBondContact O-CD 3.46Å; D1224-K1228 WeakPolarHBondContact O-CE 3.06Å; D1224-K1228 WeakPolarHBondContact O-CG 3.46Å; D1224-K1228 PolarHBondContact O-NZ 3.45Å; D1224-R1257 IonicContact OD1-CZ 3.54Å; D1224-R1257 IonicContact OD1-NH1 2.74Å; D1224-R1257 PolarHBondContact OD1-NH1 2.89Å; D1224-R1257 IonicContact OD1-NH2 3.02Å; D1224-R1257 PolarHBondContact OD1-NH2 2.87Å
1225E98.2Very high98Very high31 Ų3147.7 Ų47.715%0.14524%0.235CC..Hα-helixtrans-92.6-37.6166.2-158.2179.3131.300112G1192 Q1193 V1194 V1195 P1221 I1222 L1223 H1227 K1228 G1229G1192-E1225 VanDerWaalsContact C-OE1 3.27Å; G1192-E1225 WeakPolarHBondContact CA-OE2 3.48Å; G1192-E1225 PolarHBondContact N-OE2 2.92Å; Q1193-E1225 PolarHBondContact N-OE1 3.49Å; Q1193-E1225 VanDerWaalsContact N-OE1 3.14Å; V1194-E1225 HydrophobicContact CB-CB 3.83Å; V1194-E1225 HydrophobicContact CB-CG 3.9Å; V1194-E1225 WeakPolarHBondContact CB-OE1 3.45Å; V1194-E1225 HydrophobicContact CG1-CB 4.28Å; V1194-E1225 HydrophobicContact CG2-CB 3.92Å; V1194-E1225 HydrophobicContact CG2-CG 4.22Å; V1194-E1225 PolarHBondContact N-OE1 3.27Å; V1195-E1225 HydrophobicContact CG2-CG 4.47Å; P1221-E1225 PolarHBondContact O-N 2.93Å; I1222-E1225 PolarHBondContact O-N 2.92Å; I1222-E1225 VanDerWaalsContact O-N 3.14Å; L1223-E1225 PolarHBondContact O-N 2.89Å; E1225-H1227 VanDerWaalsContact C-N 3.29Å; E1225-H1227 PolarHBondContact O-N 3.02Å; E1225-K1228 WeakPolarHBondContact O-CB 3.4Å; E1225-K1228 PolarHBondContact O-N 3.21Å; E1225-K1228 VanDerWaalsContact O-N 3.14Å; E1225-G1229 PolarHBondContact O-N 2.8Å
1226L98.4Very high98Very high4 Ų445.7 Ų45.72%0.02123%0.225CC..Hα-helixtrans-55.3-43.8169.6-71.3171.7000111.9V1194 S1198 I1207 L1211 I1222 L1223 K1228 G1229 V1230 L1233 V1242 V1246V1194-L1226 HydrophobicContact CG1-CD2 3.76Å; V1194-L1226 HydrophobicContact CG1-CG 3.75Å; S1198-L1226 VanDerWaalsContact OG-CD2 3.24Å; S1198-L1226 WeakPolarHBondContact OG-CD2 3.43Å; I1207-L1226 HydrophobicContact CG2-CD1 4.4Å; L1211-L1226 HydrophobicContact CD1-CD1 4.21Å; I1222-L1226 HydrophobicContact CG2-CD1 4.29Å; I1222-L1226 WeakPolarHBondContact O-CG 3.3Å; I1222-L1226 PolarHBondContact O-N 3.29Å; L1223-L1226 HydrophobicContact CD2-CD1 4.34Å; L1223-L1226 WeakPolarHBondContact O-CB 3.4Å; L1223-L1226 PolarHBondContact O-N 2.82Å; L1226-K1228 PolarHBondContact O-N 3.1Å; L1226-G1229 CarbonylContact O-C 3.09Å; L1226-G1229 WeakPolarHBondContact O-CA 3.29Å; L1226-G1229 PolarHBondContact O-N 2.8Å; L1226-V1230 WeakPolarHBondContact O-CG2 3.25Å; L1226-V1230 PolarHBondContact O-N 3.3Å; L1226-V1230 VanDerWaalsContact O-N 3.17Å; L1226-L1233 HydrophobicContact CD2-CD1 3.7Å; L1226-V1242 HydrophobicContact CD1-CG1 3.89Å; L1226-V1242 HydrophobicContact CD2-CG1 3.66Å; L1226-V1242 HydrophobicContact CG-CG1 4.47Å; L1226-V1246 HydrophobicContact CD1-CG2 4.37Å
1227H98.4Very high98.1Very high28 Ų2845.1 Ų45.113%0.1321%0.214CC..Hα-helixtrans-59.7-27.1178.4-79.1-57000114L1223 E1225 G1229 D1254 R1257L1223-H1227 PolarHBondContact O-CD2 3.41Å; L1223-H1227 PolarHBondContact O-N 3.25Å; E1225-H1227 VanDerWaalsContact C-N 3.29Å; E1225-H1227 PolarHBondContact O-N 3.02Å; H1227-G1229 VanDerWaalsContact C-N 3.33Å; H1227-D1254 IonicContact CD2-OD1 3.74Å; H1227-D1254 PolarHBondContact CE1-O 3.35Å; H1227-D1254 IonicContact CE1-OD1 3.89Å; H1227-D1254 IonicContact NE2-OD1 3.65Å; H1227-D1254 PolarHBondContact NE2-OD1 2.98Å; H1227-R1257 PolarHBondContact CD2-NH2 3.24Å; H1227-R1257 VanDerWaalsContact CE1-CB 3.46Å; H1227-R1257 WeakPolarHBondContact CE1-CB 3.34Å
1228K97.1Very high98.1Very high170 Ų17041.7 Ų41.774%0.73920%0.196SC*.Hα-helixtrans-77.4-22.2174.6-61.2164.3-170.71480112.1D1224 E1225 L1226D1224-K1228 WeakPolarHBondContact O-CD 3.46Å; D1224-K1228 WeakPolarHBondContact O-CE 3.06Å; D1224-K1228 WeakPolarHBondContact O-CG 3.46Å; D1224-K1228 PolarHBondContact O-NZ 3.45Å; E1225-K1228 WeakPolarHBondContact O-CB 3.4Å; E1225-K1228 PolarHBondContact O-N 3.21Å; E1225-K1228 VanDerWaalsContact O-N 3.14Å; L1226-K1228 PolarHBondContact O-N 3.1Å
1229G97.2Very high98.2Very high9 Ų941.4 Ų41.49%0.09320%0.195CC..Hα-helixtrans-103.2-3.1-175.500000116E1225 L1226 H1227 E1231 H1232 L1233E1225-G1229 PolarHBondContact O-N 2.8Å; L1226-G1229 CarbonylContact O-C 3.09Å; L1226-G1229 WeakPolarHBondContact O-CA 3.29Å; L1226-G1229 PolarHBondContact O-N 2.8Å; H1227-G1229 VanDerWaalsContact C-N 3.33Å; G1229-E1231 VanDerWaalsContact C-N 3.34Å; G1229-E1231 PolarHBondContact O-N 2.98Å; G1229-E1231 VanDerWaalsContact O-N 3.15Å; G1229-H1232 WeakPolarHBondContact O-CB 3.09Å; G1229-H1232 PolarHBondContact O-N 2.81Å; G1229-L1233 WeakPolarHBondContact O-CG 3.33Å; G1229-L1233 PolarHBondContact O-N 3.22Å
1230V98.3Very high98.2Very high3 Ų340.7 Ų40.72%0.01819%0.19CC..Hα-helixtrans-47.9-49.8-168.4179.50000113L1226 H1232 L1233 V1234 I1243 I1258 N1261L1226-V1230 WeakPolarHBondContact O-CG2 3.25Å; L1226-V1230 PolarHBondContact O-N 3.3Å; L1226-V1230 VanDerWaalsContact O-N 3.17Å; V1230-H1232 VanDerWaalsContact C-N 3.27Å; V1230-H1232 PolarHBondContact O-N 3.07Å; V1230-L1233 PolarHBondContact O-N 2.93Å; V1230-L1233 VanDerWaalsContact O-N 3.11Å; V1230-V1234 HydrophobicContact CG1-CG1 3.87Å; V1230-V1234 WeakPolarHBondContact O-CG1 3.4Å; V1230-V1234 WeakPolarHBondContact O-CG2 3.24Å; V1230-V1234 PolarHBondContact O-N 2.9Å; V1230-I1243 HydrophobicContact CG2-CD1 4.47Å; V1230-I1258 HydrophobicContact CG1-CG2 4.33Å; V1230-I1258 HydrophobicContact CG2-CG1 4.32Å; V1230-N1261 HydrophobicContact CB-CB 4.5Å; V1230-N1261 HydrophobicContact CG1-CB 4.07Å
1231E96.7Very high98.3Very high88 Ų8843.3 Ų43.341%0.41120%0.201SC..Hα-helixtrans-58-36.1-178.7168.6156.7-158.500113.9G1229 K1235 R1265G1229-E1231 VanDerWaalsContact C-N 3.34Å; G1229-E1231 PolarHBondContact O-N 2.98Å; G1229-E1231 VanDerWaalsContact O-N 3.15Å; E1231-K1235 WeakPolarHBondContact O-CD 3.36Å; E1231-K1235 WeakPolarHBondContact O-CE 3.4Å; E1231-K1235 IonicContact OE1-NZ 3.24Å; E1231-K1235 PolarHBondContact OE1-NZ 2.9Å; E1231-R1265 IonicContact OE1-NH1 3.69Å; E1231-R1265 PolarHBondContact OE1-NH1 3.17Å; E1231-R1265 VanDerWaalsContact OE1-NH1 3.08Å; E1231-R1265 IonicContact OE2-CZ 3.5Å; E1231-R1265 IonicContact OE2-NH1 2.64Å; E1231-R1265 PolarHBondContact OE2-NH1 2.99Å; E1231-R1265 IonicContact OE2-NH2 2.8Å
1232H97.9Very high98.3Very high100 Ų10041.4 Ų41.446%0.46319%0.188SC..Hα-helixtrans-73.9-50.7173.3170.462.1000110.2S1199 G1229 V1230 V1234 K1235 D1236S1199-H1232 PolarHBondContact OG-CD2 2.89Å; S1199-H1232 PolarHBondContact OG-NE2 2.89Å; G1229-H1232 WeakPolarHBondContact O-CB 3.09Å; G1229-H1232 PolarHBondContact O-N 2.81Å; V1230-H1232 VanDerWaalsContact C-N 3.27Å; V1230-H1232 PolarHBondContact O-N 3.07Å; H1232-V1234 PolarHBondContact O-N 3.46Å; H1232-K1235 CarbonylContact O-C 3.54Å; H1232-K1235 PolarHBondContact O-N 3.47Å; H1232-D1236 PolarHBondContact O-N 3.47Å
1233L98.7Very high98.3Very high0 Ų041.4 Ų41.40%019%0.189CC..Hα-helixtrans-62.1-38.3-171.9-66.6173.2000113V1195 S1199 L1226 G1229 V1230 K1235 D1236 G1239 N1240 I1243V1195-L1233 HydrophobicContact CG1-CD1 4.42Å; V1195-L1233 HydrophobicContact CG1-CD2 4.08Å; V1195-L1233 HydrophobicContact CG1-CG 4.19Å; S1199-L1233 WeakPolarHBondContact OG-CD2 3.45Å; L1226-L1233 HydrophobicContact CD2-CD1 3.7Å; G1229-L1233 WeakPolarHBondContact O-CG 3.33Å; G1229-L1233 PolarHBondContact O-N 3.22Å; V1230-L1233 PolarHBondContact O-N 2.93Å; V1230-L1233 VanDerWaalsContact O-N 3.11Å; L1233-K1235 PolarHBondContact O-N 3.11Å; L1233-D1236 PolarHBondContact O-N 3.43Å; L1233-D1236 VanDerWaalsContact O-N 3.15Å; L1233-G1239 CarbonylContact O-C 3.29Å; L1233-N1240 WeakPolarHBondContact O-CA 3.47Å; L1233-N1240 PolarHBondContact O-N 3.35Å; L1233-I1243 HydrophobicContact CB-CD1 3.9Å; L1233-I1243 HydrophobicContact CB-CG1 3.76Å; L1233-I1243 HydrophobicContact CD1-CD1 4Å
1234V98.7Very high98.3Very high1 Ų141.6 Ų41.61%0.00619%0.189CC..THydrogen-bonded Turntrans-65.7-21.1177.1-58.70000113.5V1230 H1232 I1243 L1262 L1269 A1275 V1278V1230-V1234 HydrophobicContact CG1-CG1 3.87Å; V1230-V1234 WeakPolarHBondContact O-CG1 3.4Å; V1230-V1234 WeakPolarHBondContact O-CG2 3.24Å; V1230-V1234 PolarHBondContact O-N 2.9Å; H1232-V1234 PolarHBondContact O-N 3.46Å; V1234-I1243 HydrophobicContact CG1-CB 4.12Å; V1234-I1243 HydrophobicContact CG1-CG1 3.89Å; V1234-I1243 HydrophobicContact CG1-CG2 3.81Å; V1234-L1262 HydrophobicContact CG1-CD2 4.23Å; V1234-L1269 HydrophobicContact CG2-CD2 4.22Å; V1234-A1275 HydrophobicContact CB-CB 4.49Å; V1234-A1275 VanDerWaalsContact O-CA 3.28Å; V1234-A1275 WeakPolarHBondContact O-CA 3.48Å; V1234-A1275 VanDerWaalsContact O-CB 3.23Å; V1234-A1275 WeakPolarHBondContact O-CB 3.42Å; V1234-A1275 PolarHBondContact O-N 3.01Å; V1234-V1278 HydrophobicContact CB-CB 4.41Å; V1234-V1278 HydrophobicContact CB-CG1 4.22Å; V1234-V1278 HydrophobicContact CB-CG2 4.09Å; V1234-V1278 HydrophobicContact CG1-CB 4.43Å; V1234-V1278 HydrophobicContact CG1-CG1 3.74Å; V1234-V1278 HydrophobicContact CG1-CG2 4.26Å
1235K98.6Very high98.4Very high81 Ų8139.9 Ų39.935%0.35218%0.179SC..THydrogen-bonded Turntrans-97.7-13.7177-57.7170.2-164.1163.70112.3E1231 H1232 L1233 L1269 H1272E1231-K1235 WeakPolarHBondContact O-CD 3.36Å; E1231-K1235 WeakPolarHBondContact O-CE 3.4Å; E1231-K1235 IonicContact OE1-NZ 3.24Å; E1231-K1235 PolarHBondContact OE1-NZ 2.9Å; H1232-K1235 CarbonylContact O-C 3.54Å; H1232-K1235 PolarHBondContact O-N 3.47Å; L1233-K1235 PolarHBondContact O-N 3.11Å; K1235-L1269 HydrophobicContact CG-CD2 4.4Å; K1235-H1272 PolarHBondContact O-CE1 3.5Å; K1235-H1272 VanDerWaalsContact O-CE1 3.3Å
1236D98.7Very high98.4Very high24 Ų2438.6 Ų38.613%0.12817%0.174CC..SBendtrans-78.3147.5179-178.162000112.7S1199 H1232 L1233 Y1238 G1239 N1240S1199-D1236 WeakPolarHBondContact CA-OD2 3.5Å; S1199-D1236 WeakPolarHBondContact CB-OD2 3.42Å; H1232-D1236 PolarHBondContact O-N 3.47Å; L1233-D1236 PolarHBondContact O-N 3.43Å; L1233-D1236 VanDerWaalsContact O-N 3.15Å; D1236-Y1238 VanDerWaalsContact C-N 3.26Å; D1236-Y1238 PolarHBondContact O-N 3.28Å; D1236-Y1238 WeakPolarHBondContact OD2-CA 3.5Å; D1236-Y1238 WeakPolarHBondContact OD2-CB 3.42Å; D1236-Y1238 PolarHBondContact OD2-N 3.46Å; D1236-G1239 PolarHBondContact OD2-N 2.95Å; D1236-N1240 WeakPolarHBondContact O-CB 3.31Å; D1236-N1240 PolarHBondContact O-N 2.86Å; D1236-N1240 PolarHBondContact O-ND2 3.4Å
1237Q98.5Very high98.4Very high84 Ų8438.4 Ų38.439%0.39317%0.173SC..THydrogen-bonded Turntrans-66.9-22-177.875.8-162.5-63.100114.1N1240 Y1241 F1274Q1237-N1240 VanDerWaalsContact C-ND2 3.26Å; Q1237-N1240 PolarHBondContact O-ND2 3.17Å; Q1237-Y1241 WeakPolarHBondContact O-CE2 3.33Å; Q1237-F1274 HydrophobicContact CB-CD1 4.42Å; Q1237-F1274 HydrophobicContact CB-CD2 4.28Å; Q1237-F1274 HydrophobicContact CB-CE1 3.86Å; Q1237-F1274 HydrophobicContact CB-CE2 3.7Å; Q1237-F1274 HydrophobicContact CB-CZ 3.46Å; Q1237-F1274 VanDerWaalsContact CB-CZ 3.46Å
1238Y98.5Very high98.4Very high56 Ų5638.2 Ų38.222%0.2217%0.172CC..THydrogen-bonded Turntrans-112.5-41.8176.5-53.7-63.1000111.7S1198 S1199 P1201 D1236 N1240 Y1241S1198-Y1238 CarbonylContact O-C 3.58Å; S1199-Y1238 WeakPolarHBondContact O-CD2 3.31Å; P1201-Y1238 HydrophobicContact CB-CD1 4.24Å; P1201-Y1238 HydrophobicContact CB-CD2 4.39Å; P1201-Y1238 HydrophobicContact CB-CE1 3.76Å; P1201-Y1238 HydrophobicContact CB-CE2 3.93Å; P1201-Y1238 HydrophobicContact CG-CE2 4.25Å; D1236-Y1238 VanDerWaalsContact C-N 3.26Å; D1236-Y1238 PolarHBondContact O-N 3.28Å; D1236-Y1238 WeakPolarHBondContact OD2-CA 3.5Å; D1236-Y1238 WeakPolarHBondContact OD2-CB 3.42Å; D1236-Y1238 PolarHBondContact OD2-N 3.46Å; Y1238-N1240 PolarHBondContact O-N 2.88Å; Y1238-Y1241 PolarHBondContact O-N 2.9Å; Y1238-Y1241 VanDerWaalsContact O-N 3.1Å
1239G98.7Very high98.4Very high0 Ų034.2 Ų34.20%016%0.156CC..Hα-helixtrans-59.6-29-179.800000113.7S1198 L1233 D1236 Y1241 V1242 I1243S1198-G1239 WeakPolarHBondContact O-CA 3.48Å; S1198-G1239 PolarHBondContact O-N 3.15Å; L1233-G1239 CarbonylContact O-C 3.29Å; D1236-G1239 PolarHBondContact OD2-N 2.95Å; G1239-Y1241 PolarHBondContact O-N 3.2Å; G1239-V1242 WeakPolarHBondContact O-CB 3.5Å; G1239-V1242 PolarHBondContact O-N 3.29Å; G1239-V1242 VanDerWaalsContact O-N 3.08Å; G1239-I1243 PolarHBondContact O-N 3.14Å; G1239-I1243 VanDerWaalsContact O-N 3.13Å
1240N98.8Very high98.4Very high1 Ų134.9 Ų34.91%0.00516%0.162CC..Hα-helixtrans-61.5-33.8177.477.888.8000111.9L1233 D1236 Q1237 Y1238 V1242 I1243 Q1244 F1274 V1278L1233-N1240 WeakPolarHBondContact O-CA 3.47Å; L1233-N1240 PolarHBondContact O-N 3.35Å; D1236-N1240 WeakPolarHBondContact O-CB 3.31Å; D1236-N1240 PolarHBondContact O-N 2.86Å; D1236-N1240 PolarHBondContact O-ND2 3.4Å; Q1237-N1240 VanDerWaalsContact C-ND2 3.26Å; Q1237-N1240 PolarHBondContact O-ND2 3.17Å; Y1238-N1240 PolarHBondContact O-N 2.88Å; N1240-V1242 VanDerWaalsContact C-N 3.35Å; N1240-I1243 PolarHBondContact O-N 3.22Å; N1240-Q1244 WeakPolarHBondContact O-CB 3.44Å; N1240-Q1244 VanDerWaalsContact O-CG 3.24Å; N1240-Q1244 WeakPolarHBondContact O-CG 3.21Å; N1240-Q1244 PolarHBondContact O-N 3.38Å; N1240-Q1244 PolarHBondContact OD1-NE2 3.01Å; N1240-F1274 HydrophobicContact CB-CB 4.16Å; N1240-V1278 HydrophobicContact CB-CG2 3.83Å
1241Y98.8Very high98.3Very high124 Ų12437.3 Ų37.349%0.48618%0.179SC..Hα-helixtrans-68.6-34.8176.3-62.8-72.4000111.8Q1237 Y1238 G1239 Q1244 H1245Q1237-Y1241 WeakPolarHBondContact O-CE2 3.33Å; Y1238-Y1241 PolarHBondContact O-N 2.9Å; Y1238-Y1241 VanDerWaalsContact O-N 3.1Å; G1239-Y1241 PolarHBondContact O-N 3.2Å; Y1241-Q1244 PolarHBondContact O-N 3.49Å; Y1241-H1245 VanDerWaalsContact O-CB 3.31Å; Y1241-H1245 WeakPolarHBondContact O-CB 3.39Å; Y1241-H1245 PolarHBondContact O-N 3.46Å
1242V98.8Very high98.3Very high0 Ų038.2 Ų38.20%019%0.187CC..Hα-helixtrans-65.4-43.4175.1-179.60000110.9C1204 I1207 L1226 G1239 N1240 H1245 V1246C1204-V1242 HydrophobicContact CB-CG2 3.79Å; I1207-V1242 HydrophobicContact CB-CG2 4.48Å; I1207-V1242 HydrophobicContact CG2-CG1 3.55Å; I1207-V1242 HydrophobicContact CG2-CG2 4.26Å; L1226-V1242 HydrophobicContact CD1-CG1 3.89Å; L1226-V1242 HydrophobicContact CD2-CG1 3.66Å; L1226-V1242 HydrophobicContact CG-CG1 4.47Å; G1239-V1242 WeakPolarHBondContact O-CB 3.5Å; G1239-V1242 PolarHBondContact O-N 3.29Å; G1239-V1242 VanDerWaalsContact O-N 3.08Å; N1240-V1242 VanDerWaalsContact C-N 3.35Å; V1242-H1245 PolarHBondContact O-N 3.45Å; V1242-V1246 WeakPolarHBondContact O-CG2 3.27Å; V1242-V1246 PolarHBondContact O-N 3.22Å; V1242-V1246 VanDerWaalsContact O-N 3.12Å
1243I98.8Very high98.3Very high1 Ų138.8 Ų38.81%0.00519%0.19CC..Hα-helixtrans-68.1-40.9175.7-53.5-53.3000111.2V1230 L1233 V1234 G1239 N1240 H1245 V1246 L1247 I1258 V1278V1230-I1243 HydrophobicContact CG2-CD1 4.47Å; L1233-I1243 HydrophobicContact CB-CD1 3.9Å; L1233-I1243 HydrophobicContact CB-CG1 3.76Å; L1233-I1243 HydrophobicContact CD1-CD1 4Å; V1234-I1243 HydrophobicContact CG1-CB 4.12Å; V1234-I1243 HydrophobicContact CG1-CG1 3.89Å; V1234-I1243 HydrophobicContact CG1-CG2 3.81Å; G1239-I1243 PolarHBondContact O-N 3.14Å; G1239-I1243 VanDerWaalsContact O-N 3.13Å; N1240-I1243 PolarHBondContact O-N 3.22Å; I1243-H1245 VanDerWaalsContact C-N 3.3Å; I1243-H1245 PolarHBondContact O-N 3.34Å; I1243-V1246 PolarHBondContact O-N 3.44Å; I1243-L1247 HydrophobicContact CG2-CD1 4.12Å; I1243-L1247 HydrophobicContact CG2-CG 4.45Å; I1243-L1247 WeakPolarHBondContact O-CB 3.42Å; I1243-L1247 WeakPolarHBondContact O-CG 3.34Å; I1243-L1247 PolarHBondContact O-N 3.4Å; I1243-I1258 HydrophobicContact CG2-CD1 4.01Å; I1243-I1258 HydrophobicContact CG2-CG1 4.37Å; I1243-I1258 HydrophobicContact CG2-CG2 3.62Å; I1243-V1278 HydrophobicContact CG2-CG1 3.87Å
1244Q98.8Very high98.3Very high19 Ų1939 Ų399%0.08919%0.191CC..Hα-helixtrans-58.3-42.8173.6-74.4-176.480.800111.6N1240 Y1241 L1247 E1248 V1278 K1281N1240-Q1244 WeakPolarHBondContact O-CB 3.44Å; N1240-Q1244 VanDerWaalsContact O-CG 3.24Å; N1240-Q1244 WeakPolarHBondContact O-CG 3.21Å; N1240-Q1244 PolarHBondContact O-N 3.38Å; N1240-Q1244 PolarHBondContact OD1-NE2 3.01Å; Y1241-Q1244 PolarHBondContact O-N 3.49Å; Q1244-L1247 WeakPolarHBondContact O-CB 3.26Å; Q1244-L1247 PolarHBondContact O-N 2.83Å; Q1244-E1248 WeakPolarHBondContact O-CG 3.47Å; Q1244-E1248 PolarHBondContact O-N 3.47Å; Q1244-V1278 HydrophobicContact CG-CG2 4.16Å; Q1244-K1281 HydrophobicContact CB-CG 3.98Å; Q1244-K1281 HydrophobicContact CG-CB 4.23Å; Q1244-K1281 HydrophobicContact CG-CG 3.6Å; Q1244-K1281 VanDerWaalsContact OE1-CG 3.24Å
1245H98.7Very high98.2Very high13 Ų1339.9 Ų39.96%0.0620%0.195CC..Hα-helixtrans-60.7-45.2176.9-178.691.1000112.2Q1208 E1212 Y1241 V1242 I1243 L1247 E1248 H1249Q1208-H1245 HydrophobicContact CG-CB 4.09Å; E1212-H1245 WeakPolarHBondContact CG-CE1 3.4Å; E1212-H1245 IonicContact OE1-CE1 3.89Å; E1212-H1245 PolarHBondContact OE1-CE1 3.15Å; E1212-H1245 IonicContact OE1-ND1 3.32Å; E1212-H1245 IonicContact OE1-NE2 2.67Å; Y1241-H1245 VanDerWaalsContact O-CB 3.31Å; Y1241-H1245 WeakPolarHBondContact O-CB 3.39Å; Y1241-H1245 PolarHBondContact O-N 3.46Å; V1242-H1245 PolarHBondContact O-N 3.45Å; I1243-H1245 VanDerWaalsContact C-N 3.3Å; I1243-H1245 PolarHBondContact O-N 3.34Å; H1245-L1247 VanDerWaalsContact C-N 3.34Å; H1245-L1247 PolarHBondContact O-N 3.5Å; H1245-E1248 PolarHBondContact O-N 3.08Å; H1245-H1249 AromaticContact CE1-CD2 3.4Å; H1245-H1249 PolarHBondContact CE1-CD2 3.44Å; H1245-H1249 VanDerWaalsContact CE1-CD2 3.4Å; H1245-H1249 AromaticContact CG-CD2 3.92Å; H1245-H1249 AromaticContact ND1-CD2 3.42Å; H1245-H1249 PolarHBondContact ND1-CD2 3.2Å; H1245-H1249 AromaticContact ND1-NE2 4Å; H1245-H1249 AromaticContact NE2-CD2 3.9Å; H1245-H1249 PolarHBondContact O-CD2 3.33Å; H1245-H1249 PolarHBondContact O-N 3.22Å
1246V98.7Very high98.2Very high4 Ų437.4 Ų37.42%0.02419%0.187CC..Hα-helixtrans-65.7-36.7174.7-179.40000111.5L1211 L1223 L1226 V1242 I1243 E1248 G1250 D1254 I1258L1211-V1246 HydrophobicContact CD1-CG2 3.81Å; L1223-V1246 HydrophobicContact CD2-CG1 4.05Å; L1223-V1246 HydrophobicContact CD2-CG2 3.85Å; L1226-V1246 HydrophobicContact CD1-CG2 4.37Å; V1242-V1246 WeakPolarHBondContact O-CG2 3.27Å; V1242-V1246 PolarHBondContact O-N 3.22Å; V1242-V1246 VanDerWaalsContact O-N 3.12Å; I1243-V1246 PolarHBondContact O-N 3.44Å; V1246-E1248 VanDerWaalsContact C-N 3.29Å; V1246-E1248 PolarHBondContact O-N 3.48Å; V1246-G1250 VanDerWaalsContact O-CA 3.27Å; V1246-G1250 WeakPolarHBondContact O-CA 3.42Å; V1246-G1250 PolarHBondContact O-N 3.36Å; V1246-D1254 HydrophobicContact CG1-CB 3.91Å; V1246-I1258 HydrophobicContact CB-CD1 3.82Å; V1246-I1258 HydrophobicContact CG1-CD1 3.52Å
1247L98.6Very high98.2Very high0 Ų040 Ų400%020%0.195CC..Hα-helixtrans-64.1-32174.5-75168.8000112.7I1243 Q1244 H1245 K1255 I1258 I1259 V1278 K1281 A1282 N1285I1243-L1247 HydrophobicContact CG2-CD1 4.12Å; I1243-L1247 HydrophobicContact CG2-CG 4.45Å; I1243-L1247 WeakPolarHBondContact O-CB 3.42Å; I1243-L1247 WeakPolarHBondContact O-CG 3.34Å; I1243-L1247 PolarHBondContact O-N 3.4Å; Q1244-L1247 WeakPolarHBondContact O-CB 3.26Å; Q1244-L1247 PolarHBondContact O-N 2.83Å; H1245-L1247 VanDerWaalsContact C-N 3.34Å; H1245-L1247 PolarHBondContact O-N 3.5Å; L1247-K1255 WeakPolarHBondContact O-CD 3.45Å; L1247-K1255 WeakPolarHBondContact O-CE 3.42Å; L1247-K1255 PolarHBondContact O-NZ 3.2Å; L1247-I1258 HydrophobicContact CD1-CG2 4.17Å; L1247-I1258 HydrophobicContact CD2-CB 4.16Å; L1247-I1258 HydrophobicContact CD2-CG2 3.82Å; L1247-I1258 HydrophobicContact CG-CD1 4.41Å; L1247-I1258 HydrophobicContact CG-CG2 4.08Å; L1247-I1259 HydrophobicContact CD2-CD1 4.45Å; L1247-I1259 HydrophobicContact CD2-CG1 4.17Å; L1247-V1278 HydrophobicContact CD1-CG1 3.79Å; L1247-K1281 HydrophobicContact CB-CB 4.33Å; L1247-K1281 HydrophobicContact CD1-CB 4.21Å; L1247-A1282 HydrophobicContact CD1-CB 4.06Å; L1247-A1282 HydrophobicContact CD2-CB 4.37Å; L1247-N1285 WeakPolarHBondContact O-CB 3.16Å; L1247-N1285 PolarHBondContact O-OD1 3.1Å
1248E98.3Very high98.2Very high25 Ų2536.1 Ų36.112%0.11718%0.177CC..Hα-helixtrans-84.7-49.1178.4-68.2-172.9137.900112.7S134 Q1244 H1245 V1246 K1255 K1281S134-E1248 VanDerWaalsContact CA-OE1 3.32Å; S134-E1248 WeakPolarHBondContact CA-OE1 3.2Å; S134-E1248 VanDerWaalsContact CB-OE2 3.22Å; S134-E1248 WeakPolarHBondContact CB-OE2 3.3Å; S134-E1248 PolarHBondContact OG-OE2 3.1Å; Q1244-E1248 WeakPolarHBondContact O-CG 3.47Å; Q1244-E1248 PolarHBondContact O-N 3.47Å; H1245-E1248 PolarHBondContact O-N 3.08Å; V1246-E1248 VanDerWaalsContact C-N 3.29Å; V1246-E1248 PolarHBondContact O-N 3.48Å; E1248-K1255 PolarHBondContact O-NZ 3.29Å; E1248-K1281 HydrophobicContact CG-CD 4.33Å; E1248-K1281 VanDerWaalsContact OE1-CD 3.29Å; E1248-K1281 WeakPolarHBondContact OE1-CD 3.46Å; E1248-K1281 WeakPolarHBondContact OE1-CE 3.47Å; E1248-K1281 IonicContact OE1-NZ 3.52Å; E1248-K1281 PolarHBondContact OE1-NZ 3.22Å; E1248-K1281 IonicContact OE2-NZ 3.72Å
1249H97.1Very high98.2Very high86 Ų8633.6 Ų33.640%0.39817%0.168SC..Hα-helixtrans-111.1-14.3-167.9-50.5-75.2000115.2S134 H1245S134-H1249 PolarHBondContact OG-CE1 3.38Å; S134-H1249 PolarHBondContact OG-NE2 3.47Å; S134-H1249 VanDerWaalsContact OG-NE2 3.15Å; H1245-H1249 AromaticContact CE1-CD2 3.4Å; H1245-H1249 PolarHBondContact CE1-CD2 3.44Å; H1245-H1249 VanDerWaalsContact CE1-CD2 3.4Å; H1245-H1249 AromaticContact CG-CD2 3.92Å; H1245-H1249 AromaticContact ND1-CD2 3.42Å; H1245-H1249 PolarHBondContact ND1-CD2 3.2Å; H1245-H1249 AromaticContact ND1-NE2 4Å; H1245-H1249 AromaticContact NE2-CD2 3.9Å; H1245-H1249 PolarHBondContact O-CD2 3.33Å; H1245-H1249 PolarHBondContact O-N 3.22Å
1250G96.8Very high98.1Very high22 Ų2239.5 Ų39.523%0.22720%0.195CC..SBendtrans-72.1172.3-177.200000114.3V1246 K1255V1246-G1250 VanDerWaalsContact O-CA 3.27Å; V1246-G1250 WeakPolarHBondContact O-CA 3.42Å; V1246-G1250 PolarHBondContact O-N 3.36Å; G1250-K1255 WeakPolarHBondContact O-CE 3.46Å
1251S97.1Very high98Very high54 Ų5442.1 Ų42.138%0.37821%0.209SC..  trans-63.7153.317584.80000111.6E1253 D1254 K1255S1251-E1253 PolarHBondContact O-N 3.47Å; S1251-E1253 PolarHBondContact OG-N 2.92Å; S1251-D1254 PolarHBondContact O-N 3.01Å; S1251-D1254 PolarHBondContact OG-N 2.98Å; S1251-D1254 VanDerWaalsContact OG-N 3.11Å; S1251-D1254 PolarHBondContact OG-OD2 3.24Å; S1251-K1255 WeakPolarHBondContact O-CG 3.34Å; S1251-K1255 PolarHBondContact O-N 2.59Å
1252N96.8Very high97.9Very high108 Ų10836.2 Ų36.258%0.57819%0.186SC*.Hα-helixtrans-58.7-31.3175.3-72.8-22.5000112.4K1255 S1256N1252-K1255 PolarHBondContact O-N 3.34Å; N1252-S1256 WeakPolarHBondContact O-CB 3.49Å; N1252-S1256 PolarHBondContact O-N 2.91Å; N1252-S1256 PolarHBondContact O-OG 2.85Å
1253E97.4Very high97.7Very high111 Ų11142 Ų4252%0.51921%0.208SC..Hα-helixtrans-63.3-46.6173.5-169-153.8126.300111.4S1251 S1256 R1257S1251-E1253 PolarHBondContact O-N 3.47Å; S1251-E1253 PolarHBondContact OG-N 2.92Å; E1253-S1256 PolarHBondContact O-N 3.1Å; E1253-R1257 WeakPolarHBondContact O-CB 3.47Å; E1253-R1257 VanDerWaalsContact O-CG 3.27Å; E1253-R1257 WeakPolarHBondContact O-CG 3.42Å; E1253-R1257 PolarHBondContact O-N 2.89Å; E1253-R1257 WeakPolarHBondContact OE1-CD 3.28Å; E1253-R1257 IonicContact OE1-CZ 3.96Å; E1253-R1257 IonicContact OE1-NH1 3.54Å; E1253-R1257 PolarHBondContact OE1-NH1 3.16Å
1254D98.3Very high97.5Very high4 Ų444.5 Ų44.52%0.02123%0.234CC..Hα-helixtrans-66.7-37.9178.7-65-69.6000111.5R1220 H1227 V1246 S1251 R1257 I1258R1220-D1254 IonicContact CZ-OD1 3.01Å; R1220-D1254 IonicContact NH1-OD1 2.75Å; R1220-D1254 PolarHBondContact NH1-OD1 3.15Å; R1220-D1254 IonicContact NH1-OD2 2.71Å; R1220-D1254 PolarHBondContact NH1-OD2 3.27Å; R1220-D1254 IonicContact NH2-OD1 2.88Å; R1220-D1254 PolarHBondContact NH2-OD1 3.47Å; H1227-D1254 IonicContact CD2-OD1 3.74Å; H1227-D1254 PolarHBondContact CE1-O 3.35Å; H1227-D1254 IonicContact CE1-OD1 3.89Å; H1227-D1254 IonicContact NE2-OD1 3.65Å; H1227-D1254 PolarHBondContact NE2-OD1 2.98Å; V1246-D1254 HydrophobicContact CG1-CB 3.91Å; S1251-D1254 PolarHBondContact O-N 3.01Å; S1251-D1254 PolarHBondContact OG-N 2.98Å; S1251-D1254 VanDerWaalsContact OG-N 3.11Å; S1251-D1254 PolarHBondContact OG-OD2 3.24Å; D1254-R1257 PolarHBondContact O-N 3.37Å; D1254-I1258 WeakPolarHBondContact O-CG1 3.47Å; D1254-I1258 PolarHBondContact O-N 2.93Å; D1254-I1258 VanDerWaalsContact O-N 3.1Å
1255K98.4Very high97.2Very high21 Ų2146.9 Ų46.99%0.09124%0.242CC..Hα-helixtrans-60.2-50.9171.7-64-176.1-170-147.90111.1L1247 E1248 G1250 S1251 N1252 R1257 I1258 I1259 N1285L1247-K1255 WeakPolarHBondContact O-CD 3.45Å; L1247-K1255 WeakPolarHBondContact O-CE 3.42Å; L1247-K1255 PolarHBondContact O-NZ 3.2Å; E1248-K1255 PolarHBondContact O-NZ 3.29Å; G1250-K1255 WeakPolarHBondContact O-CE 3.46Å; S1251-K1255 WeakPolarHBondContact O-CG 3.34Å; S1251-K1255 PolarHBondContact O-N 2.59Å; N1252-K1255 PolarHBondContact O-N 3.34Å; K1255-R1257 PolarHBondContact O-N 2.83Å; K1255-I1258 PolarHBondContact O-N 2.95Å; K1255-I1259 WeakPolarHBondContact O-CD1 3.39Å; K1255-I1259 VanDerWaalsContact O-CG1 3.31Å; K1255-I1259 WeakPolarHBondContact O-CG1 3.03Å; K1255-I1259 PolarHBondContact O-N 3.48Å; K1255-N1285 HydrophobicContact CD-CB 4.44Å
1256S98.3Very high97.1Very high28 Ų2846.3 Ų46.320%0.19624%0.239CC..Hα-helixtrans-59.8-41.9177.7-72.90000112.9N1252 E1253 I1258 I1259 Q1260 E1290N1252-S1256 WeakPolarHBondContact O-CB 3.49Å; N1252-S1256 PolarHBondContact O-N 2.91Å; N1252-S1256 PolarHBondContact O-OG 2.85Å; E1253-S1256 PolarHBondContact O-N 3.1Å; S1256-I1258 VanDerWaalsContact C-N 3.35Å; S1256-I1258 PolarHBondContact O-N 3.42Å; S1256-I1259 PolarHBondContact O-N 3.26Å; S1256-Q1260 WeakPolarHBondContact O-CB 3.47Å; S1256-Q1260 WeakPolarHBondContact O-CG 3.29Å; S1256-Q1260 PolarHBondContact O-N 2.84Å; S1256-E1290 VanDerWaalsContact CA-OE1 3.26Å; S1256-E1290 WeakPolarHBondContact CA-OE1 3.2Å; S1256-E1290 WeakPolarHBondContact CB-OE1 3.08Å; S1256-E1290 PolarHBondContact OG-OE1 3.24Å
1257R98.1Very high96.8Very high78 Ų7847.9 Ų47.929%0.29425%0.25SS..Hα-helixtrans-61.5-40.6176.4-75.416664.2169.4-1.3112D1224 H1227 E1253 D1254 K1255 N1261D1224-R1257 IonicContact OD1-CZ 3.54Å; D1224-R1257 IonicContact OD1-NH1 2.74Å; D1224-R1257 PolarHBondContact OD1-NH1 2.89Å; D1224-R1257 IonicContact OD1-NH2 3.02Å; D1224-R1257 PolarHBondContact OD1-NH2 2.87Å; H1227-R1257 PolarHBondContact CD2-NH2 3.24Å; H1227-R1257 VanDerWaalsContact CE1-CB 3.46Å; H1227-R1257 WeakPolarHBondContact CE1-CB 3.34Å; E1253-R1257 WeakPolarHBondContact O-CB 3.47Å; E1253-R1257 VanDerWaalsContact O-CG 3.27Å; E1253-R1257 WeakPolarHBondContact O-CG 3.42Å; E1253-R1257 PolarHBondContact O-N 2.89Å; E1253-R1257 WeakPolarHBondContact OE1-CD 3.28Å; E1253-R1257 IonicContact OE1-CZ 3.96Å; E1253-R1257 IonicContact OE1-NH1 3.54Å; E1253-R1257 PolarHBondContact OE1-NH1 3.16Å; D1254-R1257 PolarHBondContact O-N 3.37Å; K1255-R1257 PolarHBondContact O-N 2.83Å; R1257-N1261 PolarHBondContact O-N 3.34Å
1258I98.6Very high96.7Very high3 Ų351.2 Ų51.22%0.01528%0.278CS..Hα-helixtrans-66-49.9172.8-68.6163.1000110.4V1230 I1243 V1246 L1247 D1254 K1255 S1256 Q1260 N1261 L1262V1230-I1258 HydrophobicContact CG1-CG2 4.33Å; V1230-I1258 HydrophobicContact CG2-CG1 4.32Å; I1243-I1258 HydrophobicContact CG2-CD1 4.01Å; I1243-I1258 HydrophobicContact CG2-CG1 4.37Å; I1243-I1258 HydrophobicContact CG2-CG2 3.62Å; V1246-I1258 HydrophobicContact CB-CD1 3.82Å; V1246-I1258 HydrophobicContact CG1-CD1 3.52Å; L1247-I1258 HydrophobicContact CD1-CG2 4.17Å; L1247-I1258 HydrophobicContact CD2-CB 4.16Å; L1247-I1258 HydrophobicContact CD2-CG2 3.82Å; L1247-I1258 HydrophobicContact CG-CD1 4.41Å; L1247-I1258 HydrophobicContact CG-CG2 4.08Å; D1254-I1258 WeakPolarHBondContact O-CG1 3.47Å; D1254-I1258 PolarHBondContact O-N 2.93Å; D1254-I1258 VanDerWaalsContact O-N 3.1Å; K1255-I1258 PolarHBondContact O-N 2.95Å; S1256-I1258 VanDerWaalsContact C-N 3.35Å; S1256-I1258 PolarHBondContact O-N 3.42Å; I1258-Q1260 VanDerWaalsContact C-N 3.32Å; I1258-Q1260 PolarHBondContact O-N 2.98Å; I1258-N1261 WeakPolarHBondContact O-CA 3.46Å; I1258-N1261 VanDerWaalsContact O-CB 3.27Å; I1258-N1261 WeakPolarHBondContact O-CB 3.48Å; I1258-N1261 PolarHBondContact O-N 3.45Å; I1258-L1262 HydrophobicContact CG2-CD1 4.17Å; I1258-L1262 HydrophobicContact CG2-CG 4.44Å; I1258-L1262 WeakPolarHBondContact O-CG 3.28Å; I1258-L1262 PolarHBondContact O-N 3.42Å; I1258-L1262 VanDerWaalsContact O-N 3.15Å
1259I98.1Very high96.6Very high3 Ų350.4 Ų50.42%0.01527%0.274CS..Hα-helixtrans-60.1-40.9-177.4-70.7160.4000111.7L1247 K1255 S1256 N1261 L1262 R1263 A1282 A1286 E1290 L1294L1247-I1259 HydrophobicContact CD2-CD1 4.45Å; L1247-I1259 HydrophobicContact CD2-CG1 4.17Å; K1255-I1259 WeakPolarHBondContact O-CD1 3.39Å; K1255-I1259 VanDerWaalsContact O-CG1 3.31Å; K1255-I1259 WeakPolarHBondContact O-CG1 3.03Å; K1255-I1259 PolarHBondContact O-N 3.48Å; S1256-I1259 PolarHBondContact O-N 3.26Å; I1259-N1261 PolarHBondContact O-N 3.13Å; I1259-L1262 WeakPolarHBondContact O-CB 3.35Å; I1259-L1262 PolarHBondContact O-N 3.48Å; I1259-R1263 PolarHBondContact O-N 2.86Å; I1259-A1282 HydrophobicContact CG1-CB 4.29Å; I1259-A1286 HydrophobicContact CD1-CB 3.67Å; I1259-E1290 VanDerWaalsContact CD1-OE2 3.31Å; I1259-E1290 WeakPolarHBondContact CD1-OE2 3.37Å; I1259-E1290 HydrophobicContact CG2-CB 4.2Å; I1259-E1290 HydrophobicContact CG2-CG 4.4Å; I1259-L1294 HydrophobicContact CG2-CD1 4.09Å; I1259-L1294 HydrophobicContact CG2-CD2 4.37Å; I1259-L1294 HydrophobicContact CG2-CG 4.34Å
1260Q97.1Very high96.7Very high125 Ų12546.3 Ų46.358%0.58426%0.255SS*.Hα-helixtrans-59.6-33.4173.5-72.617031.500112.5S1256 I1258S1256-Q1260 WeakPolarHBondContact O-CB 3.47Å; S1256-Q1260 WeakPolarHBondContact O-CG 3.29Å; S1256-Q1260 PolarHBondContact O-N 2.84Å; I1258-Q1260 VanDerWaalsContact C-N 3.32Å; I1258-Q1260 PolarHBondContact O-N 2.98Å
1261N96.4Very high96.7Very high55 Ų5547.4 Ų47.429%0.29426%0.26SS..Hα-helixtrans-73.4-25.2174.4-158.8-92.2000113.1V1230 R1257 I1258 I1259 R1265V1230-N1261 HydrophobicContact CB-CB 4.5Å; V1230-N1261 HydrophobicContact CG1-CB 4.07Å; R1257-N1261 PolarHBondContact O-N 3.34Å; I1258-N1261 WeakPolarHBondContact O-CA 3.46Å; I1258-N1261 VanDerWaalsContact O-CB 3.27Å; I1258-N1261 WeakPolarHBondContact O-CB 3.48Å; I1258-N1261 PolarHBondContact O-N 3.45Å; I1259-N1261 PolarHBondContact O-N 3.13Å; N1261-R1265 PolarHBondContact O-NE 3.05Å; N1261-R1265 PolarHBondContact O-NH2 2.95Å; N1261-R1265 PolarHBondContact OD1-NH2 3.38Å
1262L96.9Very high96.8Very high1 Ų148 Ų481%0.00526%0.256CS..Hα-helixtrans-80.2-23.1178.7-61174000113.3V1234 I1258 I1259 R1265 L1269 V1278 M1279 A1282V1234-L1262 HydrophobicContact CG1-CD2 4.23Å; I1258-L1262 HydrophobicContact CG2-CD1 4.17Å; I1258-L1262 HydrophobicContact CG2-CG 4.44Å; I1258-L1262 WeakPolarHBondContact O-CG 3.28Å; I1258-L1262 PolarHBondContact O-N 3.42Å; I1258-L1262 VanDerWaalsContact O-N 3.15Å; I1259-L1262 WeakPolarHBondContact O-CB 3.35Å; I1259-L1262 PolarHBondContact O-N 3.48Å; L1262-R1265 PolarHBondContact O-N 3.22Å; L1262-L1269 HydrophobicContact CB-CD1 4.44Å; L1262-L1269 HydrophobicContact CD2-CD1 3.58Å; L1262-V1278 HydrophobicContact CD1-CG1 4.32Å; L1262-V1278 HydrophobicContact CD2-CG1 4.34Å; L1262-M1279 HydrophobicContact CB-SD 3.96Å; L1262-M1279 HydrophobicContact CD1-CE 4.49Å; L1262-M1279 HydrophobicContact CD1-SD 3.93Å; L1262-M1279 HydrophobicContact CD2-SD 4.1Å; L1262-M1279 HydrophobicContact CG-SD 4.21Å; L1262-A1282 HydrophobicContact CD1-CB 3.55Å
1263R95.4Very high96.8Very high121 Ų12148 Ų4846%0.45725%0.251SS..THydrogen-bonded Turntrans-61.7152.9178.8-70.3-175.967.4179.55.5113.2I1259 R1265 V1293 L1294 E1297I1259-R1263 PolarHBondContact O-N 2.86Å; R1263-R1265 PolarHBondContact O-N 2.89Å; R1263-V1293 HydrophobicContact CG-CG1 4.3Å; R1263-L1294 HydrophobicContact CG-CD2 4.2Å; R1263-E1297 WeakPolarHBondContact CA-OE2 3.34Å
1264G92.7Very high96.9Very high53 Ų5345.4 Ų45.455%0.54624%0.238SC..THydrogen-bonded Turntrans703.5-173.700000114E1297G1264-E1297 VanDerWaalsContact CA-OE1 3.31Å; G1264-E1297 WeakPolarHBondContact CA-OE1 3.37Å; G1264-E1297 PolarHBondContact N-OE1 3.23Å; G1264-E1297 VanDerWaalsContact N-OE1 3.13Å; G1264-E1297 PolarHBondContact N-OE2 3.26Å
1265R94.1Very high96.9Very high70 Ų7045.2 Ų45.226%0.26424%0.237SC..  trans-140.18.1-170.2-56.6-168.5-70.5-167.73.8113.4E1231 N1261 L1262 R1263 C1267 A1268 L1269 E1297E1231-R1265 IonicContact OE1-NH1 3.69Å; E1231-R1265 PolarHBondContact OE1-NH1 3.17Å; E1231-R1265 VanDerWaalsContact OE1-NH1 3.08Å; E1231-R1265 IonicContact OE2-CZ 3.5Å; E1231-R1265 IonicContact OE2-NH1 2.64Å; E1231-R1265 PolarHBondContact OE2-NH1 2.99Å; E1231-R1265 IonicContact OE2-NH2 2.8Å; N1261-R1265 PolarHBondContact O-NE 3.05Å; N1261-R1265 PolarHBondContact O-NH2 2.95Å; N1261-R1265 PolarHBondContact OD1-NH2 3.38Å; L1262-R1265 PolarHBondContact O-N 3.22Å; R1263-R1265 PolarHBondContact O-N 2.89Å; R1265-C1267 VanDerWaalsContact C-N 3.35Å; R1265-C1267 PolarHBondContact O-N 3.38Å; R1265-A1268 PolarHBondContact O-N 2.93Å; R1265-A1268 VanDerWaalsContact O-N 3.09Å; R1265-L1269 HydrophobicContact CB-CD1 3.98Å; R1265-L1269 HydrophobicContact CB-CG 4.13Å; R1265-L1269 WeakPolarHBondContact O-CG 3.22Å; R1265-L1269 PolarHBondContact O-N 3.25Å; R1265-E1297 PolarHBondContact N-OE1 3.02Å
1266V95.2Very high96.9Very high0 Ų044.4 Ų44.40%023%0.234CC..Hα-helixtrans-54.9-47.4-173.4171.10000111.6A1268 S1270 M1279 L1294 E1297 I1298 M1339V1266-A1268 PolarHBondContact O-N 3.43Å; V1266-S1270 WeakPolarHBondContact O-CB 3.45Å; V1266-S1270 PolarHBondContact O-N 3.3Å; V1266-S1270 PolarHBondContact O-OG 3.33Å; V1266-M1279 HydrophobicContact CB-CE 4.48Å; V1266-M1279 HydrophobicContact CG1-CE 4.17Å; V1266-M1279 HydrophobicContact CG2-CE 3.91Å; V1266-L1294 HydrophobicContact CG2-CD2 3.74Å; V1266-E1297 HydrophobicContact CB-CG 4.48Å; V1266-E1297 VanDerWaalsContact CB-OE1 3.3Å; V1266-E1297 WeakPolarHBondContact CB-OE1 3.31Å; V1266-E1297 HydrophobicContact CG2-CG 4.43Å; V1266-E1297 VanDerWaalsContact CG2-OE1 3.27Å; V1266-E1297 WeakPolarHBondContact CG2-OE1 3.22Å; V1266-E1297 PolarHBondContact N-OE1 3.31Å; V1266-I1298 HydrophobicContact CB-CG2 4.24Å; V1266-I1298 HydrophobicContact CG1-CG2 3.63Å; V1266-M1339 HydrophobicContact CG1-CE 3.89Å
1267C94Very high96.9Very high38 Ų3845.8 Ų45.826%0.25724%0.239SC..Hα-helixtrans-62.5-42179-175.90000113R1265 S1271 S1322 M1326R1265-C1267 VanDerWaalsContact C-N 3.35Å; R1265-C1267 PolarHBondContact O-N 3.38Å; C1267-S1271 PolarHBondContact O-N 3Å; C1267-S1271 PolarHBondContact O-OG 3.15Å; C1267-S1322 WeakPolarHBondContact CB-OG 3.5Å; C1267-S1322 PolarHBondContact SG-OG 3.18Å; C1267-M1326 HydrophobicContact CB-CG 4.36Å; C1267-M1326 HydrophobicContact CB-SD 3.97Å
1268A95.1Very high97Very high70 Ų7042.1 Ų42.158%0.57923%0.226SC*.Hα-helixtrans-71.1-40.9-178.300000112.1R1265 V1266R1265-A1268 PolarHBondContact O-N 2.93Å; R1265-A1268 VanDerWaalsContact O-N 3.09Å; V1266-A1268 PolarHBondContact O-N 3.43Å
1269L97.8Very high97Very high8 Ų842 Ų424%0.04223%0.225CC..Hα-helixtrans-74.2-35.8177.6-63.5176.9000111.9V1234 K1235 L1262 R1265 S1271 H1272 A1275 S1276 M1279V1234-L1269 HydrophobicContact CG2-CD2 4.22Å; K1235-L1269 HydrophobicContact CG-CD2 4.4Å; L1262-L1269 HydrophobicContact CB-CD1 4.44Å; L1262-L1269 HydrophobicContact CD2-CD1 3.58Å; R1265-L1269 HydrophobicContact CB-CD1 3.98Å; R1265-L1269 HydrophobicContact CB-CG 4.13Å; R1265-L1269 WeakPolarHBondContact O-CG 3.22Å; R1265-L1269 PolarHBondContact O-N 3.25Å; L1269-S1271 PolarHBondContact O-N 3.3Å; L1269-H1272 PolarHBondContact O-N 3.05Å; L1269-A1275 HydrophobicContact CB-CB 4.02Å; L1269-A1275 HydrophobicContact CD2-CB 3.99Å; L1269-A1275 CarbonylContact O-C 3.59Å; L1269-A1275 VanDerWaalsContact O-C 3.29Å; L1269-A1275 WeakPolarHBondContact O-CB 3.23Å; L1269-S1276 PolarHBondContact O-N 3.26Å; L1269-M1279 HydrophobicContact CB-CG 3.95Å; L1269-M1279 HydrophobicContact CB-SD 4.2Å; L1269-M1279 HydrophobicContact CD1-SD 4.38Å
1270S98.1Very high97Very high0 Ų043.2 Ų43.20%023%0.231CC..Hα-helixtrans-62-32.5174.7-610000112.8V1266 H1272 S1276 Y1331 A1332V1266-S1270 WeakPolarHBondContact O-CB 3.45Å; V1266-S1270 PolarHBondContact O-N 3.3Å; V1266-S1270 PolarHBondContact O-OG 3.33Å; S1270-H1272 PolarHBondContact O-N 3.17Å; S1270-S1276 VanDerWaalsContact O-CB 3.29Å; S1270-S1276 WeakPolarHBondContact O-CB 3.28Å; S1270-Y1331 CarbonylContact O-C 3.23Å; S1270-A1332 WeakPolarHBondContact O-CA 3.5Å; S1270-A1332 WeakPolarHBondContact O-CB 3.5Å; S1270-A1332 PolarHBondContact O-N 3.29Å; S1270-A1332 VanDerWaalsContact O-N 3.14Å
1271S97.1Very high97.1Very high45 Ų4538.8 Ų38.832%0.31521%0.209SC..THydrogen-bonded Turntrans-85.17.7-179.3-48.40000113.2C1267 L1269 D1329C1267-S1271 PolarHBondContact O-N 3Å; C1267-S1271 PolarHBondContact O-OG 3.15Å; L1269-S1271 PolarHBondContact O-N 3.3Å; S1271-D1329 WeakPolarHBondContact CA-OD2 3.21Å
1272H98.3Very high97.2Very high66 Ų6636.2 Ų36.231%0.30620%0.195SC..SBendtrans-112.3126.1-175.7-179.1-102.4000111.5K1235 L1269 S1270 F1274 A1275 S1276K1235-H1272 PolarHBondContact O-CE1 3.5Å; K1235-H1272 VanDerWaalsContact O-CE1 3.3Å; L1269-H1272 PolarHBondContact O-N 3.05Å; S1270-H1272 PolarHBondContact O-N 3.17Å; H1272-F1274 AromaticContact CE1-CD2 3.92Å; H1272-F1274 PolarHBondContact O-N 3.2Å; H1272-A1275 HydrophobicContact CB-CB 4.11Å; H1272-A1275 PolarHBondContact ND1-N 2.91Å; H1272-A1275 PolarHBondContact O-N 3.34Å; H1272-S1276 PolarHBondContact O-N 3.02Å; H1272-S1276 PolarHBondContact O-OG 2.75Å
1273K98.3Very high97.2Very high109 Ų10936.1 Ų36.147%0.47420%0.195SC..THydrogen-bonded Turntrans-43.1-39.4-171.3-179172.9175.560.10115.9S1276 N1277 Y1331K1273-S1276 PolarHBondContact O-OG 2.93Å; K1273-N1277 PolarHBondContact O-ND2 3.22Å; K1273-Y1331 HydrophobicContact CB-CD1 4.42Å; K1273-Y1331 HydrophobicContact CB-CD2 4.4Å; K1273-Y1331 HydrophobicContact CB-CE1 3.88Å; K1273-Y1331 HydrophobicContact CB-CE2 3.85Å; K1273-Y1331 HydrophobicContact CD-CE1 4.46Å; K1273-Y1331 HydrophobicContact CG-CE1 3.77Å
1274F98.5Very high97.3Very high55 Ų5532 Ų3224%0.24119%0.187CC..THydrogen-bonded Turntrans-97.4-34.7-178.8-57.6-60.3000112.7Q1237 N1240 H1272 N1277Q1237-F1274 HydrophobicContact CB-CD1 4.42Å; Q1237-F1274 HydrophobicContact CB-CD2 4.28Å; Q1237-F1274 HydrophobicContact CB-CE1 3.86Å; Q1237-F1274 HydrophobicContact CB-CE2 3.7Å; Q1237-F1274 HydrophobicContact CB-CZ 3.46Å; Q1237-F1274 VanDerWaalsContact CB-CZ 3.46Å; N1240-F1274 HydrophobicContact CB-CB 4.16Å; H1272-F1274 AromaticContact CE1-CD2 3.92Å; H1272-F1274 PolarHBondContact O-N 3.2Å; F1274-N1277 PolarHBondContact O-ND2 2.96Å
1275A98.7Very high97.5Very high0 Ų031.1 Ų31.10%017%0.169CC..Hα-helixtrans-82.4-17.4-175.100000113V1234 L1269 H1272 N1277 V1278 M1279V1234-A1275 HydrophobicContact CB-CB 4.49Å; V1234-A1275 VanDerWaalsContact O-CA 3.28Å; V1234-A1275 WeakPolarHBondContact O-CA 3.48Å; V1234-A1275 VanDerWaalsContact O-CB 3.23Å; V1234-A1275 WeakPolarHBondContact O-CB 3.42Å; V1234-A1275 PolarHBondContact O-N 3.01Å; L1269-A1275 HydrophobicContact CB-CB 4.02Å; L1269-A1275 HydrophobicContact CD2-CB 3.99Å; L1269-A1275 CarbonylContact O-C 3.59Å; L1269-A1275 VanDerWaalsContact O-C 3.29Å; L1269-A1275 WeakPolarHBondContact O-CB 3.23Å; H1272-A1275 HydrophobicContact CB-CB 4.11Å; H1272-A1275 PolarHBondContact ND1-N 2.91Å; H1272-A1275 PolarHBondContact O-N 3.34Å; A1275-N1277 VanDerWaalsContact C-N 3.3Å; A1275-N1277 PolarHBondContact O-N 3.15Å; A1275-V1278 WeakPolarHBondContact O-CB 3.5Å; A1275-V1278 PolarHBondContact O-N 2.95Å; A1275-M1279 WeakPolarHBondContact O-CG 3.37Å; A1275-M1279 PolarHBondContact O-N 3.41Å
1276S98.7Very high97.7Very high4 Ų428.1 Ų28.13%0.02816%0.16CC..Hα-helixtrans-57.7-43.5169.862.40000111.5L1269 S1270 H1272 K1273 M1279 E1280L1269-S1276 PolarHBondContact O-N 3.26Å; S1270-S1276 VanDerWaalsContact O-CB 3.29Å; S1270-S1276 WeakPolarHBondContact O-CB 3.28Å; H1272-S1276 PolarHBondContact O-N 3.02Å; H1272-S1276 PolarHBondContact O-OG 2.75Å; K1273-S1276 PolarHBondContact O-OG 2.93Å; S1276-M1279 PolarHBondContact O-N 3.31Å; S1276-E1280 PolarHBondContact O-N 3.38Å
1277N98.7Very high97.7Very high58 Ų5830.7 Ų30.731%0.3118%0.175SC..Hα-helixtrans-64.9-41.3176.8-41.1-82.9000110.7K1273 F1274 A1275 E1280 K1281K1273-N1277 PolarHBondContact O-ND2 3.22Å; F1274-N1277 PolarHBondContact O-ND2 2.96Å; A1275-N1277 VanDerWaalsContact C-N 3.3Å; A1275-N1277 PolarHBondContact O-N 3.15Å; N1277-E1280 WeakPolarHBondContact O-CB 3.5Å; N1277-E1280 PolarHBondContact O-N 3.11Å; N1277-K1281 WeakPolarHBondContact O-CG 3.35Å; N1277-K1281 PolarHBondContact O-N 2.81Å
1278V98.8Very high97.7Very high1 Ų133.2 Ų33.21%0.00619%0.191CC..Hα-helixtrans-61.3-44.4173.8-176.50000111V1234 N1240 I1243 Q1244 L1247 L1262 A1275 E1280 K1281 A1282V1234-V1278 HydrophobicContact CB-CB 4.41Å; V1234-V1278 HydrophobicContact CB-CG1 4.22Å; V1234-V1278 HydrophobicContact CB-CG2 4.09Å; V1234-V1278 HydrophobicContact CG1-CB 4.43Å; V1234-V1278 HydrophobicContact CG1-CG1 3.74Å; V1234-V1278 HydrophobicContact CG1-CG2 4.26Å; N1240-V1278 HydrophobicContact CB-CG2 3.83Å; I1243-V1278 HydrophobicContact CG2-CG1 3.87Å; Q1244-V1278 HydrophobicContact CG-CG2 4.16Å; L1247-V1278 HydrophobicContact CD1-CG1 3.79Å; L1262-V1278 HydrophobicContact CD1-CG1 4.32Å; L1262-V1278 HydrophobicContact CD2-CG1 4.34Å; A1275-V1278 WeakPolarHBondContact O-CB 3.5Å; A1275-V1278 PolarHBondContact O-N 2.95Å; V1278-E1280 PolarHBondContact O-N 3.32Å; V1278-K1281 PolarHBondContact O-N 3.34Å; V1278-A1282 WeakPolarHBondContact O-CB 3.41Å; V1278-A1282 PolarHBondContact O-N 3.1Å
1279M98.4Very high97.8Very high0 Ų033.9 Ų33.90%019%0.191CC..Hα-helixtrans-62-42.8175.2-72.7-50.9-4300111.7L1262 V1266 L1269 A1275 S1276 K1281 A1282 I1283 L1294 V1335L1262-M1279 HydrophobicContact CB-SD 3.96Å; L1262-M1279 HydrophobicContact CD1-CE 4.49Å; L1262-M1279 HydrophobicContact CD1-SD 3.93Å; L1262-M1279 HydrophobicContact CD2-SD 4.1Å; L1262-M1279 HydrophobicContact CG-SD 4.21Å; V1266-M1279 HydrophobicContact CB-CE 4.48Å; V1266-M1279 HydrophobicContact CG1-CE 4.17Å; V1266-M1279 HydrophobicContact CG2-CE 3.91Å; L1269-M1279 HydrophobicContact CB-CG 3.95Å; L1269-M1279 HydrophobicContact CB-SD 4.2Å; L1269-M1279 HydrophobicContact CD1-SD 4.38Å; A1275-M1279 WeakPolarHBondContact O-CG 3.37Å; A1275-M1279 PolarHBondContact O-N 3.41Å; S1276-M1279 PolarHBondContact O-N 3.31Å; M1279-K1281 PolarHBondContact O-N 3.47Å; M1279-A1282 PolarHBondContact O-N 3.5Å; M1279-I1283 HydrophobicContact CE-CD1 4.38Å; M1279-I1283 HydrophobicContact CE-CG1 4.49Å; M1279-I1283 WeakPolarHBondContact O-CB 3.48Å; M1279-I1283 VanDerWaalsContact O-CD1 3.28Å; M1279-I1283 WeakPolarHBondContact O-CD1 3.37Å; M1279-I1283 VanDerWaalsContact O-CG1 3.22Å; M1279-I1283 WeakPolarHBondContact O-CG1 3.44Å; M1279-I1283 PolarHBondContact O-N 2.93Å; M1279-L1294 HydrophobicContact CE-CD1 4.34Å; M1279-L1294 HydrophobicContact CE-CD2 4.22Å; M1279-V1335 HydrophobicContact CB-CG1 4.02Å; M1279-V1335 HydrophobicContact CB-CG2 4.31Å
1280E98.5Very high97.7Very high29 Ų2934.9 Ų34.914%0.13620%0.196CC..Hα-helixtrans-59-41174.5-89.8-172.2-117.900113.2S1276 N1277 V1278 A1284 Y1334 V1335 R1338S1276-E1280 PolarHBondContact O-N 3.38Å; N1277-E1280 WeakPolarHBondContact O-CB 3.5Å; N1277-E1280 PolarHBondContact O-N 3.11Å; V1278-E1280 PolarHBondContact O-N 3.32Å; E1280-A1284 VanDerWaalsContact O-CB 3.3Å; E1280-A1284 WeakPolarHBondContact O-CB 3.5Å; E1280-A1284 PolarHBondContact O-N 3.09Å; E1280-A1284 VanDerWaalsContact O-N 3.15Å; E1280-Y1334 VanDerWaalsContact OE1-CB 3.28Å; E1280-Y1334 WeakPolarHBondContact OE1-CB 3.3Å; E1280-V1335 HydrophobicContact CG-CG2 4.29Å; E1280-R1338 HydrophobicContact CG-CB 4.02Å; E1280-R1338 HydrophobicContact CG-CG 4.27Å; E1280-R1338 IonicContact OE2-CZ 3.99Å; E1280-R1338 IonicContact OE2-NH1 2.67Å; E1280-R1338 PolarHBondContact OE2-NH1 3.36Å; E1280-R1338 IonicContact OE2-NH2 2.96Å; E1280-R1338 PolarHBondContact OE2-NH2 2.97Å
1281K98.4Very high97.6Very high32 Ų3237.3 Ų37.314%0.13921%0.205CC..Hα-helixtrans-72.8-36.3174.4-62.9-55.5-170161.10112.4Q1244 L1247 E1248 N1277 V1278 M1279 A1284 N1285Q1244-K1281 HydrophobicContact CB-CG 3.98Å; Q1244-K1281 HydrophobicContact CG-CB 4.23Å; Q1244-K1281 HydrophobicContact CG-CG 3.6Å; Q1244-K1281 VanDerWaalsContact OE1-CG 3.24Å; L1247-K1281 HydrophobicContact CB-CB 4.33Å; L1247-K1281 HydrophobicContact CD1-CB 4.21Å; E1248-K1281 HydrophobicContact CG-CD 4.33Å; E1248-K1281 VanDerWaalsContact OE1-CD 3.29Å; E1248-K1281 WeakPolarHBondContact OE1-CD 3.46Å; E1248-K1281 WeakPolarHBondContact OE1-CE 3.47Å; E1248-K1281 IonicContact OE1-NZ 3.52Å; E1248-K1281 PolarHBondContact OE1-NZ 3.22Å; E1248-K1281 IonicContact OE2-NZ 3.72Å; N1277-K1281 WeakPolarHBondContact O-CG 3.35Å; N1277-K1281 PolarHBondContact O-N 2.81Å; V1278-K1281 PolarHBondContact O-N 3.34Å; M1279-K1281 PolarHBondContact O-N 3.47Å; K1281-A1284 PolarHBondContact O-N 3.29Å; K1281-N1285 WeakPolarHBondContact O-CB 3.3Å; K1281-N1285 PolarHBondContact O-N 3.34Å; K1281-N1285 PolarHBondContact O-ND2 2.97Å
1282A98.5Very high97.5Very high0 Ų035.9 Ų35.90%020%0.196CC..Hα-helixtrans-62.7-48.9175.800000110.7L1247 I1259 L1262 V1278 M1279 A1284 N1285 A1286 L1294L1247-A1282 HydrophobicContact CD1-CB 4.06Å; L1247-A1282 HydrophobicContact CD2-CB 4.37Å; I1259-A1282 HydrophobicContact CG1-CB 4.29Å; L1262-A1282 HydrophobicContact CD1-CB 3.55Å; V1278-A1282 WeakPolarHBondContact O-CB 3.41Å; V1278-A1282 PolarHBondContact O-N 3.1Å; M1279-A1282 PolarHBondContact O-N 3.5Å; A1282-A1284 PolarHBondContact O-N 3Å; A1282-N1285 PolarHBondContact O-N 3.01Å; A1282-A1286 WeakPolarHBondContact O-CB 3.46Å; A1282-A1286 PolarHBondContact O-N 3.27Å; A1282-L1294 HydrophobicContact CB-CD1 4.43Å
1283I97.8Very high97.3Very high0 Ų034.6 Ų34.60%019%0.193CC..Hα-helixtrans-63.7-29176.4-64.2156.9000111.6M1279 R1291 L1294 V1335 R1338 M1339M1279-I1283 HydrophobicContact CE-CD1 4.38Å; M1279-I1283 HydrophobicContact CE-CG1 4.49Å; M1279-I1283 WeakPolarHBondContact O-CB 3.48Å; M1279-I1283 VanDerWaalsContact O-CD1 3.28Å; M1279-I1283 WeakPolarHBondContact O-CD1 3.37Å; M1279-I1283 VanDerWaalsContact O-CG1 3.22Å; M1279-I1283 WeakPolarHBondContact O-CG1 3.44Å; M1279-I1283 PolarHBondContact O-N 2.93Å; I1283-R1291 HydrophobicContact CG2-CG 4.3Å; I1283-R1291 VanDerWaalsContact O-CD 3.25Å; I1283-R1291 WeakPolarHBondContact O-CD 3.38Å; I1283-L1294 HydrophobicContact CG1-CD1 4.18Å; I1283-V1335 HydrophobicContact CD1-CG1 3.48Å; I1283-V1335 VanDerWaalsContact CD1-CG1 3.48Å; I1283-R1338 HydrophobicContact CG2-CG 4.22Å; I1283-M1339 HydrophobicContact CD1-CE 3.56Å; I1283-M1339 HydrophobicContact CD1-CG 3.82Å; I1283-M1339 HydrophobicContact CD1-SD 4.49Å; I1283-M1339 HydrophobicContact CG1-CE 4.36Å; I1283-M1339 HydrophobicContact CG2-CG 4.31Å
1284A97.9Very high97.1Very high34 Ų3429.4 Ų29.428%0.28117%0.17SC..Hα-helixtrans-76.9-31.8176.300000114.8E1280 K1281 A1282 L1342E1280-A1284 VanDerWaalsContact O-CB 3.3Å; E1280-A1284 WeakPolarHBondContact O-CB 3.5Å; E1280-A1284 PolarHBondContact O-N 3.09Å; E1280-A1284 VanDerWaalsContact O-N 3.15Å; K1281-A1284 PolarHBondContact O-N 3.29Å; A1282-A1284 PolarHBondContact O-N 3Å; A1284-L1342 HydrophobicContact CB-CD1 3.9Å
1285N97.6Very high96.9Very high34 Ų3426.8 Ų26.818%0.18216%0.159CC..Hα-helixtrans-114.2-6.2-172.2-66.5-88.3000114.6L1247 K1255 K1281 A1282L1247-N1285 WeakPolarHBondContact O-CB 3.16Å; L1247-N1285 PolarHBondContact O-OD1 3.1Å; K1255-N1285 HydrophobicContact CD-CB 4.44Å; K1281-N1285 WeakPolarHBondContact O-CB 3.3Å; K1281-N1285 PolarHBondContact O-N 3.34Å; K1281-N1285 PolarHBondContact O-ND2 2.97Å; A1282-N1285 PolarHBondContact O-N 3.01Å
1286A97Very high96.5Very high7 Ų731.7 Ų31.76%0.05818%0.181CC..SBendtrans-62.1144.5172.100000111.6I1259 A1282 E1290 R1291I1259-A1286 HydrophobicContact CD1-CB 3.67Å; A1282-A1286 WeakPolarHBondContact O-CB 3.46Å; A1282-A1286 PolarHBondContact O-N 3.27Å; A1286-E1290 HydrophobicContact CB-CB 3.85Å; A1286-R1291 HydrophobicContact CB-CB 4.12Å
1287V95.4Very high96.1Very high55 Ų5532.5 Ų32.533%0.33319%0.185SC..  trans-65.8157.4168.9-61.10000110.1S1289 E1290 R1291V1287-S1289 VanDerWaalsContact C-N 3.26Å; V1287-S1289 PolarHBondContact O-N 3.22Å; V1287-S1289 VanDerWaalsContact O-N 3.07Å; V1287-E1290 HydrophobicContact CG2-CB 4.08Å; V1287-E1290 HydrophobicContact CG2-CG 3.72Å; V1287-E1290 PolarHBondContact N-OE2 3.18Å; V1287-E1290 WeakPolarHBondContact O-CB 3.33Å; V1287-E1290 PolarHBondContact O-N 2.85Å; V1287-R1291 PolarHBondContact O-N 2.92Å
1288P95.1Very high95.6Very high91 Ų9129.8 Ų29.859%0.59117%0.17SC*.Hα-helixtrans-54.3-35.1-170.8-30.436.9000115.7A1292P1288-A1292 WeakPolarHBondContact O-CB 3.38Å; P1288-A1292 PolarHBondContact O-N 2.94Å
1289S95.4Very high94.8Very high83 Ų8330.1 Ų30.158%0.5817%0.172SC*.Hα-helixtrans-70-38.8175.948.10000113.4V1287 A1292 V1293V1287-S1289 VanDerWaalsContact C-N 3.26Å; V1287-S1289 PolarHBondContact O-N 3.22Å; V1287-S1289 VanDerWaalsContact O-N 3.07Å; S1289-A1292 WeakPolarHBondContact O-CB 3.33Å; S1289-V1293 WeakPolarHBondContact O-CG2 3.14Å; S1289-V1293 PolarHBondContact O-N 3.07Å
1290E96.5Very high93.6Very high29 Ų2934.8 Ų34.814%0.13619%0.194CC..Hα-helixtrans-68.8-41173.6-72.7-179.8148.800111.4S1256 I1259 A1286 V1287 A1292 V1293 L1294S1256-E1290 VanDerWaalsContact CA-OE1 3.26Å; S1256-E1290 WeakPolarHBondContact CA-OE1 3.2Å; S1256-E1290 WeakPolarHBondContact CB-OE1 3.08Å; S1256-E1290 PolarHBondContact OG-OE1 3.24Å; I1259-E1290 VanDerWaalsContact CD1-OE2 3.31Å; I1259-E1290 WeakPolarHBondContact CD1-OE2 3.37Å; I1259-E1290 HydrophobicContact CG2-CB 4.2Å; I1259-E1290 HydrophobicContact CG2-CG 4.4Å; A1286-E1290 HydrophobicContact CB-CB 3.85Å; V1287-E1290 HydrophobicContact CG2-CB 4.08Å; V1287-E1290 HydrophobicContact CG2-CG 3.72Å; V1287-E1290 PolarHBondContact N-OE2 3.18Å; V1287-E1290 WeakPolarHBondContact O-CB 3.33Å; V1287-E1290 PolarHBondContact O-N 2.85Å; E1290-A1292 VanDerWaalsContact C-N 3.35Å; E1290-V1293 WeakPolarHBondContact O-CB 3.39Å; E1290-V1293 PolarHBondContact O-N 2.88Å; E1290-L1294 WeakPolarHBondContact O-CG 3.4Å; E1290-L1294 PolarHBondContact O-N 3.23Å
1291R96.1Very high91.7Very high52 Ų5235 Ų3520%0.19620%0.198CC..Hα-helixtrans-63.2-40.6175.4-173170.567.2-1483.4111.9I1283 A1286 V1287 L1294 I1295 L1342I1283-R1291 HydrophobicContact CG2-CG 4.3Å; I1283-R1291 VanDerWaalsContact O-CD 3.25Å; I1283-R1291 WeakPolarHBondContact O-CD 3.38Å; A1286-R1291 HydrophobicContact CB-CB 4.12Å; V1287-R1291 PolarHBondContact O-N 2.92Å; R1291-L1294 PolarHBondContact O-N 3.35Å; R1291-I1295 HydrophobicContact CG-CD1 3.95Å; R1291-I1295 WeakPolarHBondContact O-CG1 3.35Å; R1291-I1295 PolarHBondContact O-N 3Å; R1291-I1295 VanDerWaalsContact O-N 3.13Å; R1291-L1342 PolarHBondContact NE-O 3.47Å; R1291-L1342 PolarHBondContact NH2-O 3.32Å
1292A94.2Very high89.5Confident15 Ų1538.7 Ų38.712%0.12422%0.218CC..Hα-helixtrans-55.3-53.4172.600000110.9P1288 S1289 E1290 L1294 I1295 E1296 Q1347P1288-A1292 WeakPolarHBondContact O-CB 3.38Å; P1288-A1292 PolarHBondContact O-N 2.94Å; S1289-A1292 WeakPolarHBondContact O-CB 3.33Å; E1290-A1292 VanDerWaalsContact C-N 3.35Å; A1292-L1294 VanDerWaalsContact C-N 3.35Å; A1292-L1294 PolarHBondContact O-N 3.17Å; A1292-I1295 PolarHBondContact O-N 2.8Å; A1292-E1296 WeakPolarHBondContact O-CB 3.49Å; A1292-E1296 WeakPolarHBondContact O-CG 3.27Å; A1292-E1296 PolarHBondContact O-N 3.38Å; A1292-Q1347 VanDerWaalsContact CA-NE2 3.28Å
1293V94.2Very high86.9Confident38 Ų3841.7 Ų41.723%0.2324%0.239CC..Hα-helixtrans-57.1-41.5179160.90000113.1R1263 S1289 E1290 I1295 E1297R1263-V1293 HydrophobicContact CG-CG1 4.3Å; S1289-V1293 WeakPolarHBondContact O-CG2 3.14Å; S1289-V1293 PolarHBondContact O-N 3.07Å; E1290-V1293 WeakPolarHBondContact O-CB 3.39Å; E1290-V1293 PolarHBondContact O-N 2.88Å; V1293-I1295 VanDerWaalsContact C-N 3.32Å; V1293-I1295 PolarHBondContact O-N 2.96Å; V1293-E1297 PolarHBondContact O-N 3.22Å
1294L95.4Very high84.3Confident0 Ų049 Ų490%028%0.278CS..Hα-helixtrans-68.6-28.4177-68.6177.4000113.3I1259 R1263 V1266 M1279 A1282 I1283 E1290 R1291 A1292 M1339I1259-L1294 HydrophobicContact CG2-CD1 4.09Å; I1259-L1294 HydrophobicContact CG2-CD2 4.37Å; I1259-L1294 HydrophobicContact CG2-CG 4.34Å; R1263-L1294 HydrophobicContact CG-CD2 4.2Å; V1266-L1294 HydrophobicContact CG2-CD2 3.74Å; M1279-L1294 HydrophobicContact CE-CD1 4.34Å; M1279-L1294 HydrophobicContact CE-CD2 4.22Å; A1282-L1294 HydrophobicContact CB-CD1 4.43Å; I1283-L1294 HydrophobicContact CG1-CD1 4.18Å; E1290-L1294 WeakPolarHBondContact O-CG 3.4Å; E1290-L1294 PolarHBondContact O-N 3.23Å; R1291-L1294 PolarHBondContact O-N 3.35Å; A1292-L1294 VanDerWaalsContact C-N 3.35Å; A1292-L1294 PolarHBondContact O-N 3.17Å; L1294-M1339 WeakPolarHBondContact O-CE 3.34Å
1295I93.6Very high81.6Confident0 Ų052.9 Ų52.90%030%0.298CS..Hα-helixtrans-82.5-40176.4-69.1167.1000110.6R1291 A1292 V1293 E1297 I1298 L1299 M1339 A1343 L1351R1291-I1295 HydrophobicContact CG-CD1 3.95Å; R1291-I1295 WeakPolarHBondContact O-CG1 3.35Å; R1291-I1295 PolarHBondContact O-N 3Å; R1291-I1295 VanDerWaalsContact O-N 3.13Å; A1292-I1295 PolarHBondContact O-N 2.8Å; V1293-I1295 VanDerWaalsContact C-N 3.32Å; V1293-I1295 PolarHBondContact O-N 2.96Å; I1295-E1297 VanDerWaalsContact C-N 3.29Å; I1295-E1297 PolarHBondContact O-N 3.13Å; I1295-I1298 WeakPolarHBondContact O-CG1 3.44Å; I1295-I1298 PolarHBondContact O-N 2.92Å; I1295-L1299 HydrophobicContact CG2-CD1 3.83Å; I1295-L1299 HydrophobicContact CG2-CG 4.4Å; I1295-L1299 WeakPolarHBondContact O-CG 3.45Å; I1295-L1299 PolarHBondContact O-N 3.33Å; I1295-M1339 HydrophobicContact CG1-CB 4.32Å; I1295-M1339 HydrophobicContact CG1-CE 4.36Å; I1295-M1339 HydrophobicContact CG1-CG 3.98Å; I1295-M1339 HydrophobicContact CG1-SD 4.16Å; I1295-A1343 HydrophobicContact CD1-CB 4.05Å; I1295-L1351 HydrophobicContact CG2-CD1 3.9Å; I1295-L1351 HydrophobicContact CG2-CD2 4.32Å; I1295-L1351 HydrophobicContact CG2-CG 4.16Å
1296E90.6Very high78.9Confident103 Ų10356.9 Ų56.948%0.48132%0.319SS..Hα-helixtrans-60.3-37.7177.2-77170.2-165.100112.3A1292 I1298 L1299 H1300A1292-E1296 WeakPolarHBondContact O-CB 3.49Å; A1292-E1296 WeakPolarHBondContact O-CG 3.27Å; A1292-E1296 PolarHBondContact O-N 3.38Å; E1296-I1298 PolarHBondContact O-N 3.43Å; E1296-I1298 VanDerWaalsContact O-N 3.16Å; E1296-L1299 PolarHBondContact O-N 3.23Å; E1296-H1300 PolarHBondContact O-N 2.99Å
1297E90.3Very high76.9Confident21 Ų2160.8 Ų60.810%0.09834%0.338CS..Hα-helixtrans-56.8-29.4177.9-171.4175.9130.900113.5R1263 G1264 R1265 V1266 V1293 I1295 H1300 P1301R1263-E1297 WeakPolarHBondContact CA-OE2 3.34Å; G1264-E1297 VanDerWaalsContact CA-OE1 3.31Å; G1264-E1297 WeakPolarHBondContact CA-OE1 3.37Å; G1264-E1297 PolarHBondContact N-OE1 3.23Å; G1264-E1297 VanDerWaalsContact N-OE1 3.13Å; G1264-E1297 PolarHBondContact N-OE2 3.26Å; R1265-E1297 PolarHBondContact N-OE1 3.02Å; V1266-E1297 HydrophobicContact CB-CG 4.48Å; V1266-E1297 VanDerWaalsContact CB-OE1 3.3Å; V1266-E1297 WeakPolarHBondContact CB-OE1 3.31Å; V1266-E1297 HydrophobicContact CG2-CG 4.43Å; V1266-E1297 VanDerWaalsContact CG2-OE1 3.27Å; V1266-E1297 WeakPolarHBondContact CG2-OE1 3.22Å; V1266-E1297 PolarHBondContact N-OE1 3.31Å; V1293-E1297 PolarHBondContact O-N 3.22Å; I1295-E1297 VanDerWaalsContact C-N 3.29Å; I1295-E1297 PolarHBondContact O-N 3.13Å; E1297-H1300 CarbonylContact O-C 3.57Å; E1297-P1301 WeakPolarHBondContact O-CA 3.34Å
1298I87.3Confident74.6Confident1 Ų164.6 Ų64.61%0.00536%0.357CS..Hα-helixtrans-96.8-16.2177.269.5154000113.6V1266 I1295 E1296 L1323 M1326 M1339 L1351V1266-I1298 HydrophobicContact CB-CG2 4.24Å; V1266-I1298 HydrophobicContact CG1-CG2 3.63Å; I1295-I1298 WeakPolarHBondContact O-CG1 3.44Å; I1295-I1298 PolarHBondContact O-N 2.92Å; E1296-I1298 PolarHBondContact O-N 3.43Å; E1296-I1298 VanDerWaalsContact O-N 3.16Å; I1298-L1323 HydrophobicContact CD1-CD1 4.11Å; I1298-M1326 HydrophobicContact CB-SD 4.23Å; I1298-M1326 HydrophobicContact CD1-CE 4.23Å; I1298-M1326 HydrophobicContact CD1-SD 4.41Å; I1298-M1326 HydrophobicContact CG2-CE 4.13Å; I1298-M1326 HydrophobicContact CG2-SD 3.63Å; I1298-M1339 HydrophobicContact CD1-CE 4.12Å; I1298-M1339 HydrophobicContact CD1-SD 3.3Å; I1298-M1339 WeakPolarHBondContact CD1-SD 3.31Å; I1298-M1339 HydrophobicContact CG1-CE 4.34Å; I1298-M1339 HydrophobicContact CG1-SD 3.98Å; I1298-L1351 HydrophobicContact CD1-CD2 4.42Å
1299L82.7Confident72Confident8 Ų863 Ų634%0.04236%0.356CS..Hα-helixtrans-82-33.1173.2-69.5172.7000111.7I1295 E1296 I1319 V1350 L1351 R1354I1295-L1299 HydrophobicContact CG2-CD1 3.83Å; I1295-L1299 HydrophobicContact CG2-CG 4.4Å; I1295-L1299 WeakPolarHBondContact O-CG 3.45Å; I1295-L1299 PolarHBondContact O-N 3.33Å; E1296-L1299 PolarHBondContact O-N 3.23Å; L1299-I1319 WeakPolarHBondContact O-CG2 3.33Å; L1299-V1350 HydrophobicContact CD1-CB 4.47Å; L1299-V1350 HydrophobicContact CD1-CG1 3.81Å; L1299-V1350 HydrophobicContact CD2-CG1 4.01Å; L1299-V1350 HydrophobicContact CG-CG1 4.49Å; L1299-L1351 HydrophobicContact CD2-CD2 3.82Å; L1299-L1351 HydrophobicContact CD2-CG 4.23Å; L1299-L1351 HydrophobicContact CG-CD2 4.33Å; L1299-R1354 HydrophobicContact CD2-CB 4.42Å; L1299-R1354 HydrophobicContact CD2-CG 3.76Å
1300H73.7Confident69.7Low98 Ų9865 Ų6545%0.45436%0.361SS..SBendtrans-139.579.3177.6-51.3109.9000108E1296 E1297 I1302 R1354E1296-H1300 PolarHBondContact O-N 2.99Å; E1297-H1300 CarbonylContact O-C 3.57Å; H1300-I1302 PolarHBondContact O-N 3.44Å; H1300-I1302 VanDerWaalsContact O-N 3.12Å; H1300-R1354 PolarHBondContact CD2-NH2 3.14Å; H1300-R1354 VanDerWaalsContact CD2-NH2 3.33Å; H1300-R1354 PolarHBondContact NE2-NH2 3.08Å
1301P58.1Low67.4Low35 Ų3570.6 Ų70.623%0.22740%0.397CS..  trans-46.8123.8172.6-29.837.5000109.9E1297 S1303E1297-P1301 WeakPolarHBondContact O-CA 3.34Å; P1301-S1303 PolarHBondContact O-N 2.9Å
1302I52.5Low64.8Low108 Ų10872.6 Ų72.655%0.55442%0.419SS*.  trans-53.6110.6-177.5-61.3172.4000106.4H1300 N1304H1300-I1302 PolarHBondContact O-N 3.44Å; H1300-I1302 VanDerWaalsContact O-N 3.12Å; I1302-N1304 PolarHBondContact O-N 3.44Å; I1302-N1304 VanDerWaalsContact O-N 3.11Å
1303S44.3Very low62.4Low64 Ų6476.3 Ų76.345%0.44844%0.444SS..  trans-55.8121.9172.8510000107.1P1301 V1305P1301-S1303 PolarHBondContact O-N 2.9Å; S1303-V1305 VanDerWaalsContact C-N 3.29Å; S1303-V1305 PolarHBondContact O-N 3.15Å
1304N42.4Very low60Low153 Ų15379.1 Ų79.182%0.81846%0.461SS*.  trans-56.7101.8167.2-81.7-4.3000106.7I1302 N1306I1302-N1304 PolarHBondContact O-N 3.44Å; I1302-N1304 VanDerWaalsContact O-N 3.11Å; N1304-N1306 PolarHBondContact O-N 3.06Å
1305V41.8Very low57.5Low115 Ų11582.4 Ų82.470%0.69748%0.481SS*.  trans-70.488.1174.7-179.70000105.6S1303 I1307S1303-V1305 VanDerWaalsContact C-N 3.29Å; S1303-V1305 PolarHBondContact O-N 3.15Å; V1305-I1307 PolarHBondContact O-N 3.31Å; V1305-I1307 VanDerWaalsContact O-N 3.12Å
1306N39.3Very low55.2Low119 Ų11987.5 Ų87.564%0.63651%0.513SS*.  trans-53.1121.6164.4-104.3-1.9000106.3N1304 N1308 G1309N1304-N1306 PolarHBondContact O-N 3.06Å; N1306-N1308 PolarHBondContact O-N 2.82Å; N1306-G1309 PolarHBondContact O-N 3.09Å
1307I56Low53.3Low88 Ų8888.2 Ų88.245%0.45152%0.52SS..THydrogen-bonded Turntrans-60.8-13.1-166.8-62.7118.9000112.7Q542 V1305 G1309Q542-I1307 HydrophobicContact CB-CG2 3.86Å; Q542-I1307 HydrophobicContact CG-CG1 4.2Å; Q542-I1307 HydrophobicContact CG-CG2 3.99Å; Q542-I1307 VanDerWaalsContact OE1-CD1 3.27Å; V1305-I1307 PolarHBondContact O-N 3.31Å; V1305-I1307 VanDerWaalsContact O-N 3.12Å; I1307-G1309 VanDerWaalsContact C-N 3.31Å; I1307-G1309 PolarHBondContact O-N 3.03Å
1308N46.2Very low51.4Low136 Ų13692.5 Ų92.573%0.72754%0.543SS*.THydrogen-bonded Turntrans-82.10.8-177.1-51.2-3000113.7N1306 D1310N1306-N1308 PolarHBondContact O-N 2.82Å; N1308-D1310 PolarHBondContact O-N 2.82Å
1309G41.9Very low49.7Very low56 Ų5694.5 Ų94.558%0.57755%0.554SS**  trans75.3-11.3171.100000116.9N1306 I1307 T1311N1306-G1309 PolarHBondContact O-N 3.09Å; I1307-G1309 VanDerWaalsContact C-N 3.31Å; I1307-G1309 PolarHBondContact O-N 3.03Å; G1309-T1311 PolarHBondContact O-N 3.14Å; G1309-T1311 PolarHBondContact O-OG1 3.41Å
1310D46Very low48.4Very low127 Ų12796.5 Ų96.568%0.67957%0.568SS**  trans-57.1106.8177.9-90.2-23.9000112.1N1308 S1312N1308-D1310 PolarHBondContact O-N 2.82Å; D1310-S1312 PolarHBondContact O-N 3.4Å
1311T48.1Very low48.4Very low146 Ų14693.2 Ų93.290%0.89656%0.556SS**  trans-79.747.2175.5-490000110.5G1309 S1313G1309-T1311 PolarHBondContact O-N 3.14Å; G1309-T1311 PolarHBondContact O-OG1 3.41Å; T1311-S1313 PolarHBondContact O-N 2.67Å
1312S42.6Very low49.6Very low94 Ų9492.4 Ų92.466%0.65755%0.552SS**  trans-79.377.1-169.7-75.10000112.2D1310D1310-S1312 PolarHBondContact O-N 3.4Å
1313S43.5Very low51.3Low93 Ų9387.6 Ų87.665%0.6553%0.527SS*.  trans5075.4165.4-168.40000114.8T1311 T1315T1311-S1313 PolarHBondContact O-N 2.67Å; S1313-T1315 PolarHBondContact O-N 2.71Å
1314V44.2Very low53.4Low97 Ų9785.6 Ų85.659%0.58851%0.512SS*.  trans-63.491.4156.6179.50000107.4T1316 I1319V1314-T1316 PolarHBondContact O-N 2.89Å; V1314-I1319 HydrophobicContact CG1-CD1 4.27Å; V1314-I1319 HydrophobicContact CG1-CG1 4.37Å
1315T41.7Very low55.7Low69 Ų6981.8 Ų81.842%0.42349%0.492SS..  trans-59.6127.9175.851.20000109.1S1313 N1317 N1318S1313-T1315 PolarHBondContact O-N 2.71Å; T1315-N1317 PolarHBondContact O-N 3.32Å; T1315-N1318 PolarHBondContact O-N 2.88Å
1316T46.9Very low58.2Low107 Ų10776.3 Ų76.366%0.65646%0.458SS*.THydrogen-bonded Turntrans-56.5-19.6-178.441.80000113.5V1314 N1318 I1319 S1320V1314-T1316 PolarHBondContact O-N 2.89Å; T1316-N1318 VanDerWaalsContact C-N 3.27Å; T1316-N1318 PolarHBondContact O-N 3Å; T1316-I1319 PolarHBondContact O-N 3.14Å; T1316-S1320 PolarHBondContact O-N 3.4Å; T1316-S1320 PolarHBondContact O-OG 3.39Å; T1316-S1320 VanDerWaalsContact O-OG 3.04Å
1317N49.3Very low60.8Low118 Ų11870.7 Ų70.763%0.63143%0.428SS*.Hα-helixtrans-47.1-44.5165.2-58.7-18.1000112.9T1315 S1320 S1321T1315-N1317 PolarHBondContact O-N 3.32Å; N1317-S1320 PolarHBondContact O-N 2.81Å; N1317-S1321 PolarHBondContact O-N 2.63Å
1318N51.7Low62.6Low111 Ų11169.2 Ų69.259%0.59442%0.418SS*.Hα-helixtrans-89.8-9.3-170.4-147.932000114.7T1315 T1316 S1321T1315-N1318 PolarHBondContact O-N 2.88Å; T1316-N1318 VanDerWaalsContact C-N 3.27Å; T1316-N1318 PolarHBondContact O-N 3Å; N1318-S1321 WeakPolarHBondContact CA-OG 3.48Å; N1318-S1321 PolarHBondContact O-OG 2.9Å; N1318-S1321 PolarHBondContact OD1-OG 2.87Å
1319I50.5Low64.9Low43 Ų4364.2 Ų64.222%0.22139%0.392CS..Hα-helixtrans-79.6-36.5163.6-71.3174.4000109.4L1299 V1314 T1316L1299-I1319 WeakPolarHBondContact O-CG2 3.33Å; V1314-I1319 HydrophobicContact CG1-CD1 4.27Å; V1314-I1319 HydrophobicContact CG1-CG1 4.37Å; T1316-I1319 PolarHBondContact O-N 3.14Å
1320S56.7Low67.6Low49 Ų4965.6 Ų65.634%0.34338%0.383SS..Hα-helixtrans-69.7-40.9177.1-51.60000111.6T1316 N1317 S1322 L1323 V1324T1316-S1320 PolarHBondContact O-N 3.4Å; T1316-S1320 PolarHBondContact O-OG 3.39Å; T1316-S1320 VanDerWaalsContact O-OG 3.04Å; N1317-S1320 PolarHBondContact O-N 2.81Å; S1320-S1322 PolarHBondContact O-N 3.3Å; S1320-L1323 PolarHBondContact O-N 3.32Å; S1320-V1324 WeakPolarHBondContact O-CB 3.4Å; S1320-V1324 WeakPolarHBondContact O-CG2 3.45Å; S1320-V1324 PolarHBondContact O-N 3.24Å
1321S71.9Confident70Confident29 Ų2962.2 Ų62.220%0.20336%0.361CS..Hα-helixtrans-51.4-49.1-174.857.70000114N1317 N1318 L1323 V1324 D1325N1317-S1321 PolarHBondContact O-N 2.63Å; N1318-S1321 WeakPolarHBondContact CA-OG 3.48Å; N1318-S1321 PolarHBondContact O-OG 2.9Å; N1318-S1321 PolarHBondContact OD1-OG 2.87Å; S1321-L1323 PolarHBondContact O-N 3.26Å; S1321-V1324 CarbonylContact O-C 3.59Å; S1321-V1324 WeakPolarHBondContact O-CB 3.21Å; S1321-V1324 PolarHBondContact O-N 2.76Å; S1321-D1325 WeakPolarHBondContact O-CB 3.41Å; S1321-D1325 PolarHBondContact O-N 3.13Å
1322S84.2Confident72.4Confident19 Ų1955.3 Ų55.313%0.13332%0.319CS..Hα-helixtrans-57.1-52.9-176.9-178.50000112.9C1267 S1320 D1325 M1326C1267-S1322 WeakPolarHBondContact CB-OG 3.5Å; C1267-S1322 PolarHBondContact SG-OG 3.18Å; S1320-S1322 PolarHBondContact O-N 3.3Å; S1322-D1325 PolarHBondContact O-N 2.93Å; S1322-M1326 WeakPolarHBondContact O-CG 3.3Å; S1322-M1326 PolarHBondContact O-N 3.46Å
1323L88.7Confident75Confident6 Ų650.8 Ų50.83%0.03129%0.287CS..Hα-helixtrans-66.4-40.3175.7169.457.9000111.7I1298 S1320 S1321 D1325 M1327 V1336 R1354 I1355I1298-L1323 HydrophobicContact CD1-CD1 4.11Å; S1320-L1323 PolarHBondContact O-N 3.32Å; S1321-L1323 PolarHBondContact O-N 3.26Å; L1323-D1325 VanDerWaalsContact C-N 3.29Å; L1323-D1325 PolarHBondContact O-N 3.19Å; L1323-M1327 HydrophobicContact CD1-CE 3.67Å; L1323-M1327 HydrophobicContact CD1-CG 4.11Å; L1323-M1327 HydrophobicContact CD1-SD 3.9Å; L1323-M1327 HydrophobicContact CG-CE 3.71Å; L1323-M1327 WeakPolarHBondContact O-CE 3.42Å; L1323-M1327 WeakPolarHBondContact O-CG 3.42Å; L1323-M1327 PolarHBondContact O-N 2.84Å; L1323-M1327 VanDerWaalsContact O-N 3.16Å; L1323-V1336 HydrophobicContact CD1-CG1 4.27Å; L1323-V1336 HydrophobicContact CD1-CG2 4.31Å; L1323-R1354 HydrophobicContact CD2-CB 3.78Å; L1323-I1355 HydrophobicContact CD1-CG1 4.35Å; L1323-I1355 HydrophobicContact CD2-CG1 4.14Å
1324V87.8Confident77.6Confident22 Ų2250.8 Ų50.813%0.13327%0.274CS..Hα-helixtrans-53-47.9173.4169.90000110.8S1320 S1321 M1327 K1328 M1358S1320-V1324 WeakPolarHBondContact O-CB 3.4Å; S1320-V1324 WeakPolarHBondContact O-CG2 3.45Å; S1320-V1324 PolarHBondContact O-N 3.24Å; S1321-V1324 CarbonylContact O-C 3.59Å; S1321-V1324 WeakPolarHBondContact O-CB 3.21Å; S1321-V1324 PolarHBondContact O-N 2.76Å; V1324-M1327 PolarHBondContact O-N 2.89Å; V1324-K1328 HydrophobicContact CG1-CD 4.28Å; V1324-K1328 VanDerWaalsContact CG1-NZ 3.3Å; V1324-K1328 WeakPolarHBondContact O-CG 3.45Å; V1324-K1328 PolarHBondContact O-N 3.28Å; V1324-M1358 HydrophobicContact CB-CE 3.89Å; V1324-M1358 HydrophobicContact CG2-CE 3.22Å; V1324-M1358 HydrophobicContact CG2-CG 4.35Å; V1324-M1358 HydrophobicContact CG2-SD 3.53Å; V1324-M1358 VanDerWaalsContact CG2-SD 3.53Å
1325D90.1Very high80.1Confident74 Ų7446.2 Ų46.240%0.39625%0.246SC..Hα-helixtrans-80.6-35.1-170.8-64.9-30.1000111.7S1321 S1322 L1323 M1327 K1328 D1329S1321-D1325 WeakPolarHBondContact O-CB 3.41Å; S1321-D1325 PolarHBondContact O-N 3.13Å; S1322-D1325 PolarHBondContact O-N 2.93Å; L1323-D1325 VanDerWaalsContact C-N 3.29Å; L1323-D1325 PolarHBondContact O-N 3.19Å; D1325-M1327 VanDerWaalsContact C-N 3.26Å; D1325-M1327 PolarHBondContact O-N 3.43Å; D1325-K1328 PolarHBondContact O-N 2.69Å; D1325-K1328 IonicContact OD1-NZ 3.84Å; D1325-K1328 PolarHBondContact OD1-NZ 2.73Å; D1325-D1329 PolarHBondContact O-N 2.67Å
1326M94.5Very high82.7Confident0 Ų042.9 Ų42.90%023%0.226CC..Hα-helixtrans-56-40.1167.3-74.2177.263.100112.3C1267 I1298 S1322 K1328 D1329 A1332 N1333 V1336C1267-M1326 HydrophobicContact CB-CG 4.36Å; C1267-M1326 HydrophobicContact CB-SD 3.97Å; I1298-M1326 HydrophobicContact CB-SD 4.23Å; I1298-M1326 HydrophobicContact CD1-CE 4.23Å; I1298-M1326 HydrophobicContact CD1-SD 4.41Å; I1298-M1326 HydrophobicContact CG2-CE 4.13Å; I1298-M1326 HydrophobicContact CG2-SD 3.63Å; S1322-M1326 WeakPolarHBondContact O-CG 3.3Å; S1322-M1326 PolarHBondContact O-N 3.46Å; M1326-K1328 VanDerWaalsContact C-N 3.29Å; M1326-K1328 PolarHBondContact O-N 3.08Å; M1326-D1329 PolarHBondContact O-N 3.36Å; M1326-A1332 HydrophobicContact CB-CB 3.78Å; M1326-A1332 HydrophobicContact CG-CB 3.92Å; M1326-A1332 CarbonylContact O-C 3.25Å; M1326-A1332 VanDerWaalsContact O-C 3.23Å; M1326-A1332 WeakPolarHBondContact O-CB 3.42Å; M1326-N1333 PolarHBondContact O-N 3.05Å; M1326-V1336 HydrophobicContact CB-CG2 3.93Å; M1326-V1336 HydrophobicContact CE-CG2 3.88Å
1327M94.6Very high85.1Confident0 Ų038.5 Ų38.50%020%0.198CC..THydrogen-bonded Turntrans-78-10.3177.7-69.5-173.2-6300114.6L1323 V1324 D1325 V1336 I1355 M1358 L1362 G1368 I1371L1323-M1327 HydrophobicContact CD1-CE 3.67Å; L1323-M1327 HydrophobicContact CD1-CG 4.11Å; L1323-M1327 HydrophobicContact CD1-SD 3.9Å; L1323-M1327 HydrophobicContact CG-CE 3.71Å; L1323-M1327 WeakPolarHBondContact O-CE 3.42Å; L1323-M1327 WeakPolarHBondContact O-CG 3.42Å; L1323-M1327 PolarHBondContact O-N 2.84Å; L1323-M1327 VanDerWaalsContact O-N 3.16Å; V1324-M1327 PolarHBondContact O-N 2.89Å; D1325-M1327 VanDerWaalsContact C-N 3.26Å; D1325-M1327 PolarHBondContact O-N 3.43Å; M1327-V1336 HydrophobicContact CG-CB 4.11Å; M1327-V1336 HydrophobicContact CG-CG1 3.76Å; M1327-V1336 HydrophobicContact CG-CG2 3.92Å; M1327-V1336 HydrophobicContact SD-CG1 3.93Å; M1327-I1355 HydrophobicContact CE-CB 4.34Å; M1327-I1355 HydrophobicContact CE-CG1 3.87Å; M1327-I1355 HydrophobicContact CE-CG2 3.77Å; M1327-I1355 HydrophobicContact SD-CB 4.28Å; M1327-I1355 HydrophobicContact SD-CD1 3.79Å; M1327-I1355 HydrophobicContact SD-CG1 3.69Å; M1327-I1355 HydrophobicContact SD-CG2 3.54Å; M1327-I1355 VanDerWaalsContact SD-CG2 3.54Å; M1327-M1358 HydrophobicContact CE-CE 3.1Å; M1327-L1362 HydrophobicContact CB-CD1 4.48Å; M1327-L1362 HydrophobicContact CB-CD2 3.67Å; M1327-L1362 HydrophobicContact CE-CD1 3.97Å; M1327-L1362 HydrophobicContact CE-CD2 4.38Å; M1327-L1362 HydrophobicContact SD-CD1 4Å; M1327-G1368 WeakPolarHBondContact O-CA 3.28Å; M1327-G1368 PolarHBondContact O-N 2.96Å; M1327-I1371 HydrophobicContact CB-CG1 4.03Å; M1327-I1371 HydrophobicContact CG-CD1 4.3Å; M1327-I1371 HydrophobicContact CG-CG1 3.94Å; M1327-I1371 HydrophobicContact CG-CG2 4.48Å; M1327-I1371 HydrophobicContact SD-CB 4.43Å; M1327-I1371 HydrophobicContact SD-CG1 4.22Å; M1327-I1371 HydrophobicContact SD-CG2 3.7Å
1328K93Very high87.3Confident57 Ų5733.6 Ų33.625%0.24817%0.17CC..THydrogen-bonded Turntrans-94.1-22.1170.8-67.6170.7-170.7157.50112.9V1324 D1325 M1326 F1365 Y1367V1324-K1328 HydrophobicContact CG1-CD 4.28Å; V1324-K1328 VanDerWaalsContact CG1-NZ 3.3Å; V1324-K1328 WeakPolarHBondContact O-CG 3.45Å; V1324-K1328 PolarHBondContact O-N 3.28Å; D1325-K1328 PolarHBondContact O-N 2.69Å; D1325-K1328 IonicContact OD1-NZ 3.84Å; D1325-K1328 PolarHBondContact OD1-NZ 2.73Å; M1326-K1328 VanDerWaalsContact C-N 3.29Å; M1326-K1328 PolarHBondContact O-N 3.08Å; K1328-F1365 HydrophobicContact CB-CD1 4.19Å; K1328-F1365 HydrophobicContact CB-CG 4.4Å; K1328-F1365 HydrophobicContact CD-CD1 3.93Å; K1328-F1365 HydrophobicContact CD-CD2 4.44Å; K1328-F1365 HydrophobicContact CD-CE1 3.72Å; K1328-F1365 HydrophobicContact CD-CE2 4.27Å; K1328-F1365 HydrophobicContact CD-CG 4.31Å; K1328-F1365 HydrophobicContact CD-CZ 3.91Å; K1328-F1365 HydrophobicContact CG-CB 4.31Å; K1328-F1365 HydrophobicContact CG-CD1 3.77Å; K1328-F1365 HydrophobicContact CG-CD2 4.03Å; K1328-F1365 HydrophobicContact CG-CE1 4.08Å; K1328-F1365 HydrophobicContact CG-CE2 4.34Å; K1328-F1365 HydrophobicContact CG-CG 3.75Å; K1328-F1365 HydrophobicContact CG-CZ 4.36Å; K1328-Y1367 VanDerWaalsContact O-CD2 3.25Å; K1328-Y1367 WeakPolarHBondContact O-CD2 3.36Å
1329D95.8Very high89.4Confident32 Ų3228.3 Ų28.317%0.17114%0.142CC..SBendtrans-76.8153.2-176.7174.857.4000112.7S1271 D1325 M1326 Y1331 A1332 N1333S1271-D1329 WeakPolarHBondContact CA-OD2 3.21Å; D1325-D1329 PolarHBondContact O-N 2.67Å; M1326-D1329 PolarHBondContact O-N 3.36Å; D1329-Y1331 VanDerWaalsContact C-N 3.31Å; D1329-Y1331 PolarHBondContact O-N 3.24Å; D1329-Y1331 WeakPolarHBondContact OD2-CA 3.42Å; D1329-Y1331 WeakPolarHBondContact OD2-CB 3.17Å; D1329-Y1331 PolarHBondContact OD2-N 2.75Å; D1329-A1332 HydrophobicContact CB-CB 4.13Å; D1329-A1332 PolarHBondContact OD2-N 3.36Å; D1329-N1333 WeakPolarHBondContact O-CB 3.27Å; D1329-N1333 PolarHBondContact O-ND2 3.47Å
1330Q96.8Very high91.5Very high84 Ų8426.3 Ų26.339%0.39313%0.132SC..THydrogen-bonded Turntrans-69.3-21.9-177.976.8-152.9-82.700114.2N1333 Y1334 Y1367Q1330-N1333 VanDerWaalsContact C-ND2 3.29Å; Q1330-N1333 PolarHBondContact O-ND2 3.2Å; Q1330-N1333 VanDerWaalsContact O-ND2 3.09Å; Q1330-Y1334 WeakPolarHBondContact O-CE2 3.46Å; Q1330-Y1367 HydrophobicContact CB-CD1 4.26Å; Q1330-Y1367 HydrophobicContact CB-CD2 4.21Å; Q1330-Y1367 HydrophobicContact CB-CE1 3.73Å; Q1330-Y1367 HydrophobicContact CB-CE2 3.65Å; Q1330-Y1367 HydrophobicContact CB-CG 4.48Å
1331Y97.9Very high93.3Very high57 Ų5725.5 Ų25.522%0.22412%0.123CC..THydrogen-bonded Turntrans-111.1-47.9179.9-53.3-63.4000111.6S1270 K1273 D1329 N1333 Y1334S1270-Y1331 CarbonylContact O-C 3.23Å; K1273-Y1331 HydrophobicContact CB-CD1 4.42Å; K1273-Y1331 HydrophobicContact CB-CD2 4.4Å; K1273-Y1331 HydrophobicContact CB-CE1 3.88Å; K1273-Y1331 HydrophobicContact CB-CE2 3.85Å; K1273-Y1331 HydrophobicContact CD-CE1 4.46Å; K1273-Y1331 HydrophobicContact CG-CE1 3.77Å; D1329-Y1331 VanDerWaalsContact C-N 3.31Å; D1329-Y1331 PolarHBondContact O-N 3.24Å; D1329-Y1331 WeakPolarHBondContact OD2-CA 3.42Å; D1329-Y1331 WeakPolarHBondContact OD2-CB 3.17Å; D1329-Y1331 PolarHBondContact OD2-N 2.75Å; Y1331-N1333 PolarHBondContact O-N 3.13Å; Y1331-N1333 VanDerWaalsContact O-N 3.14Å; Y1331-Y1334 WeakPolarHBondContact O-CD2 3.31Å; Y1331-Y1334 PolarHBondContact O-N 3.35Å
1332A97.6Very high94.4Very high0 Ų026.8 Ų26.80%013%0.127CC..Hα-helixtrans-66.3-20.8-173.300000113.8S1270 M1326 D1329 Y1334 V1335 V1336S1270-A1332 WeakPolarHBondContact O-CA 3.5Å; S1270-A1332 WeakPolarHBondContact O-CB 3.5Å; S1270-A1332 PolarHBondContact O-N 3.29Å; S1270-A1332 VanDerWaalsContact O-N 3.14Å; M1326-A1332 HydrophobicContact CB-CB 3.78Å; M1326-A1332 HydrophobicContact CG-CB 3.92Å; M1326-A1332 CarbonylContact O-C 3.25Å; M1326-A1332 VanDerWaalsContact O-C 3.23Å; M1326-A1332 WeakPolarHBondContact O-CB 3.42Å; D1329-A1332 HydrophobicContact CB-CB 4.13Å; D1329-A1332 PolarHBondContact OD2-N 3.36Å; A1332-Y1334 PolarHBondContact O-N 3.11Å; A1332-V1335 WeakPolarHBondContact O-CB 3.37Å; A1332-V1335 PolarHBondContact O-N 2.91Å; A1332-V1335 VanDerWaalsContact O-N 3.16Å; A1332-V1336 PolarHBondContact O-N 2.8Å
1333N97Very high94.9Very high0 Ų026 Ų260%012%0.121CC..Hα-helixtrans-62.6-2817480.389000112.6M1326 D1329 Q1330 Y1331 Q1337 I1371M1326-N1333 PolarHBondContact O-N 3.05Å; D1329-N1333 WeakPolarHBondContact O-CB 3.27Å; D1329-N1333 PolarHBondContact O-ND2 3.47Å; Q1330-N1333 VanDerWaalsContact C-ND2 3.29Å; Q1330-N1333 PolarHBondContact O-ND2 3.2Å; Q1330-N1333 VanDerWaalsContact O-ND2 3.09Å; Y1331-N1333 PolarHBondContact O-N 3.13Å; Y1331-N1333 VanDerWaalsContact O-N 3.14Å; N1333-Q1337 WeakPolarHBondContact O-CG 3.49Å; N1333-Q1337 PolarHBondContact O-N 3.42Å; N1333-Q1337 VanDerWaalsContact O-N 3.15Å; N1333-Q1337 PolarHBondContact O-NE2 3.38Å; N1333-Q1337 PolarHBondContact OD1-NE2 2.97Å; N1333-I1371 HydrophobicContact CB-CD1 3.98Å; N1333-I1371 VanDerWaalsContact O-CD1 3.31Å; N1333-I1371 WeakPolarHBondContact O-CD1 3.08Å
1334Y97.8Very high95Very high93 Ų9329 Ų2937%0.36514%0.138SC..Hα-helixtrans-73.1-40.7173.7-63.6-76.3000111.2A141 E1280 Q1330 Y1331 A1332 V1336 Q1337 R1338A141-Y1334 HydrophobicContact CB-CE1 4.38Å; E1280-Y1334 VanDerWaalsContact OE1-CB 3.28Å; E1280-Y1334 WeakPolarHBondContact OE1-CB 3.3Å; Q1330-Y1334 WeakPolarHBondContact O-CE2 3.46Å; Y1331-Y1334 WeakPolarHBondContact O-CD2 3.31Å; Y1331-Y1334 PolarHBondContact O-N 3.35Å; A1332-Y1334 PolarHBondContact O-N 3.11Å; Y1334-V1336 VanDerWaalsContact C-N 3.34Å; Y1334-V1336 PolarHBondContact O-N 3.34Å; Y1334-Q1337 WeakPolarHBondContact O-CB 3.39Å; Y1334-Q1337 PolarHBondContact O-N 2.81Å; Y1334-Q1337 VanDerWaalsContact O-N 3.1Å; Y1334-R1338 PolarHBondContact O-N 3.13Å
1335V97.7Very high95.3Very high0 Ų033.7 Ų33.70%017%0.166CC..Hα-helixtrans-60.2-43.2174.1-168.30000111.2M1279 E1280 I1283 A1332 Q1337 R1338 M1339M1279-V1335 HydrophobicContact CB-CG1 4.02Å; M1279-V1335 HydrophobicContact CB-CG2 4.31Å; E1280-V1335 HydrophobicContact CG-CG2 4.29Å; I1283-V1335 HydrophobicContact CD1-CG1 3.48Å; I1283-V1335 VanDerWaalsContact CD1-CG1 3.48Å; A1332-V1335 WeakPolarHBondContact O-CB 3.37Å; A1332-V1335 PolarHBondContact O-N 2.91Å; A1332-V1335 VanDerWaalsContact O-N 3.16Å; V1335-Q1337 VanDerWaalsContact C-N 3.33Å; V1335-Q1337 PolarHBondContact O-N 2.91Å; V1335-R1338 PolarHBondContact O-N 2.93Å; V1335-M1339 HydrophobicContact CG1-CE 4.36Å; V1335-M1339 WeakPolarHBondContact O-CG 3.02Å; V1335-M1339 PolarHBondContact O-N 3.42Å
1336V96.1Very high95.3Very high0 Ų034.9 Ų34.90%017%0.17CC..Hα-helixtrans-65-34.9175.4178.70000112.1L1323 M1326 M1327 A1332 Y1334 M1339 L1340 I1355 I1371L1323-V1336 HydrophobicContact CD1-CG1 4.27Å; L1323-V1336 HydrophobicContact CD1-CG2 4.31Å; M1326-V1336 HydrophobicContact CB-CG2 3.93Å; M1326-V1336 HydrophobicContact CE-CG2 3.88Å; M1327-V1336 HydrophobicContact CG-CB 4.11Å; M1327-V1336 HydrophobicContact CG-CG1 3.76Å; M1327-V1336 HydrophobicContact CG-CG2 3.92Å; M1327-V1336 HydrophobicContact SD-CG1 3.93Å; A1332-V1336 PolarHBondContact O-N 2.8Å; Y1334-V1336 VanDerWaalsContact C-N 3.34Å; Y1334-V1336 PolarHBondContact O-N 3.34Å; V1336-M1339 PolarHBondContact O-N 2.96Å; V1336-L1340 HydrophobicContact CG1-CD1 4.39Å; V1336-L1340 WeakPolarHBondContact O-CG 3.1Å; V1336-L1340 PolarHBondContact O-N 3.16Å; V1336-I1355 HydrophobicContact CG1-CD1 4.29Å; V1336-I1371 HydrophobicContact CB-CD1 4.28Å; V1336-I1371 HydrophobicContact CG1-CD1 4.32Å
1337Q96.4Very high95.1Very high14 Ų1436 Ų367%0.06518%0.175CC..Hα-helixtrans-66.2-41173.3-74.1171.396.300112N1333 Y1334 V1335 L1340 E1341 I1371 K1374N1333-Q1337 WeakPolarHBondContact O-CG 3.49Å; N1333-Q1337 PolarHBondContact O-N 3.42Å; N1333-Q1337 VanDerWaalsContact O-N 3.15Å; N1333-Q1337 PolarHBondContact O-NE2 3.38Å; N1333-Q1337 PolarHBondContact OD1-NE2 2.97Å; Y1334-Q1337 WeakPolarHBondContact O-CB 3.39Å; Y1334-Q1337 PolarHBondContact O-N 2.81Å; Y1334-Q1337 VanDerWaalsContact O-N 3.1Å; V1335-Q1337 VanDerWaalsContact C-N 3.33Å; V1335-Q1337 PolarHBondContact O-N 2.91Å; Q1337-L1340 PolarHBondContact O-N 3.32Å; Q1337-E1341 VanDerWaalsContact O-CG 3.29Å; Q1337-E1341 WeakPolarHBondContact O-CG 3.23Å; Q1337-E1341 PolarHBondContact O-N 3.45Å; Q1337-I1371 HydrophobicContact CG-CD1 3.71Å; Q1337-K1374 HydrophobicContact CG-CB 4.3Å; Q1337-K1374 HydrophobicContact CG-CD 4.38Å; Q1337-K1374 HydrophobicContact CG-CG 4.16Å
1338R96.6Very high95.1Very high16 Ų1639 Ų396%0.0619%0.186CC..Hα-helixtrans-65.1-36.8173.9-174.658.246.952.119.7112.8N137 E1280 I1283 Y1334 V1335 E1341 L1342N137-R1338 PolarHBondContact OD1-NE 3.29Å; N137-R1338 PolarHBondContact OD1-NH2 3.23Å; E1280-R1338 HydrophobicContact CG-CB 4.02Å; E1280-R1338 HydrophobicContact CG-CG 4.27Å; E1280-R1338 IonicContact OE2-CZ 3.99Å; E1280-R1338 IonicContact OE2-NH1 2.67Å; E1280-R1338 PolarHBondContact OE2-NH1 3.36Å; E1280-R1338 IonicContact OE2-NH2 2.96Å; E1280-R1338 PolarHBondContact OE2-NH2 2.97Å; I1283-R1338 HydrophobicContact CG2-CG 4.22Å; Y1334-R1338 PolarHBondContact O-N 3.13Å; V1335-R1338 PolarHBondContact O-N 2.93Å; R1338-E1341 WeakPolarHBondContact CA-OE2 3.38Å; R1338-E1341 WeakPolarHBondContact CD-OE2 3.29Å; R1338-E1341 IonicContact CZ-OE2 3.08Å; R1338-E1341 IonicContact NE-OE2 2.69Å; R1338-E1341 PolarHBondContact NE-OE2 3.03Å; R1338-E1341 IonicContact NH2-OE2 2.73Å; R1338-E1341 WeakPolarHBondContact O-CB 3.29Å; R1338-E1341 PolarHBondContact O-N 2.99Å; R1338-L1342 VanDerWaalsContact CD-CD1 3.43Å; R1338-L1342 HydrophobicContact CG-CD1 4.14Å; R1338-L1342 PolarHBondContact O-N 3.28Å
1339M95.8Very high95Very high0 Ų042.3 Ų42.30%020%0.197CC..Hα-helixtrans-63.7-45.7171.3-71.2-178.916900111.4V1266 I1283 L1294 I1295 I1298 V1335 V1336 E1341 L1342 A1343 L1351V1266-M1339 HydrophobicContact CG1-CE 3.89Å; I1283-M1339 HydrophobicContact CD1-CE 3.56Å; I1283-M1339 HydrophobicContact CD1-CG 3.82Å; I1283-M1339 HydrophobicContact CD1-SD 4.49Å; I1283-M1339 HydrophobicContact CG1-CE 4.36Å; I1283-M1339 HydrophobicContact CG2-CG 4.31Å; L1294-M1339 WeakPolarHBondContact O-CE 3.34Å; I1295-M1339 HydrophobicContact CG1-CB 4.32Å; I1295-M1339 HydrophobicContact CG1-CE 4.36Å; I1295-M1339 HydrophobicContact CG1-CG 3.98Å; I1295-M1339 HydrophobicContact CG1-SD 4.16Å; I1298-M1339 HydrophobicContact CD1-CE 4.12Å; I1298-M1339 HydrophobicContact CD1-SD 3.3Å; I1298-M1339 WeakPolarHBondContact CD1-SD 3.31Å; I1298-M1339 HydrophobicContact CG1-CE 4.34Å; I1298-M1339 HydrophobicContact CG1-SD 3.98Å; V1335-M1339 HydrophobicContact CG1-CE 4.36Å; V1335-M1339 WeakPolarHBondContact O-CG 3.02Å; V1335-M1339 PolarHBondContact O-N 3.42Å; V1336-M1339 PolarHBondContact O-N 2.96Å; M1339-E1341 VanDerWaalsContact C-N 3.27Å; M1339-E1341 PolarHBondContact O-N 3.44Å; M1339-L1342 PolarHBondContact O-N 2.92Å; M1339-A1343 WeakPolarHBondContact O-CB 3.26Å; M1339-A1343 PolarHBondContact O-N 2.87Å; M1339-L1351 HydrophobicContact CB-CD1 4.28Å
1340L94.6Very high94.8Very high0 Ų042.4 Ų42.40%020%0.199CC..Hα-helixtrans-62.6-32.7175.6-75.2168.5000113V1336 Q1337 R1348 L1351 I1352 I1355 I1371 K1374 L1375 Y1378V1336-L1340 HydrophobicContact CG1-CD1 4.39Å; V1336-L1340 WeakPolarHBondContact O-CG 3.1Å; V1336-L1340 PolarHBondContact O-N 3.16Å; Q1337-L1340 PolarHBondContact O-N 3.32Å; L1340-R1348 PolarHBondContact O-NE 3.34Å; L1340-L1351 HydrophobicContact CD2-CB 3.81Å; L1340-L1351 HydrophobicContact CD2-CD1 4.35Å; L1340-I1352 HydrophobicContact CD2-CG1 4.05Å; L1340-I1355 HydrophobicContact CD1-CD1 4.06Å; L1340-I1355 HydrophobicContact CD2-CD1 4.18Å; L1340-I1355 HydrophobicContact CG-CD1 4.43Å; L1340-I1371 HydrophobicContact CD1-CG2 4.36Å; L1340-K1374 HydrophobicContact CB-CG 4.38Å; L1340-K1374 HydrophobicContact CD1-CG 3.99Å; L1340-L1375 HydrophobicContact CD1-CD2 4.18Å; L1340-L1375 HydrophobicContact CD2-CD2 4.38Å; L1340-Y1378 HydrophobicContact CB-CE2 4.23Å; L1340-Y1378 PolarHBondContact O-OH 2.86Å
1341E94.7Very high94.5Very high33 Ų3338.4 Ų38.415%0.15418%0.18CC..Hα-helixtrans-64.7-55.7172.5-73.9159.2-17400111.8Q1337 R1338 M1339 R1348 K1374Q1337-E1341 VanDerWaalsContact O-CG 3.29Å; Q1337-E1341 WeakPolarHBondContact O-CG 3.23Å; Q1337-E1341 PolarHBondContact O-N 3.45Å; R1338-E1341 WeakPolarHBondContact CA-OE2 3.38Å; R1338-E1341 WeakPolarHBondContact CD-OE2 3.29Å; R1338-E1341 IonicContact CZ-OE2 3.08Å; R1338-E1341 IonicContact NE-OE2 2.69Å; R1338-E1341 PolarHBondContact NE-OE2 3.03Å; R1338-E1341 IonicContact NH2-OE2 2.73Å; R1338-E1341 WeakPolarHBondContact O-CB 3.29Å; R1338-E1341 PolarHBondContact O-N 2.99Å; M1339-E1341 VanDerWaalsContact C-N 3.27Å; M1339-E1341 PolarHBondContact O-N 3.44Å; E1341-R1348 PolarHBondContact O-NH2 2.98Å; E1341-K1374 VanDerWaalsContact CG-NZ 3.28Å; E1341-K1374 WeakPolarHBondContact OE1-CE 3.5Å; E1341-K1374 IonicContact OE1-NZ 2.96Å; E1341-K1374 PolarHBondContact OE1-NZ 2.68Å
1342L95Very high94.3Very high55 Ų5536.5 Ų36.529%0.28817%0.173SC..Hα-helixtrans-99.9-8-164.3-58.3-175.2000115.4A1284 R1291 R1338 M1339A1284-L1342 HydrophobicContact CB-CD1 3.9Å; R1291-L1342 PolarHBondContact NE-O 3.47Å; R1291-L1342 PolarHBondContact NH2-O 3.32Å; R1338-L1342 VanDerWaalsContact CD-CD1 3.43Å; R1338-L1342 HydrophobicContact CG-CD1 4.14Å; R1338-L1342 PolarHBondContact O-N 3.28Å; M1339-L1342 PolarHBondContact O-N 2.92Å
1343A93.7Very high93.9Very high2 Ų239.8 Ų39.82%0.01719%0.191CC..SBendtrans-53.8141.7167.300000111.2I1295 M1339 Q1347 R1348 L1351I1295-A1343 HydrophobicContact CD1-CB 4.05Å; M1339-A1343 WeakPolarHBondContact O-CB 3.26Å; M1339-A1343 PolarHBondContact O-N 2.87Å; A1343-Q1347 HydrophobicContact CB-CB 3.7Å; A1343-R1348 HydrophobicContact CB-CB 3.9Å; A1343-R1348 PolarHBondContact O-NH2 3.49Å; A1343-L1351 HydrophobicContact CB-CD1 3.91Å
1344D92.4Very high93.5Very high71 Ų7144.2 Ų44.238%0.3821%0.208SC..  trans-65.8175.9168.269.548.7000111.8E1346 Q1347 R1348D1344-E1346 VanDerWaalsContact C-N 3.26Å; D1344-E1346 PolarHBondContact O-N 3Å; D1344-E1346 WeakPolarHBondContact OD1-CA 3.32Å; D1344-E1346 PolarHBondContact OD1-N 3.43Å; D1344-Q1347 VanDerWaalsContact CG-CD 3.48Å; D1344-Q1347 VanDerWaalsContact N-OE1 3.12Å; D1344-Q1347 WeakPolarHBondContact OD1-CG 3.32Å; D1344-Q1347 PolarHBondContact OD1-N 3.37Å; D1344-Q1347 WeakPolarHBondContact OD2-CG 3.38Å; D1344-Q1347 PolarHBondContact OD2-NE2 3.09Å; D1344-Q1347 PolarHBondContact OD2-OE1 3.47Å; D1344-R1348 WeakPolarHBondContact O-CB 3.3Å; D1344-R1348 PolarHBondContact O-N 3.43Å
1345T92.4Very high93.2Very high119 Ų11939.8 Ų39.873%0.7319%0.191SC*.Hα-helixtrans-55.5-38.3-177.4-55.90000113.3R1349T1345-R1349 VanDerWaalsContact O-CB 3.31Å; T1345-R1349 WeakPolarHBondContact O-CB 3.15Å; T1345-R1349 PolarHBondContact O-N 2.92Å; T1345-R1349 VanDerWaalsContact O-N 3.08Å
1346E90.9Very high92.8Very high100 Ų10044.7 Ų44.747%0.46721%0.209SC..Hα-helixtrans-82.8-46.4-176.4175.954.9-161.800111.2D1344 R1348 R1349 V1350D1344-E1346 VanDerWaalsContact C-N 3.26Å; D1344-E1346 PolarHBondContact O-N 3Å; D1344-E1346 WeakPolarHBondContact OD1-CA 3.32Å; D1344-E1346 PolarHBondContact OD1-N 3.43Å; E1346-R1348 VanDerWaalsContact C-N 3.29Å; E1346-R1348 PolarHBondContact O-N 3.42Å; E1346-R1349 WeakPolarHBondContact O-CB 3.16Å; E1346-R1349 PolarHBondContact O-N 3.33Å; E1346-R1349 VanDerWaalsContact O-N 3.14Å; E1346-R1349 IonicContact OE1-CZ 3.64Å; E1346-R1349 IonicContact OE1-NE 2.78Å; E1346-R1349 IonicContact OE1-NH2 2.81Å; E1346-R1349 PolarHBondContact OE1-NH2 3.27Å; E1346-R1349 IonicContact OE2-CZ 3.57Å; E1346-R1349 IonicContact OE2-NE 3.62Å; E1346-R1349 PolarHBondContact OE2-NE 3.16Å; E1346-R1349 IonicContact OE2-NH2 3.34Å; E1346-R1349 PolarHBondContact OE2-NH2 2.8Å; E1346-V1350 WeakPolarHBondContact O-CG2 3.45Å; E1346-V1350 PolarHBondContact O-N 3.09Å
1347Q90.6Very high92.4Very high23 Ų2349.5 Ų49.511%0.10724%0.24CC..Hα-helixtrans-54.5-45.4171.3-69.1168.73.900111.4A1292 A1343 D1344 V1350 L1351A1292-Q1347 VanDerWaalsContact CA-NE2 3.28Å; A1343-Q1347 HydrophobicContact CB-CB 3.7Å; D1344-Q1347 VanDerWaalsContact CG-CD 3.48Å; D1344-Q1347 VanDerWaalsContact N-OE1 3.12Å; D1344-Q1347 WeakPolarHBondContact OD1-CG 3.32Å; D1344-Q1347 PolarHBondContact OD1-N 3.37Å; D1344-Q1347 WeakPolarHBondContact OD2-CG 3.38Å; D1344-Q1347 PolarHBondContact OD2-NE2 3.09Å; D1344-Q1347 PolarHBondContact OD2-OE1 3.47Å; Q1347-V1350 PolarHBondContact O-N 3.28Å; Q1347-L1351 WeakPolarHBondContact O-CB 3.34Å; Q1347-L1351 WeakPolarHBondContact O-CG 3.25Å; Q1347-L1351 PolarHBondContact O-N 3.12Å
1348R93.8Very high91.9Very high63 Ų6350.1 Ų50.124%0.23824%0.243CC..Hα-helixtrans-66.6-39.2178.6-167.3-174.4-67.9120.3-4.8111.1L1340 E1341 A1343 D1344 E1346 I1352L1340-R1348 PolarHBondContact O-NE 3.34Å; E1341-R1348 PolarHBondContact O-NH2 2.98Å; A1343-R1348 HydrophobicContact CB-CB 3.9Å; A1343-R1348 PolarHBondContact O-NH2 3.49Å; D1344-R1348 WeakPolarHBondContact O-CB 3.3Å; D1344-R1348 PolarHBondContact O-N 3.43Å; E1346-R1348 VanDerWaalsContact C-N 3.29Å; E1346-R1348 PolarHBondContact O-N 3.42Å; R1348-I1352 HydrophobicContact CG-CD1 3.91Å; R1348-I1352 HydrophobicContact CG-CG1 4.46Å; R1348-I1352 WeakPolarHBondContact O-CB 3.34Å; R1348-I1352 WeakPolarHBondContact O-CG1 3.36Å; R1348-I1352 PolarHBondContact O-N 2.89Å
1349R92.4Very high91.4Very high126 Ų12651 Ų5148%0.47525%0.248SC..Hα-helixtrans-60.2-45.9173.1-173-167.27286.14.9111.3T1345 E1346 N1353T1345-R1349 VanDerWaalsContact O-CB 3.31Å; T1345-R1349 WeakPolarHBondContact O-CB 3.15Å; T1345-R1349 PolarHBondContact O-N 2.92Å; T1345-R1349 VanDerWaalsContact O-N 3.08Å; E1346-R1349 WeakPolarHBondContact O-CB 3.16Å; E1346-R1349 PolarHBondContact O-N 3.33Å; E1346-R1349 VanDerWaalsContact O-N 3.14Å; E1346-R1349 IonicContact OE1-CZ 3.64Å; E1346-R1349 IonicContact OE1-NE 2.78Å; E1346-R1349 IonicContact OE1-NH2 2.81Å; E1346-R1349 PolarHBondContact OE1-NH2 3.27Å; E1346-R1349 IonicContact OE2-CZ 3.57Å; E1346-R1349 IonicContact OE2-NE 3.62Å; E1346-R1349 PolarHBondContact OE2-NE 3.16Å; E1346-R1349 IonicContact OE2-NH2 3.34Å; E1346-R1349 PolarHBondContact OE2-NH2 2.8Å; R1349-N1353 WeakPolarHBondContact O-CB 3.22Å; R1349-N1353 VanDerWaalsContact O-CG 3.22Å; R1349-N1353 PolarHBondContact O-N 2.83Å; R1349-N1353 PolarHBondContact O-ND2 3.06Å
1350V90.8Very high91Very high34 Ų3456.2 Ų56.221%0.20628%0.276CS..Hα-helixtrans-65.9-46.7178.5176.40000111.3L1299 E1346 Q1347 N1353 R1354L1299-V1350 HydrophobicContact CD1-CB 4.47Å; L1299-V1350 HydrophobicContact CD1-CG1 3.81Å; L1299-V1350 HydrophobicContact CD2-CG1 4.01Å; L1299-V1350 HydrophobicContact CG-CG1 4.49Å; E1346-V1350 WeakPolarHBondContact O-CG2 3.45Å; E1346-V1350 PolarHBondContact O-N 3.09Å; Q1347-V1350 PolarHBondContact O-N 3.28Å; V1350-N1353 PolarHBondContact O-N 3.05Å; V1350-R1354 WeakPolarHBondContact O-CG 3.35Å; V1350-R1354 PolarHBondContact O-N 3.14Å
1351L91.4Very high90.6Very high0 Ų059.4 Ų59.40%030%0.295CS..Hα-helixtrans-55.2-53173.6-78.6164.5000111.6I1295 I1298 L1299 M1339 L1340 A1343 Q1347 N1353 R1354 I1355I1295-L1351 HydrophobicContact CG2-CD1 3.9Å; I1295-L1351 HydrophobicContact CG2-CD2 4.32Å; I1295-L1351 HydrophobicContact CG2-CG 4.16Å; I1298-L1351 HydrophobicContact CD1-CD2 4.42Å; L1299-L1351 HydrophobicContact CD2-CD2 3.82Å; L1299-L1351 HydrophobicContact CD2-CG 4.23Å; L1299-L1351 HydrophobicContact CG-CD2 4.33Å; M1339-L1351 HydrophobicContact CB-CD1 4.28Å; L1340-L1351 HydrophobicContact CD2-CB 3.81Å; L1340-L1351 HydrophobicContact CD2-CD1 4.35Å; A1343-L1351 HydrophobicContact CB-CD1 3.91Å; Q1347-L1351 WeakPolarHBondContact O-CB 3.34Å; Q1347-L1351 WeakPolarHBondContact O-CG 3.25Å; Q1347-L1351 PolarHBondContact O-N 3.12Å; L1351-N1353 VanDerWaalsContact C-N 3.27Å; L1351-N1353 PolarHBondContact O-N 2.97Å; L1351-R1354 PolarHBondContact O-N 3.28Å; L1351-R1354 VanDerWaalsContact O-N 3.13Å; L1351-I1355 VanDerWaalsContact O-CG1 3.22Å; L1351-I1355 WeakPolarHBondContact O-CG1 3.44Å; L1351-I1355 PolarHBondContact O-N 3.15Å
1352I92.1Very high90.3Very high17 Ų1757.8 Ų57.89%0.08729%0.288CS..Hα-helixtrans-57.8-40.8178.9-71.9171.2000111.1L1340 R1348 I1355 R1356 L1375 Y1378L1340-I1352 HydrophobicContact CD2-CG1 4.05Å; R1348-I1352 HydrophobicContact CG-CD1 3.91Å; R1348-I1352 HydrophobicContact CG-CG1 4.46Å; R1348-I1352 WeakPolarHBondContact O-CB 3.34Å; R1348-I1352 WeakPolarHBondContact O-CG1 3.36Å; R1348-I1352 PolarHBondContact O-N 2.89Å; I1352-I1355 PolarHBondContact O-N 3.33Å; I1352-R1356 HydrophobicContact CG2-CG 4.09Å; I1352-R1356 WeakPolarHBondContact O-CB 3.37Å; I1352-R1356 VanDerWaalsContact O-CG 3.26Å; I1352-R1356 WeakPolarHBondContact O-CG 3.39Å; I1352-R1356 PolarHBondContact O-N 3.3Å; I1352-L1375 HydrophobicContact CB-CD2 4.49Å; I1352-L1375 HydrophobicContact CG1-CD2 3.84Å; I1352-Y1378 HydrophobicContact CD1-CD2 4.35Å; I1352-Y1378 HydrophobicContact CD1-CG 4.13Å
1353N90.3Very high90.1Very high70 Ų7062.2 Ų62.237%0.37430%0.301SS..Hα-helixtrans-70.8-30.5178.8-73.6-23.1000113.6R1349 V1350 L1351 P1357R1349-N1353 WeakPolarHBondContact O-CB 3.22Å; R1349-N1353 VanDerWaalsContact O-CG 3.22Å; R1349-N1353 PolarHBondContact O-N 2.83Å; R1349-N1353 PolarHBondContact O-ND2 3.06Å; V1350-N1353 PolarHBondContact O-N 3.05Å; L1351-N1353 VanDerWaalsContact C-N 3.27Å; L1351-N1353 PolarHBondContact O-N 2.97Å; N1353-P1357 WeakPolarHBondContact O-CD 3.47Å
1354R88.1Confident89.9Confident93 Ų9370.3 Ų70.335%0.35134%0.336SS..Hα-helixtrans-71.1-39.2170.3-68.8-65.3-167.4162.82.7112.2L1299 H1300 L1323 V1350 L1351L1299-R1354 HydrophobicContact CD2-CB 4.42Å; L1299-R1354 HydrophobicContact CD2-CG 3.76Å; H1300-R1354 PolarHBondContact CD2-NH2 3.14Å; H1300-R1354 VanDerWaalsContact CD2-NH2 3.33Å; H1300-R1354 PolarHBondContact NE2-NH2 3.08Å; L1323-R1354 HydrophobicContact CD2-CB 3.78Å; V1350-R1354 WeakPolarHBondContact O-CG 3.35Å; V1350-R1354 PolarHBondContact O-N 3.14Å; L1351-R1354 PolarHBondContact O-N 3.28Å; L1351-R1354 VanDerWaalsContact O-N 3.13Å
1355I90.8Very high89.8Confident0 Ų070.6 Ų70.60%033%0.334CS..Hα-helixtrans-82.4-32.9-173.9-53.3163000112.5L1323 M1327 V1336 L1340 L1351 I1352 M1358 Q1359 L1362 I1371 L1375L1323-I1355 HydrophobicContact CD1-CG1 4.35Å; L1323-I1355 HydrophobicContact CD2-CG1 4.14Å; M1327-I1355 HydrophobicContact CE-CB 4.34Å; M1327-I1355 HydrophobicContact CE-CG1 3.87Å; M1327-I1355 HydrophobicContact CE-CG2 3.77Å; M1327-I1355 HydrophobicContact SD-CB 4.28Å; M1327-I1355 HydrophobicContact SD-CD1 3.79Å; M1327-I1355 HydrophobicContact SD-CG1 3.69Å; M1327-I1355 HydrophobicContact SD-CG2 3.54Å; M1327-I1355 VanDerWaalsContact SD-CG2 3.54Å; V1336-I1355 HydrophobicContact CG1-CD1 4.29Å; L1340-I1355 HydrophobicContact CD1-CD1 4.06Å; L1340-I1355 HydrophobicContact CD2-CD1 4.18Å; L1340-I1355 HydrophobicContact CG-CD1 4.43Å; L1351-I1355 VanDerWaalsContact O-CG1 3.22Å; L1351-I1355 WeakPolarHBondContact O-CG1 3.44Å; L1351-I1355 PolarHBondContact O-N 3.15Å; I1352-I1355 PolarHBondContact O-N 3.33Å; I1355-M1358 WeakPolarHBondContact O-CB 3.46Å; I1355-M1358 PolarHBondContact O-N 3Å; I1355-Q1359 PolarHBondContact O-N 3.32Å; I1355-L1362 HydrophobicContact CG2-CD1 3.74Å; I1355-I1371 HydrophobicContact CG2-CG2 4.16Å; I1355-L1375 HydrophobicContact CB-CD1 4.16Å; I1355-L1375 HydrophobicContact CG2-CD1 3.58Å
1356R89.7Confident89.8Confident103 Ų10370.6 Ų70.639%0.38933%0.329SS..G310 helixtrans-50.2-50.4-179-89.4172.5174.6173.4-3.6114.2I1352 M1358 Q1359 N1379I1352-R1356 HydrophobicContact CG2-CG 4.09Å; I1352-R1356 WeakPolarHBondContact O-CB 3.37Å; I1352-R1356 VanDerWaalsContact O-CG 3.26Å; I1352-R1356 WeakPolarHBondContact O-CG 3.39Å; I1352-R1356 PolarHBondContact O-N 3.3Å; R1356-M1358 PolarHBondContact O-N 3.42Å; R1356-M1358 VanDerWaalsContact O-N 3.14Å; R1356-Q1359 WeakPolarHBondContact O-CG 3.35Å; R1356-Q1359 PolarHBondContact O-N 2.86Å; R1356-N1379 PolarHBondContact NH2-OD1 2.92Å
1357P88.3Confident89.9Confident101 Ų10169.8 Ų69.866%0.65632%0.322SS*.G310 helixtrans-57.2-28176.8-26.435.2000114.2N1353N1353-P1357 WeakPolarHBondContact O-CD 3.47Å
1358M85.1Confident89.8Confident26 Ų2668.7 Ų68.713%0.12832%0.317CS..G310 helixtrans-91.2-3.3-173.4-67.6159.935.100114V1324 M1327 I1355 R1356 N1360 V1361 L1362V1324-M1358 HydrophobicContact CB-CE 3.89Å; V1324-M1358 HydrophobicContact CG2-CE 3.22Å; V1324-M1358 HydrophobicContact CG2-CG 4.35Å; V1324-M1358 HydrophobicContact CG2-SD 3.53Å; V1324-M1358 VanDerWaalsContact CG2-SD 3.53Å; M1327-M1358 HydrophobicContact CE-CE 3.1Å; I1355-M1358 WeakPolarHBondContact O-CB 3.46Å; I1355-M1358 PolarHBondContact O-N 3Å; R1356-M1358 PolarHBondContact O-N 3.42Å; R1356-M1358 VanDerWaalsContact O-N 3.14Å; M1358-N1360 PolarHBondContact O-N 3Å; M1358-N1360 VanDerWaalsContact O-N 3.15Å; M1358-V1361 WeakPolarHBondContact O-CA 3.21Å; M1358-V1361 WeakPolarHBondContact O-CB 3.36Å; M1358-V1361 PolarHBondContact O-N 3.22Å; M1358-L1362 PolarHBondContact O-N 3.09Å
1359Q87.4Confident89.7Confident36 Ų3668.3 Ų68.317%0.16832%0.317CS..Hα-helixtrans-53.8-38.5-179.9-71-179.5-8.500112.7I1355 R1356 V1361 L1362 R1363 I1372 L1375I1355-Q1359 PolarHBondContact O-N 3.32Å; R1356-Q1359 WeakPolarHBondContact O-CG 3.35Å; R1356-Q1359 PolarHBondContact O-N 2.86Å; Q1359-V1361 PolarHBondContact O-N 2.91Å; Q1359-L1362 PolarHBondContact O-N 2.78Å; Q1359-R1363 WeakPolarHBondContact O-CG 3.27Å; Q1359-R1363 PolarHBondContact O-N 3.19Å; Q1359-I1372 HydrophobicContact CG-CG1 4.48Å; Q1359-L1375 HydrophobicContact CG-CD1 4.38Å
1360N86.6Confident89.7Confident109 Ų10964 Ų6458%0.58330%0.303SS*.Hα-helixtrans-67.9-21.1177-70-27.1000114.1M1358 R1363M1358-N1360 PolarHBondContact O-N 3Å; M1358-N1360 VanDerWaalsContact O-N 3.15Å; N1360-R1363 PolarHBondContact OD1-NH1 3.42Å
1361V86.5Confident89.8Confident66 Ų6662.4 Ų62.440%0.429%0.293SS..Hα-helixtrans-82.4-51.6169.9-179.20000109.2M1358 Q1359 R1363 K1364 F1365M1358-V1361 WeakPolarHBondContact O-CA 3.21Å; M1358-V1361 WeakPolarHBondContact O-CB 3.36Å; M1358-V1361 PolarHBondContact O-N 3.22Å; Q1359-V1361 PolarHBondContact O-N 2.91Å; V1361-R1363 VanDerWaalsContact C-N 3.28Å; V1361-R1363 PolarHBondContact O-N 3.12Å; V1361-K1364 WeakPolarHBondContact O-CB 3.41Å; V1361-K1364 PolarHBondContact O-N 3.41Å; V1361-F1365 HydrophobicContact CG1-CD2 4.43Å; V1361-F1365 HydrophobicContact CG1-CE2 3.76Å; V1361-F1365 VanDerWaalsContact O-CD2 3.27Å; V1361-F1365 WeakPolarHBondContact O-CD2 3.37Å
1362L88.6Confident89.8Confident0 Ų063 Ų630%030%0.295CS..Hα-helixtrans-59.7-31.4-175.9-67.1176.1000113.9M1327 I1355 M1358 Q1359 K1364 F1365 I1372M1327-L1362 HydrophobicContact CB-CD1 4.48Å; M1327-L1362 HydrophobicContact CB-CD2 3.67Å; M1327-L1362 HydrophobicContact CE-CD1 3.97Å; M1327-L1362 HydrophobicContact CE-CD2 4.38Å; M1327-L1362 HydrophobicContact SD-CD1 4Å; I1355-L1362 HydrophobicContact CG2-CD1 3.74Å; M1358-L1362 PolarHBondContact O-N 3.09Å; Q1359-L1362 PolarHBondContact O-N 2.78Å; L1362-K1364 PolarHBondContact O-N 3.36Å; L1362-F1365 PolarHBondContact O-N 3.44Å; L1362-F1365 VanDerWaalsContact O-N 3.09Å; L1362-I1372 HydrophobicContact CB-CD1 3.94Å; L1362-I1372 HydrophobicContact CB-CG1 4.26Å
1363R89.9Confident89.7Confident147 Ų14763.5 Ų63.556%0.55530%0.302SS*.THydrogen-bonded Turntrans-56.1-19.3172.1-76.9179.7-179.3131.91114.1Q1359 N1360 V1361 I1372Q1359-R1363 WeakPolarHBondContact O-CG 3.27Å; Q1359-R1363 PolarHBondContact O-N 3.19Å; N1360-R1363 PolarHBondContact OD1-NH1 3.42Å; V1361-R1363 VanDerWaalsContact C-N 3.28Å; V1361-R1363 PolarHBondContact O-N 3.12Å; R1363-I1372 HydrophobicContact CB-CD1 4.3Å; R1363-I1372 HydrophobicContact CG-CD1 3.45Å; R1363-I1372 VanDerWaalsContact CG-CD1 3.45Å
1364K90.4Very high89.7Confident173 Ų17360.3 Ų60.375%0.75229%0.285SS*.THydrogen-bonded Turntrans-93.2-1.5-179.1-54.9-175.7-178.8-176.10113.9V1361 L1362V1361-K1364 WeakPolarHBondContact O-CB 3.41Å; V1361-K1364 PolarHBondContact O-N 3.41Å; L1362-K1364 PolarHBondContact O-N 3.36Å
1365F90.2Very high89.8Confident77 Ų7755.9 Ų55.934%0.33827%0.269SS..SBendtrans-120.2137.1-175.8-64.9-91.1000111.2K1328 V1361 L1362 Y1367 G1368 K1369K1328-F1365 HydrophobicContact CB-CD1 4.19Å; K1328-F1365 HydrophobicContact CB-CG 4.4Å; K1328-F1365 HydrophobicContact CD-CD1 3.93Å; K1328-F1365 HydrophobicContact CD-CD2 4.44Å; K1328-F1365 HydrophobicContact CD-CE1 3.72Å; K1328-F1365 HydrophobicContact CD-CE2 4.27Å; K1328-F1365 HydrophobicContact CD-CG 4.31Å; K1328-F1365 HydrophobicContact CD-CZ 3.91Å; K1328-F1365 HydrophobicContact CG-CB 4.31Å; K1328-F1365 HydrophobicContact CG-CD1 3.77Å; K1328-F1365 HydrophobicContact CG-CD2 4.03Å; K1328-F1365 HydrophobicContact CG-CE1 4.08Å; K1328-F1365 HydrophobicContact CG-CE2 4.34Å; K1328-F1365 HydrophobicContact CG-CG 3.75Å; K1328-F1365 HydrophobicContact CG-CZ 4.36Å; V1361-F1365 HydrophobicContact CG1-CD2 4.43Å; V1361-F1365 HydrophobicContact CG1-CE2 3.76Å; V1361-F1365 VanDerWaalsContact O-CD2 3.27Å; V1361-F1365 WeakPolarHBondContact O-CD2 3.37Å; L1362-F1365 PolarHBondContact O-N 3.44Å; L1362-F1365 VanDerWaalsContact O-N 3.09Å; F1365-Y1367 PolarHBondContact O-N 3.31Å; F1365-Y1367 VanDerWaalsContact O-N 3.11Å; F1365-G1368 PolarHBondContact O-N 2.59Å; F1365-K1369 PolarHBondContact O-N 2.87Å
1366N91.7Very high89.7Confident118 Ų11860.5 Ų60.563%0.63129%0.29SS*.THydrogen-bonded Turntrans-55.4-33.9-174-69.5-3.1000113.6K1369N1366-K1369 WeakPolarHBondContact O-CD 3.33Å; N1366-K1369 WeakPolarHBondContact O-CE 3.37Å; N1366-K1369 VanDerWaalsContact O-CG 3.29Å; N1366-K1369 WeakPolarHBondContact O-CG 3.01Å
1367Y92.4Very high89.6Confident83 Ų8360.8 Ų60.833%0.32529%0.294SS..THydrogen-bonded Turntrans-96.1-29.8-178.2-51.1-72.9000112.7K1328 Q1330 F1365 K1369 H1370K1328-Y1367 VanDerWaalsContact O-CD2 3.25Å; K1328-Y1367 WeakPolarHBondContact O-CD2 3.36Å; Q1330-Y1367 HydrophobicContact CB-CD1 4.26Å; Q1330-Y1367 HydrophobicContact CB-CD2 4.21Å; Q1330-Y1367 HydrophobicContact CB-CE1 3.73Å; Q1330-Y1367 HydrophobicContact CB-CE2 3.65Å; Q1330-Y1367 HydrophobicContact CB-CG 4.48Å; F1365-Y1367 PolarHBondContact O-N 3.31Å; F1365-Y1367 VanDerWaalsContact O-N 3.11Å; Y1367-K1369 PolarHBondContact O-N 2.88Å; Y1367-K1369 VanDerWaalsContact O-N 3.13Å; Y1367-H1370 PolarHBondContact O-CD2 3.18Å; Y1367-H1370 PolarHBondContact O-N 3.12Å
1368G90.3Very high89.3Confident0 Ų058.9 Ų58.90%027%0.274CS..Hα-helixtrans-60.7-24.2177.700000114M1327 F1365 H1370 I1371 I1372M1327-G1368 WeakPolarHBondContact O-CA 3.28Å; M1327-G1368 PolarHBondContact O-N 2.96Å; F1365-G1368 PolarHBondContact O-N 2.59Å; G1368-H1370 VanDerWaalsContact C-N 3.27Å; G1368-H1370 PolarHBondContact O-N 2.95Å; G1368-I1371 PolarHBondContact O-N 2.87Å; G1368-I1372 PolarHBondContact O-N 2.88Å
1369K90.6Very high88.7Confident56 Ų5660 Ų6024%0.24328%0.281CS..Hα-helixtrans-58.5-35.4173.177.5-166.9-179.2-170.10112.9A144 E145 F1365 N1366 Y1367 I1372 A1373A144-K1369 HydrophobicContact CB-CD 4.43Å; A144-K1369 WeakPolarHBondContact O-CE 2.89Å; E145-K1369 VanDerWaalsContact CD-NZ 3.32Å; E145-K1369 IonicContact OE1-NZ 2.68Å; E145-K1369 PolarHBondContact OE1-NZ 3.48Å; E145-K1369 IonicContact OE2-NZ 3.77Å; E145-K1369 PolarHBondContact OE2-NZ 2.78Å; F1365-K1369 PolarHBondContact O-N 2.87Å; N1366-K1369 WeakPolarHBondContact O-CD 3.33Å; N1366-K1369 WeakPolarHBondContact O-CE 3.37Å; N1366-K1369 VanDerWaalsContact O-CG 3.29Å; N1366-K1369 WeakPolarHBondContact O-CG 3.01Å; Y1367-K1369 PolarHBondContact O-N 2.88Å; Y1367-K1369 VanDerWaalsContact O-N 3.13Å; K1369-I1372 PolarHBondContact O-N 3.11Å; K1369-A1373 PolarHBondContact O-N 3.04Å
1370H91.9Very high87.5Confident36 Ų3664 Ų6417%0.16730%0.303CS..Hα-helixtrans-71-39.1-179.3-52.1-67.3000111.3G143 A144 Y1367 G1368 I1372 A1373 K1374G143-H1370 PolarHBondContact O-ND1 3.35Å; A144-H1370 PolarHBondContact O-CE1 3.32Å; Y1367-H1370 PolarHBondContact O-CD2 3.18Å; Y1367-H1370 PolarHBondContact O-N 3.12Å; G1368-H1370 VanDerWaalsContact C-N 3.27Å; G1368-H1370 PolarHBondContact O-N 2.95Å; H1370-I1372 VanDerWaalsContact C-N 3.29Å; H1370-I1372 PolarHBondContact O-N 3.45Å; H1370-A1373 PolarHBondContact O-N 3.13Å; H1370-K1374 PolarHBondContact O-N 2.9Å
1371I92.9Very high86.2Confident0 Ų063.8 Ų63.80%031%0.306CS..Hα-helixtrans-60.8-39.5174-48.3-57.3000111.2M1327 N1333 V1336 Q1337 L1340 I1355 G1368 K1374 L1375M1327-I1371 HydrophobicContact CB-CG1 4.03Å; M1327-I1371 HydrophobicContact CG-CD1 4.3Å; M1327-I1371 HydrophobicContact CG-CG1 3.94Å; M1327-I1371 HydrophobicContact CG-CG2 4.48Å; M1327-I1371 HydrophobicContact SD-CB 4.43Å; M1327-I1371 HydrophobicContact SD-CG1 4.22Å; M1327-I1371 HydrophobicContact SD-CG2 3.7Å; N1333-I1371 HydrophobicContact CB-CD1 3.98Å; N1333-I1371 VanDerWaalsContact O-CD1 3.31Å; N1333-I1371 WeakPolarHBondContact O-CD1 3.08Å; V1336-I1371 HydrophobicContact CB-CD1 4.28Å; V1336-I1371 HydrophobicContact CG1-CD1 4.32Å; Q1337-I1371 HydrophobicContact CG-CD1 3.71Å; L1340-I1371 HydrophobicContact CD1-CG2 4.36Å; I1355-I1371 HydrophobicContact CG2-CG2 4.16Å; G1368-I1371 PolarHBondContact O-N 2.87Å; I1371-K1374 WeakPolarHBondContact O-CA 3.42Å; I1371-K1374 VanDerWaalsContact O-CB 3.27Å; I1371-K1374 WeakPolarHBondContact O-CB 3.33Å; I1371-K1374 PolarHBondContact O-N 2.84Å; I1371-K1374 VanDerWaalsContact O-N 3.13Å; I1371-L1375 HydrophobicContact CG2-CD1 4.26Å; I1371-L1375 HydrophobicContact CG2-CG 4.43Å; I1371-L1375 WeakPolarHBondContact O-CG 3.34Å; I1371-L1375 PolarHBondContact O-N 3.04Å
1372I91.4Very high84.6Confident11 Ų1163.4 Ų63.46%0.05631%0.31CS..Hα-helixtrans-63.3-45.9177.4-63.1170.2000110.3Q1359 L1362 R1363 G1368 K1369 H1370 K1374 L1375 E1376Q1359-I1372 HydrophobicContact CG-CG1 4.48Å; L1362-I1372 HydrophobicContact CB-CD1 3.94Å; L1362-I1372 HydrophobicContact CB-CG1 4.26Å; R1363-I1372 HydrophobicContact CB-CD1 4.3Å; R1363-I1372 HydrophobicContact CG-CD1 3.45Å; R1363-I1372 VanDerWaalsContact CG-CD1 3.45Å; G1368-I1372 PolarHBondContact O-N 2.88Å; K1369-I1372 PolarHBondContact O-N 3.11Å; H1370-I1372 VanDerWaalsContact C-N 3.29Å; H1370-I1372 PolarHBondContact O-N 3.45Å; I1372-K1374 PolarHBondContact O-N 3.2Å; I1372-L1375 VanDerWaalsContact O-N 3.1Å; I1372-L1375 PolarHBondContact O-N 2.85Å; I1372-E1376 HydrophobicContact CG2-CG 4.45Å; I1372-E1376 WeakPolarHBondContact CG2-OE1 3.28Å; I1372-E1376 WeakPolarHBondContact O-CG 3.34Å; I1372-E1376 PolarHBondContact O-N 3.26Å
1373A91.3Very high82.6Confident28 Ų2865.4 Ų65.423%0.23133%0.331CS..Hα-helixtrans-62.7-25.8174.100000113.4K1369 H1370K1369-A1373 PolarHBondContact O-N 3.04Å; H1370-A1373 PolarHBondContact O-N 3.13Å
1374K90.2Very high80.5Confident3 Ų364.5 Ų64.51%0.01334%0.336CS..Hα-helixtrans-68.7-48.2169.8-168.166.6170.4-172.70111.6W140 Q1337 L1340 E1341 H1370 I1371 I1372 K1377 Y1378W140-K1374 HydrophobicContact CE3-CD 3.93Å; W140-K1374 HydrophobicContact CH2-CD 3.36Å; W140-K1374 HydrophobicContact CZ2-CD 4.15Å; W140-K1374 HydrophobicContact CZ3-CD 3.26Å; Q1337-K1374 HydrophobicContact CG-CB 4.3Å; Q1337-K1374 HydrophobicContact CG-CD 4.38Å; Q1337-K1374 HydrophobicContact CG-CG 4.16Å; L1340-K1374 HydrophobicContact CB-CG 4.38Å; L1340-K1374 HydrophobicContact CD1-CG 3.99Å; E1341-K1374 VanDerWaalsContact CG-NZ 3.28Å; E1341-K1374 WeakPolarHBondContact OE1-CE 3.5Å; E1341-K1374 IonicContact OE1-NZ 2.96Å; E1341-K1374 PolarHBondContact OE1-NZ 2.68Å; H1370-K1374 PolarHBondContact O-N 2.9Å; I1371-K1374 WeakPolarHBondContact O-CA 3.42Å; I1371-K1374 VanDerWaalsContact O-CB 3.27Å; I1371-K1374 WeakPolarHBondContact O-CB 3.33Å; I1371-K1374 PolarHBondContact O-N 2.84Å; I1371-K1374 VanDerWaalsContact O-N 3.13Å; I1372-K1374 PolarHBondContact O-N 3.2Å; K1374-K1377 PolarHBondContact O-N 3.45Å; K1374-Y1378 HydrophobicContact CG-CE2 4.22Å; K1374-Y1378 WeakPolarHBondContact O-CD2 3.32Å
1375L89.7Confident78.5Confident1 Ų162.3 Ų62.31%0.00533%0.333CS..Hα-helixtrans-67.2-36-178.1-66.7169.5000113.4L1340 I1352 I1355 Q1359 I1371 I1372 K1377 Y1378 N1379L1340-L1375 HydrophobicContact CD1-CD2 4.18Å; L1340-L1375 HydrophobicContact CD2-CD2 4.38Å; I1352-L1375 HydrophobicContact CB-CD2 4.49Å; I1352-L1375 HydrophobicContact CG1-CD2 3.84Å; I1355-L1375 HydrophobicContact CB-CD1 4.16Å; I1355-L1375 HydrophobicContact CG2-CD1 3.58Å; Q1359-L1375 HydrophobicContact CG-CD1 4.38Å; I1371-L1375 HydrophobicContact CG2-CD1 4.26Å; I1371-L1375 HydrophobicContact CG2-CG 4.43Å; I1371-L1375 WeakPolarHBondContact O-CG 3.34Å; I1371-L1375 PolarHBondContact O-N 3.04Å; I1372-L1375 VanDerWaalsContact O-N 3.1Å; I1372-L1375 PolarHBondContact O-N 2.85Å; L1375-K1377 PolarHBondContact O-N 3.35Å; L1375-Y1378 PolarHBondContact O-N 2.86Å; L1375-Y1378 VanDerWaalsContact O-N 3.08Å; L1375-N1379 PolarHBondContact O-N 3.39Å
1376E88.5Confident76.3Confident97 Ų9765.3 Ų65.345%0.45335%0.353SS..Hα-helixtrans-57.4-37.8179.2-76.8170.6178.600111.8I1372 Y1378 N1379 N1380I1372-E1376 HydrophobicContact CG2-CG 4.45Å; I1372-E1376 WeakPolarHBondContact CG2-OE1 3.28Å; I1372-E1376 WeakPolarHBondContact O-CG 3.34Å; I1372-E1376 PolarHBondContact O-N 3.26Å; E1376-Y1378 PolarHBondContact O-N 2.96Å; E1376-N1379 PolarHBondContact O-N 3Å; E1376-N1380 PolarHBondContact O-OD1 2.87Å; E1376-N1380 PolarHBondContact O-N 3.17Å
1377K87.1Confident74.1Confident109 Ų10965.3 Ų65.347%0.47436%0.357SS..Hα-helixtrans-66.7-35176.4-58.9-170.8-164.7175.90112.9W140 K1374 L1375W140-K1377 HydrophobicContact CH2-CD 3.59Å; W140-K1377 VanDerWaalsContact CH2-CE 3.49Å; W140-K1377 HydrophobicContact CZ2-CD 3.62Å; K1374-K1377 PolarHBondContact O-N 3.45Å; L1375-K1377 PolarHBondContact O-N 3.35Å
1378Y82.5Confident71.7Confident60 Ų6067.3 Ų67.324%0.23538%0.378CS..Hα-helixtrans-74.3-33.3175-67.4-64.5000113.1L1340 I1352 K1374 L1375 E1376 N1380 A1382L1340-Y1378 HydrophobicContact CB-CE2 4.23Å; L1340-Y1378 PolarHBondContact O-OH 2.86Å; I1352-Y1378 HydrophobicContact CD1-CD2 4.35Å; I1352-Y1378 HydrophobicContact CD1-CG 4.13Å; K1374-Y1378 HydrophobicContact CG-CE2 4.22Å; K1374-Y1378 WeakPolarHBondContact O-CD2 3.32Å; L1375-Y1378 PolarHBondContact O-N 2.86Å; L1375-Y1378 VanDerWaalsContact O-N 3.08Å; E1376-Y1378 PolarHBondContact O-N 2.96Å; Y1378-N1380 VanDerWaalsContact C-N 3.34Å; Y1378-A1382 PolarHBondContact O-N 3.42Å
1379N73.7Confident69.3Low50 Ų5070.7 Ų70.727%0.26741%0.413SS..Hα-helixtrans-63.5-40.4174.9-73.6-22.2000111.8R1356 L1375 E1376 V1381 A1382 G1383R1356-N1379 PolarHBondContact NH2-OD1 2.92Å; L1375-N1379 PolarHBondContact O-N 3.39Å; E1376-N1379 PolarHBondContact O-N 3Å; N1379-V1381 VanDerWaalsContact C-N 3.32Å; N1379-V1381 PolarHBondContact O-N 2.8Å; N1379-A1382 PolarHBondContact O-N 3.43Å; N1379-G1383 PolarHBondContact O-N 2.73Å; N1379-G1383 VanDerWaalsContact O-N 3.15Å
1380N61.3Low67Low119 Ų11977.4 Ų77.464%0.63644%0.442SS*.Hα-helixtrans-65.3-33.5-178-67.4-5000112.9E1376 Y1378 G1383E1376-N1380 PolarHBondContact O-OD1 2.87Å; E1376-N1380 PolarHBondContact O-N 3.17Å; Y1378-N1380 VanDerWaalsContact C-N 3.34Å; N1380-G1383 PolarHBondContact O-N 2.85Å
1381V59.1Low64.4Low105 Ų10581.7 Ų81.764%0.63648%0.476SS*.Hα-helixtrans-69.1-36.7175.3179.30000111.7N1379N1379-V1381 VanDerWaalsContact C-N 3.32Å; N1379-V1381 PolarHBondContact O-N 2.8Å
1382A53.7Low61.7Low59 Ų5987.2 Ų87.249%0.48852%0.515SS..Hα-helixtrans-76.4-19.5178.700000114.1Y1378 N1379Y1378-A1382 PolarHBondContact O-N 3.42Å; N1379-A1382 PolarHBondContact O-N 3.43Å
1383G46.3Very low59.2Low42 Ų4292.5 Ų92.543%0.43355%0.553SS.*Hα-helixtrans-75.6-43.5-177.700000114.2N1379 N1380 N1385N1379-G1383 PolarHBondContact O-N 2.73Å; N1379-G1383 VanDerWaalsContact O-N 3.15Å; N1380-G1383 PolarHBondContact O-N 2.85Å; G1383-N1385 VanDerWaalsContact C-N 3.32Å; G1383-N1385 PolarHBondContact O-N 2.81Å
1384N45.8Very low56.7Low127 Ų12796.2 Ų96.268%0.67958%0.584SS**G310 helixtrans-72.4-19.4-171.8-85.613.3000114.7N1386 T1387N1384-N1386 VanDerWaalsContact C-N 3.33Å; N1384-N1386 PolarHBondContact O-N 2.93Å; N1384-T1387 PolarHBondContact O-OG1 2.87Å
1385N47.3Very low54.3Low128 Ų128103 Ų10368%0.68462%0.62SS**G310 helixtrans-87.74.2-175.6-68.612.5000114G1383G1383-N1385 VanDerWaalsContact C-N 3.32Å; G1383-N1385 PolarHBondContact O-N 2.81Å
1386N44.7Very low51.8Low140 Ų140109.8 Ų109.875%0.74966%0.656SS**G310 helixtrans-114.34.8-176-86.7-55.3000114.8N1384N1384-N1386 VanDerWaalsContact C-N 3.33Å; N1384-N1386 PolarHBondContact O-N 2.93Å
1387T46Very low49.5Very low117 Ų117111.3 Ų111.372%0.71867%0.667SS**SBendtrans-105.6-5.9-176.742.30000115N1384N1384-T1387 PolarHBondContact O-OG1 2.87Å
1388T41.7Very low47.2Very low126 Ų126114 Ų11477%0.77369%0.687SS**SBendtrans-96.9-9.4178.3460000114.4K1390T1388-K1390 PolarHBondContact O-N 3.05Å
1389G39.9Very low45.2Very low71 Ų71118.7 Ų118.773%0.73272%0.716SS**SBendtrans-87.717.9-170.800000117.5
1390K41.8Very low43.5Very low197 Ų197123.5 Ų123.586%0.85774%0.742SS**SBendtrans-145.175-176.1-73.5-172176.9178.70114.4T1388T1388-K1390 PolarHBondContact O-N 3.05Å
1391S37Very low42.4Very low125 Ų125125.3 Ų125.387%0.87475%0.752SS**  trans-17679.5150-83.60000112.2
1392S36.7Very low41.4Very low117 Ų117126.9 Ų126.982%0.81876%0.757SS**  trans-15761.8172.357.60000112.4
1393S39.8Very low40.8Very low122 Ų122130.5 Ų130.585%0.85377%0.768SS**SBendtrans-154.8143.9165.1-83.60000110.8
1394A38.5Very low40.4Very low106 Ų106134.3 Ų134.388%0.87678%0.778SS**SBendtrans56.172.3174.900000116.5
1395N38.5Very low40Very low146 Ų146134.8 Ų134.878%0.78178%0.781SS**  -159.2120.6109.3-150.3-7.6000112.7
1396N37.8Very low39.4Very low142 Ų142133.9 Ų133.976%0.75978%0.78SS**  trans-157.2104.5141.6-141.4-10.9000111.5
1397N40.3Very low38.8Very low129 Ų129132.5 Ų132.569%0.6978%0.776SS**  trans20104145.5-58-51.1000118
1398N39.4Very low38.1Very low165 Ų165133 Ų13388%0.88278%0.775SS**  trans-116.1106.8148.3-129.7-13.9000106.9
1399N39.2Very low37.7Very low160 Ų160132.3 Ų132.386%0.85677%0.767SS**  trans-153.8102.7173.9-132.6-6.3000109.7
1400N38.6Very low37.4Very low151 Ų151134.2 Ų134.281%0.80776%0.76SS**  trans-141.274.1-177.8-15813.1000110.4
1401N39.1Very low37Very low157 Ų157130.5 Ų130.584%0.8475%0.749SS**  trans-162.7130.8149.3-107.8-35.5000111.6
1402N38Very low36.9Very low138 Ų138129.6 Ų129.674%0.73874%0.739SS**  trans-74.4148.7167.1-59.4-52.1000109.3
1403N39.6Very low36.7Very low135 Ų135129.8 Ų129.872%0.72273%0.731SS**  -177138.1102.6-95.2-35.5000114.3
1404N39.4Very low36.4Very low122 Ų122130.1 Ų130.165%0.65272%0.722SS**  trans52.8110.5136.2-58.5-18.9000119.8
1405N37.1Very low36.2Very low137 Ų137130 Ų13073%0.73371%0.714SS**  100.1140.4114-82.6-9.6000120.3
1406T34.6Very low36Very low108 Ų108128 Ų12866%0.66371%0.707SS**  trans62.596.5146.750.10000117.8
1407T32.7Very low35.8Very low111 Ų111125.6 Ų125.668%0.68170%0.702SS**  71.3143.6120.163.70000118.9
1408N31.1Very low35.5Very low129 Ų129125.9 Ų125.969%0.6970%0.703SS**  trans67.6129.9136.9-67.73.1000116.9
1409N33.2Very low35.2Very low111 Ų111124.2 Ų124.259%0.59469%0.694SS**  cis-167.2-177.25.4-127.1-14.9000110.7
1410N34.1Very low34.9Very low111 Ų111120.4 Ų120.459%0.59468%0.68SS**  trans31135134-57-13.8000119
1411N33.2Very low34.6Very low118 Ų118117.4 Ų117.463%0.63167%0.671SS**  cis-179.6-156.62.5-108.1-21.5000105.3
1412T33.9Very low34.3Very low106 Ų106115.5 Ų115.565%0.6567%0.666SS**  trans56.9118.5131.351.70000117.1
1413N33.1Very low34.1Very low122 Ų122114.7 Ų114.765%0.65266%0.661SS**  cis-159.9156.920.9-115.1-1.9000111
1414L33.6Very low34Very low129 Ų129116.2 Ų116.268%0.67566%0.664SS**  42.4133.7100.9-88.165.7000113.5V1416L1414-V1416 HydrophobicContact CG-CG2 4.15Å
1415S34.4Very low33.8Very low102 Ų102116 Ų11671%0.71367%0.666SS**  cis-135.3138.729.4-59.90000110.5
1416V33.7Very low33.6Very low104 Ų104113.4 Ų113.463%0.6366%0.659SS**  53.280.468.8-178.80000109L1414L1414-V1416 HydrophobicContact CG-CG2 4.15Å
1417S33.4Very low33.4Very low92 Ų92116.8 Ų116.864%0.64367%0.665SS**  85.6162.787.3-67.50000112.3
1418N33.8Very low33.3Very low135 Ų135117.4 Ų117.472%0.72267%0.668SS**  trans73141.2160.3-59.6-15.2000115.4
1419N32.9Very low33.3Very low130 Ų130115.5 Ų115.570%0.69567%0.665SS**  cis-152162.8-0.6-135.9-13000113.9
1420S33.4Very low33.3Very low80 Ų80117 Ų11756%0.55967%0.673SS**  trans17.1137.2137.973.60000117.9
1421S32.8Very low33.3Very low89 Ų89118.3 Ų118.362%0.62268%0.68SS**  178.4144.265.9-93.10000111.9
1422T33.5Very low33.5Very low117 Ų117117.3 Ų117.372%0.71868%0.682SS**  trans62165.1141.263.60000118.3
1423N33.4Very low33.5Very low120 Ų120118.4 Ų118.464%0.64268%0.684SS**  cis-164.1174.2-26.4-100.6-7.1000105.7
1424H37.1Very low33.5Very low168 Ų168118.4 Ų118.478%0.77868%0.684SS**  trans65.5170.5150.4-73.1-48.3000116.8
1425V35.7Very low33.6Very low116 Ų116118.3 Ų118.370%0.70369%0.685SS**  cis-156.5174-49.882.40000107.8
1426S31.7Very low33.4Very low84 Ų84120.9 Ų120.959%0.58769%0.69SS**  trans-10148.9161-52.30000121.1
1427K30.8Very low33.5Very low179 Ų179118.9 Ų118.978%0.77869%0.69SS**  trans70.4130.5136.7-75.9168.1-179-178.40119.8
1428T30.4Very low33.5Very low123 Ų123121.3 Ų121.376%0.75570%0.702SS**  trans65.9155136.957.90000120.7
1429S32.2Very low33.6Very low90 Ų90118.4 Ų118.463%0.62970%0.703SS**  trans68.1109.5148.3-69.80000119.6
1430N33.1Very low33.6Very low143 Ų143118.7 Ų118.777%0.76571%0.705SS**  70.3144.6117.9-58.5-3.5000120.9
1431N33.2Very low33.6Very low137 Ų137120.7 Ų120.773%0.73371%0.709SS**  trans69.2114.7162.5-67.9-6.9000116.1
1432S37.8Very low33.5Very low97 Ų97123.9 Ų123.968%0.67872%0.72SS**  67.912853.7-54.50000112.2
1433N33.6Very low33.6Very low130 Ų130122 Ų12270%0.69572%0.723SS**  -156.1141.4100.1-103.3-8.3000112.7
1434N34.2Very low33.6Very low122 Ų122119.5 Ų119.565%0.65273%0.726SS**  trans65.4134.3146.8-56.5-7.5000118.5
1435N35.3Very low33.2Very low127 Ų127117 Ų11768%0.67973%0.726SS**  cis-142.4138.2-8.4-94.8-31.8000108.2
1436N29.6Very low33.1Very low156 Ų156118.5 Ų118.583%0.83473%0.73SS**  72.8107.962.3-144.17.4000111.4
1437G36.5Very low33.1Very low61 Ų61120.6 Ų120.663%0.62973%0.734SS**  trans14985-173.400000111.1
1438T33.3Very low33.3Very low144 Ų144117 Ų11788%0.88373%0.728SS**  61.4125.777.671.30000114.7
1439G34.6Very low33.5Very low73 Ų73117.6 Ų117.675%0.75373%0.726SS**  trans112.999-178.100000110.9
1440N33Very low33.6Very low137 Ų137119.4 Ų119.473%0.73373%0.729SS**  cis75.912031.9-161.739.7000115
1441N32.9Very low34Very low121 Ų121116.7 Ų116.765%0.64772%0.721SS**  trans64.3131.5158.3-75.8-17.7000122.2
1442N32Very low34.3Very low157 Ų157115.8 Ų115.884%0.8472%0.717SS**  27.1132.9128.9-59.7-17.6000120.8
1443G34.8Very low34.3Very low77 Ų77118.3 Ų118.379%0.79472%0.722SS**  trans142.1147.2133.300000115.7
1444G33.8Very low34.5Very low68 Ų68116.1 Ų116.170%0.70173%0.731SS**  trans81.8108.7177.200000112.4
1445C29.6Very low34.6Very low114 Ų114114.3 Ų114.377%0.7774%0.74SS**  cis54.188.619.7-490000113.2
1446N32.3Very low34.7Very low149 Ų149115.1 Ų115.180%0.79775%0.75SS**  177120.999.7-92.2-23.8000114.4
1447N32Very low35.3Very low127 Ų127113.7 Ų113.768%0.67975%0.749SS**  67.5154.3107.7-153.611.5000120.1
1448T34.1Very low35.3Very low104 Ų104115.7 Ų115.764%0.63876%0.76SS**  trans65.5138.1165.363.70000118.3
1449N35.1Very low35.3Very low135 Ų135113.4 Ų113.472%0.72276%0.756SS**  cis-162.1156.2-7.7-120.1-12.1000112.4
1450N35.4Very low35.4Very low129 Ų129115.9 Ų115.969%0.6976%0.761SS**  trans46.1130134.4-133.623.9000118.5
1451S41.1Very low35.5Very low86 Ų86118.9 Ų118.960%0.60177%0.768SS**  cis-168.2140.949.1-153.70000115.9
1452N39Very low35.6Very low118 Ų118119.1 Ų119.163%0.63178%0.779SS**  trans58110.7140.4-69.6-6.9000123.7
1453N38.5Very low35.7Very low149 Ų149116.8 Ų116.880%0.79778%0.782SS**  68.3113.2115.3-57.9-13.8000121.6
1454G36.4Very low35.7Very low85 Ų85116.3 Ų116.388%0.87678%0.777SS**  121.713789.500000117
1455G36.2Very low35.9Very low83 Ų83118.7 Ų118.786%0.85678%0.783SS**  trans144.288.917200000114.2
1456T38Very low36Very low145 Ų145120.6 Ų120.689%0.8979%0.785SS**  trans-87.6163.9171.727.70000112.2
1457P42.5Very low36.3Very low125 Ų125119.4 Ų119.481%0.81279%0.788SS**  trans-95.8162-161.737.7-37.3000114.9
1458A35.9Very low36.4Very low104 Ų104121.9 Ų121.986%0.8680%0.796SS**  trans-160163.3155.800000112.4
1459A34.9Very low36.6Very low95 Ų95121.7 Ų121.779%0.78580%0.799SS**  trans-75.4166.4-177.400000114.9
1460S36.2Very low36.8Very low125 Ų125123.2 Ų123.287%0.87481%0.807SS**  -170.5164.9127.141.80000113.2
1461K34.2Very low37Very low200 Ų200121 Ų12187%0.8781%0.814SS**  trans-90.8154.5179-49.4165.4-177174.10110.2
1462S35Very low36.7Very low127 Ų127125 Ų12589%0.88883%0.825SS**  177.3163125.539.40000111.8
1463A34Very low36.7Very low108 Ų108124.8 Ų124.889%0.89383%0.829SS**  trans-98.3160.1-18000000111.8
1464G35.5Very low36.5Very low66 Ų66123.4 Ų123.468%0.6883%0.826SS**  trans-161.8108.2178.500000115.3
1465S37.2Very low36.4Very low119 Ų119128.1 Ų128.183%0.83283%0.83SS**  trans49.9118.2147.254.20000121.6
1466N31.9Very low36.4Very low153 Ų153132 Ų13282%0.81883%0.826SS**  trans-48.9158.8156-49.3-13.6000113.5
1467S38Very low36.3Very low124 Ų124133.2 Ų133.287%0.86782%0.821SS**  trans-150.9139.3138.632.50000110.6
1468E34.8Very low35.8Very low180 Ų180134 Ų13484%0.84182%0.819SS**  trans-94.3160.7-178.2-59.3147.8110.400110.8
1469S39.2Very low35.6Very low100 Ų100136.5 Ų136.570%0.69982%0.818SS**  167.8133.9113.248.10000115.8
1470N39.7Very low35.5Very low167 Ų167137.3 Ų137.389%0.89382%0.818SS**  trans60.3131.9138.2-55.9-16.7000122.9
1471G38Very low35.3Very low81 Ų81136.2 Ų136.284%0.83581%0.81SS**  trans117.6115147.800000117.8
1472M36.5Very low35.2Very low170 Ų170132 Ų13284%0.83780%0.802SS**  cis-176.2161-41.9177.1163.3-171.200107.9
1473T37.7Very low35Very low114 Ų114132.8 Ų132.870%0.69980%0.796SS**  trans65.9104.7167.936.40000120.9
1474T35.6Very low34.9Very low121 Ų121132.9 Ų132.974%0.74279%0.785SS**  72.394.5122.2-39.90000120.7
1475L33.8Very low34.8Very low183 Ų183135.7 Ų135.796%0.95879%0.789SS**  trans-127.3159.9137.6-88.6171.1000109
1476Q36Very low34.4Very low164 Ų164134.9 Ų134.977%0.76679%0.79SS**  trans-136.8158.4-163.8-165.617816.600110.8
1477Q35.2Very low34.5Very low171 Ų171133.2 Ų133.280%0.79979%0.785SS**  trans75.398.8-176.5-52.6173.1-7.700111.4
1478N32.9Very low34.3Very low143 Ų143133.2 Ų133.277%0.76578%0.781SS**  67.598.260.2-59.822.4000112.5
1479D30.5Very low34.3Very low155 Ų155130.1 Ų130.183%0.82977%0.774SS**  -173.8110.993.5-90.3-19.4000110.9
1480S34.4Very low34Very low112 Ų112130.8 Ų130.878%0.78377%0.774SS**  trans-142.4119.8-175.2-62.10000113.6
1481S31.7Very low33.7Very low102 Ų102131.4 Ų131.471%0.71377%0.771SS**  trans53.8118.9138.565.80000121.6
1482T30.7Very low33.4Very low113 Ų113136.8 Ų136.869%0.69377%0.771SS**  trans58.4109.3133.261.40000120.2
1483N32Very low33.2Very low143 Ų143133.7 Ų133.777%0.76577%0.766SS**  -164.8136.192.4-92.8-49.6000109.6
1484T30.9Very low33Very low109 Ų109133.7 Ų133.767%0.66977%0.771SS**  64.895.562.5-40.30000113.1
1485T33.8Very low32.8Very low125 Ų125135.2 Ų135.277%0.76778%0.775SS**  trans171.4104.9130.1-68.60000107.9
1486A29.7Very low32.8Very low103 Ų103132.1 Ų132.185%0.85176%0.759SS**  trans-113.3122.2172.600000109.2
1487T34.2Very low32.7Very low117 Ų117132.1 Ų132.172%0.71876%0.757SS**  trans-152155.3-175.814.70000112
1488T32.4Very low32.6Very low125 Ų125128 Ų12877%0.76775%0.752SS**  trans85.785.3166.1-22.90000117.7
1489T34.6Very low32.5Very low115 Ų115127.7 Ų127.771%0.70675%0.75SS**  32.1120.5122.7-12.20000120.6
1490T33.7Very low32.6Very low113 Ų113128.2 Ų128.269%0.69375%0.747SS**  trans66.1126.3143.644.50000122.4
1491H33.1Very low32.5Very low180 Ų180134 Ų13483%0.83375%0.752SS**  trans56.1100.4151.4-65.9-66.7000119.9
1492K32.8Very low32.6Very low194 Ų194139.1 Ų139.184%0.84378%0.779SS**  -152.1145.3118.8-119.8168.3-174.2174.50113.2
1493S30.7Very low32.7Very low105 Ų105140.4 Ų140.473%0.73478%0.783SS**  trans-72.3148.9166.1530000111
1494S33.7Very low32.7Very low114 Ų114140.3 Ų140.380%0.79778%0.784SS**  -170.9148.9111.2-93.40000111.3
1495N32.1Very low32.8Very low153 Ų153142 Ų14282%0.81879%0.791SS**  trans-59.3154.4164.8-53-22.1000109.6
1496D33.3Very low32.8Very low118 Ų118143 Ų14363%0.63179%0.792SS**  -160.9153.8100.6-126.1-26000115.1
1497K34.6Very low33Very low165 Ų165145.5 Ų145.572%0.71779%0.788SS**  trans33.3111.6162.2-67.2130.7-166.51600119
1498A33.4Very low32.9Very low84 Ų84147.4 Ų147.469%0.69479%0.793SS**  82.314355.100000115.5
1499N30.8Very low32.9Very low136 Ų136149 Ų14973%0.72780%0.795SS**  trans44.596.4155-57.9-3.6000118.2
1500H33Very low32.8Very low166 Ų166151.6 Ų151.677%0.76980%0.802SS**  169.9132.494.9-89.2-63.6000112.1
1501R31.8Very low32.7Very low235 Ų235154.8 Ų154.889%0.88781%0.811SS**  trans56.8121.1159-58.7172.6177.6172.5-1.8115.6
1502T33.1Very low32.7Very low208 Ų208152.5 Ų152.5100%1.27681%0.809SS**  cis-136.702148.20000111.3

Retrieved 1,502 of 1,502 residues in 1388 ms (Link to these results)