A0A5K4FEL3_SCHMA Loading...

Fmp27_GFWDK domain-containing protein AlphaSync Fragmented

AlphaFold DB , UniProt , Accession A0A5K4FEL3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 3,756 aa.

						>A0A5K4FEL3_SCHMA|A0A5K4FEL3
MSWECFDCVKDIICTQWALVALVILLFAVYVTPKVLVFVLSSFLSKFIPCILTVQRFGFIWARGVTITFINGECMYVDSIYLSSSLWNPKAKTLLSAWITGVEFHATDTGLYAIIKVMQRKGDGIRTHLNKGFMSWKIRLISFISIDISSIQIVVLSTKFLDDALYSNYKKAEDGALNNTNSNSSVCHHCLIHINDLSDVYPPIQFNRQTSFRLNKTSKLALTLRMTKLTMLFHISMRQAHVNLHLSHICGKLLCIPVFMETWLSNDLFVKNWNVIFENAYILGHLRLQLSTNISLECRNFNNATLSSLNGWFVKSVDLKLCGLRIAILEELMDLLSWKLYINQTCILTTQTSSFESTCSHCHQSTIHHQEDTLQMLEHSSFPFKNNKSCYLKQTSGNIISHNSLKPNFQCVQECLNSIKLCISFVPMQLFNFNHNHHFEQTQLQFSSSSSSLPSSVVPEMGFYFEIIRYSFERSLQFYFTSSHLSMEFNVPNSIKCSENDETLQTTSDFYTSLHSLSLPISQIIPSNLLNDNVDSKILFSHFILLNFRFCLNDLRLLNGWNSQAQHCLLDARIYLIEATEQLESSICNIYLNILHSSIFYIHDNIIEMNFYKKLSSICYLIGIWCKTLYDNSNCINNQSIMPITNIELFNCPKKNINSKQFNLMTQESLSRRKFFRFIEYLGLNTRQLNVRIYFGNVGGSRTSVRNNNINTSCTSITRHNEEFGASDSTVSDDNSGGGVIITHCKSVNCTDDFNTEQQYPDHIQIGMMERLKSRKIPQILFVLIPDLKSPGLQFGFTNSLVNLQFDFHELNLKKSFDLLNLTDLNLKLSNIHVCLLDKIHGSIFNESHTSQAPSLSLPHSYSLYSIRCNQSNAIYSLIHELPTLNNHHWDDLFYVHGIDIWNHKYQISLKFTTLQIEWPSFKMNELMNYIHWDYSNENVYQCYNNHINKLSTNRSSSIQCYFMENYLNNPIQFDGFLENINIFLINTFIMLRIDSQRFIAQFRSINPIYQPLKLDSLSQITITGAKLVYSYIKKLDNGADTVSCCSSTSSASVSSNSSPCPYAIVSSCDIKNDLVLSLTEIHVDVKLPDQVRLFFKCLILHCLLFKLSLERSIEISPNNQSCEFIWSLGFHLCCYNLLRSWKQFHGKLFKQSSTVSLNNSSNTCDPFLVPTINNTTTNDTIELNSSNGWHLSIKPIQSYFQFYFKLLTNKHFIMVRVKNTSFQYTPKTITTTDNKISSSNDRKNREVLLTNNTNMNDDNNKNNIGCIVSSRLKVNCEHAVIMCEDQTIAVFQNLKIRQRPENIQHRTEHLKMGLLTRANPSWEFYMDLLYVTFPYRYIFRDVYQEASCVRKFLLKLHSDNITYFHVNDQTFDQSKKSSLPNEDVTLSNPTSPTSIQSSPSTFGVYSSSTARIDYIQPSTSYIKQDRIIHIKKFIIEIKDDPFECKLNDIHTILLDEFAVHEKRVNTLREQIDRAIHSGIRVTDEERQACFTRIEIQRAQDYRNRLHRFYCDYAFSDELFTFTMDNLKIKALADESITHGEQVIAQMKIMDSDSPWPNLTEQDFSTLWCRIITMNVERWRLQLRDYPKPCLNITDLFLWGKLVIAEQMADNKGQHKVVIKPGYPWPNYTLIRFSSPTKFYYDLNADLKSFHIYYGANWEPTVSWFNQRLDDIKPLIKDKSYPPLGWWDKIRLLYHGHLLFAVDTMHWSYSTSLSPYNATEFFTWQWNRTVVHWENGVIRIDGDLDIVYQTASKYDGICQLFHIPHLEMTVKLDWLSLRDPNDHHSVKYCYMDYLSPREQTQHDSFKYFRANRLAMGINFTVKPPPTGSSTMDQRPWCSFYTSVLKFADKLRNCLSQIPRPIRRGSLYKYKPPRKPHFGRLLQSLEFSINIPQLELIFWVSYAKRTGVHVNTGPIQIIGKLKCKIENEIKLNRLIGKFSASSASSSSTTVIVSGSESTPLETTTTTNLNEQTTILHPYVMIPPRLSIQRNGLSRRPIVNWCVLNLYASIHDIAIHLRHRDNLPGPLIQMLLQCMNTYQNCTNDISNNHQLNHHNFSIHDIEQLDTEEMNNDIEAFILVPLLRYQQLCPTVLPSNTTVRVHIPGPRPTAVTSVTTSTTNTNTNENSNICNNNSGNTNLSPSSIKCHPIESIKNNTSINSTSTITENISADVTSTSQVVDEETLPFSDYNNNNRTTYNNINHIQTPRYNYTATSCSSNSQLTHEDLTPVHHLEIHEFKMRWTEQHRNLVYILMDSYRHAQSLKKNLSARALHGFRLHPGGNGSSSGHTTTMTSGGGVSGAVGSFGIGKLGVCSSSSSGGGGTALSRNARSAIQLTNNVINNNGCILLNSTDKRPLSTVIQPSDSCNLSKLTKSNYNDNCFLMKMPTTDEMLPDNINMPSNTVTMVTATTTATTINNNNNSEMKEDNYDDVYLSTNLSPSSESNKSKLTFSKQIPMLAQLLEEVDTARFYAYCEEEPKQTDVVSQLQGLHICASSLVAERNWHLELINPQLMLKTNHLAGYVLVSAARAKLDALTHPPIWKDSQLLNKSSLVGHLECMQYYATVGQVSNLDCDSESGSVFIYLFNVLPETPDQWLSTADVSDWTHHNLNADEDALSGRPEVVGCGRSVGGVVTACVCFPKTPSNNNNISNNKNPLTRTSTLTFGTKLMSNDMTLRNNVTLTSTMVTTTPTTTTVTSSTSELHSNYIRPIQLQRMISRCSCEVFYIHYEPADPANLPLPHLIPPLSLDETEVVRNPEGADTVTLLHHTLNVSTNSLQYHMIVEIVNDLLLYVEPQRKVAKLERNRLTFGLMSESQVRLAISRDQETLRRLIFEQRQLERYLWSYVRQTMQELGLDANNTLVNHSHPSAFYHSPTTDSSNNVTSRTSDLTLKLVNCIQSARKLETQINQLKSHIIDLNGILSQRLGHYQQLQIQIQRRHIRKAMSFKRYHPMNKSSASSSLLSFNNEILSSITNSNNVSLIQKSSNDDCNRIIQTNNNESETYIQNRINSHSTSSTDHLTHPNTKTMSNNNTGQNHLITENIISESGNKSLSLSSFMDGGDSKPAEIVRRSEVCFEHARWRMTENDGQIGLADVELRGFIYTKTHRQDDSGSHRLELGWIRVCSLAPNSFYREVLAPDVSGGRYAGGPILRIACSDLAPVGGISVKEAMEISVAPIVLQMSKQFYRIMMPFFFPEKSEDTTTNNTITATPVHTATIANPTGDCISSSAFTSHPFSIPQDSVGISSGTSSNAFHYLDSNLSTNADNPQNIVLPSKSWLRRYLLRKLPHRSKNESESVPSTSSSLPQPLNFIHQSHQSDVLENISSDLSMPIVVSTVATTVTFTSSLSPSSVCIPSNNLTIEAAISGRNYCSVNDDWNALNNNATGSGTEITVASSPSLTSSSVTTSKLLQMMNMRSKLPITDYLRSQNELGFPNLFHTNEYDVKSSSSSSLLSPNHKSNECFAIPVTYSNYNDTTTDNFIMVMQQPTSIYLQQLLPVNNICTYCESIHSTSNNHLHSLNMSLYNPISYGSLPMDQITSVNQIATHHSKHNINNTNIPLNPVDVMQERARQNKVFLYIKIPGFPIRLSYKGEKQKNITDVTRFELFIPTLEYHNCVWTWLDFVMEVKTRIRKQLVREVIKKKLTPRRRLPLLRISGTNSSKNDNNSSIAASSSTDSKPHELTTSNILLSSVKRLSSLTPAVTGGRADSTMHSPDVDDDDDLVDPTTVAAQEEKAQRDLEMILGRHAQIQPNKVGKRKRFKSKPF
					

Structure and PAE viewers are unavailable as this is a multi-fragment structure.

Download 13 Fragment Structures AlphaSync Parameters PDBs Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	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
1	M	35.3	Very low	45.9	Very low	239 Å²	239	144.6 Å²	144.6	100%	1.177	73%	0.733	S	S	*	*				0	119.1	0	-65.8	168.5	78.8	0	0	107
2	S	40.1	Very low	47.2	Very low	92 Å²	92	141.3 Å²	141.3	64%	0.643	72%	0.716	S	S	*	*			cis	156.4	97.1	-9.4	38.3	0	0	0	0	105
3	W	43.7	Very low	48.1	Very low	257 Å²	257	139.2 Å²	139.2	97%	0.973	71%	0.706	S	S	*	*			trans	-146	32.6	169.1	-113.4	43.2	0	0	0	108.7
4	E	32.1	Very low	48.8	Very low	173 Å²	173	135 Å²	135	81%	0.808	70%	0.695	S	S	*	*			trans	-113.5	21.4	-147	-160.6	168.3	-149.3	0	0	113.6
5	C	46.5	Very low	49.9	Very low	110 Å²	110	131.7 Å²	131.7	74%	0.743	68%	0.683	S	S	*	*	S	Bend	trans	-138.6	-0.2	-168.7	-68.2	0	0	0	0	116.9
6	F	51.7	Low	51.2	Low	188 Å²	188	132 Å²	132	83%	0.825	68%	0.681	S	S	*	*	S	Bend	trans	-107.8	-27.6	-176.3	-113	-84	0	0	0	115.7
7	D	47.4	Very low	52.6	Low	106 Å²	106	135.8 Å²	135.8	57%	0.567	68%	0.684	S	S	*	*	H	α-helix	trans	-75.1	-36.5	-178.3	-68.6	-59.7	0	0	0	113.4	V9 K10 D11	D7-V9 PolarHBondContact O-N 3.03Å; D7-K10 WeakPolarHBondContact O-CB 3.44Å; D7-K10 PolarHBondContact O-N 3.36Å; D7-D11 PolarHBondContact O-N 2.95Å
8	C	49.6	Very low	53.6	Low	85 Å²	85	131.4 Å²	131.4	57%	0.574	67%	0.673	S	S	*	*	H	α-helix	trans	-57	-27.6	-175.6	-66.3	0	0	0	0	115.1	I12	C8-I12 WeakPolarHBondContact O-CD1 3.37Å; C8-I12 WeakPolarHBondContact O-CG1 3.27Å
9	V	54.6	Low	54.8	Low	101 Å²	101	130.4 Å²	130.4	61%	0.612	67%	0.668	S	S	*	*	H	α-helix	trans	-76	-30.6	178.9	-177.6	0	0	0	0	111.6	D7	D7-V9 PolarHBondContact O-N 3.03Å
10	K	51.4	Low	56	Low	143 Å²	143	128 Å²	128	62%	0.622	66%	0.66	S	S	*	*	H	α-helix	trans	-70.9	-41.5	178.6	-171.9	180	175.4	-172.6	0	111.2	D7 I12 I13 C14	D7-K10 WeakPolarHBondContact O-CB 3.44Å; D7-K10 PolarHBondContact O-N 3.36Å; K10-I12 PolarHBondContact O-N 3.46Å; K10-I13 PolarHBondContact O-N 2.78Å; K10-C14 PolarHBondContact O-N 3.46Å
11	D	52.7	Low	57	Low	97 Å²	97	124.6 Å²	124.6	52%	0.519	65%	0.651	S	S	.	*	H	α-helix	trans	-67.3	-34.7	-177.9	-68.1	-25.5	0	0	0	113.1	D7 I13 C14 T15	D7-D11 PolarHBondContact O-N 2.95Å; D11-I13 PolarHBondContact O-N 3.11Å; D11-C14 PolarHBondContact O-N 2.92Å; D11-T15 WeakPolarHBondContact O-CB 3.39Å; D11-T15 VanDerWaalsContact O-CG2 3.28Å; D11-T15 WeakPolarHBondContact O-CG2 3.34Å; D11-T15 PolarHBondContact O-N 3.45Å; D11-T15 PolarHBondContact O-OG1 3.25Å
12	I	60.6	Low	59	Low	104 Å²	104	118 Å²	118	53%	0.533	62%	0.619	S	S	.	*	H	α-helix	trans	-65.9	-37.5	179.9	-68	168.4	0	0	0	111.8	C8 K10 T15	C8-I12 WeakPolarHBondContact O-CD1 3.37Å; C8-I12 WeakPolarHBondContact O-CG1 3.27Å; K10-I12 PolarHBondContact O-N 3.46Å; I12-T15 PolarHBondContact O-OG1 3.44Å; I12-T15 VanDerWaalsContact O-OG1 3.11Å
13	I	59.1	Low	60.9	Low	114 Å²	114	117.5 Å²	117.5	59%	0.585	61%	0.613	S	S	*	*	H	α-helix	trans	-76.8	-37.7	179	-61.7	178.7	0	0	0	111	K10 D11	K10-I13 PolarHBondContact O-N 2.78Å; D11-I13 PolarHBondContact O-N 3.11Å
14	C	58	Low	62.6	Low	81 Å²	81	110.8 Å²	110.8	55%	0.547	59%	0.594	S	S	.	*	H	α-helix	trans	-67.9	-38.2	176	-78.1	0	0	0	0	113	K10 D11 Q16 A18	K10-C14 PolarHBondContact O-N 3.46Å; D11-C14 PolarHBondContact O-N 2.92Å; C14-Q16 PolarHBondContact O-N 3.49Å; C14-A18 WeakPolarHBondContact O-CB 3.28Å; C14-A18 PolarHBondContact O-N 3.35Å
15	T	65.8	Low	64.7	Low	85 Å²	85	107.8 Å²	107.8	52%	0.521	58%	0.583	S	S	.	*	H	α-helix	trans	-66.7	-36.1	-177.3	44.2	0	0	0	0	113.6	D11 I12 A18 L19	D11-T15 WeakPolarHBondContact O-CB 3.39Å; D11-T15 VanDerWaalsContact O-CG2 3.28Å; D11-T15 WeakPolarHBondContact O-CG2 3.34Å; D11-T15 PolarHBondContact O-N 3.45Å; D11-T15 PolarHBondContact O-OG1 3.25Å; I12-T15 PolarHBondContact O-OG1 3.44Å; I12-T15 VanDerWaalsContact O-OG1 3.11Å; T15-A18 PolarHBondContact O-N 3.02Å; T15-L19 WeakPolarHBondContact O-CB 3.46Å; T15-L19 PolarHBondContact O-N 3.29Å
16	Q	69.9	Low	66.2	Low	137 Å²	137	107.3 Å²	107.3	64%	0.64	57%	0.573	S	S	*	*	H	α-helix	trans	-65.2	-46.2	178.1	-69	-172.5	-2.9	0	0	112.5	C14 L19 V20	C14-Q16 PolarHBondContact O-N 3.49Å; Q16-L19 PolarHBondContact O-N 2.98Å; Q16-V20 PolarHBondContact O-N 2.87Å
17	W	75	Confident	67.4	Low	196 Å²	196	105.4 Å²	105.4	74%	0.742	57%	0.565	S	S	*	*	H	α-helix	trans	-67.3	-36.1	175.7	-80.3	98.8	0	0	0	112.6	L19 V20 A21	W17-L19 VanDerWaalsContact C-N 3.32Å; W17-L19 PolarHBondContact O-N 3.45Å; W17-V20 PolarHBondContact O-N 3.41Å; W17-A21 WeakPolarHBondContact O-CB 3.15Å; W17-A21 PolarHBondContact O-N 2.95Å
18	A	71.6	Confident	68.7	Low	58 Å²	58	102.1 Å²	102.1	48%	0.479	55%	0.553	S	S	.	*	H	α-helix	trans	-60.8	-40	173.1	0	0	0	0	0	112	C14 T15 A21 L22	C14-A18 WeakPolarHBondContact O-CB 3.28Å; C14-A18 PolarHBondContact O-N 3.35Å; T15-A18 PolarHBondContact O-N 3.02Å; A18-A21 PolarHBondContact O-N 3.18Å; A18-L22 WeakPolarHBondContact O-CB 3.35Å; A18-L22 PolarHBondContact O-N 3.48Å
19	L	75.7	Confident	69.7	Low	112 Å²	112	101 Å²	101	59%	0.586	54%	0.543	S	S	*	.	H	α-helix	trans	-68.3	-44	-179.9	-153	162.8	0	0	0	111.6	T15 Q16 W17 L22 V23	T15-L19 WeakPolarHBondContact O-CB 3.46Å; T15-L19 PolarHBondContact O-N 3.29Å; Q16-L19 PolarHBondContact O-N 2.98Å; W17-L19 VanDerWaalsContact C-N 3.32Å; W17-L19 PolarHBondContact O-N 3.45Å; L19-L22 PolarHBondContact O-N 3.5Å; L19-V23 HydrophobicContact CD2-CG2 4.05Å; L19-V23 WeakPolarHBondContact O-CG2 3.23Å; L19-V23 PolarHBondContact O-N 3Å
20	V	78.2	Confident	70.7	Confident	82 Å²	82	103.6 Å²	103.6	50%	0.497	54%	0.543	S	S	.	.	H	α-helix	trans	-62.4	-45.2	174.9	176.4	0	0	0	0	111.4	Q16 W17 L22 V23 I24	Q16-V20 PolarHBondContact O-N 2.87Å; W17-V20 PolarHBondContact O-N 3.41Å; V20-L22 VanDerWaalsContact C-N 3.32Å; V20-L22 PolarHBondContact O-N 3.27Å; V20-V23 PolarHBondContact O-N 2.99Å; V20-I24 HydrophobicContact CG1-CD1 4.15Å; V20-I24 WeakPolarHBondContact O-CG1 3.34Å; V20-I24 PolarHBondContact O-N 3.45Å; V20-I24 VanDerWaalsContact O-N 3.14Å
21	A	77.4	Confident	71.8	Confident	57 Å²	57	99.4 Å²	99.4	47%	0.471	53%	0.529	S	S	.	.	H	α-helix	trans	-61.5	-40.2	175.8	0	0	0	0	0	112	W17 A18 I24 L25	W17-A21 WeakPolarHBondContact O-CB 3.15Å; W17-A21 PolarHBondContact O-N 2.95Å; A18-A21 PolarHBondContact O-N 3.18Å; A21-I24 PolarHBondContact O-N 3.36Å; A21-L25 VanDerWaalsContact O-CB 3.23Å; A21-L25 WeakPolarHBondContact O-CB 3.27Å; A21-L25 PolarHBondContact O-N 2.89Å
22	L	78.2	Confident	72.7	Confident	99 Å²	99	97.9 Å²	97.9	52%	0.518	52%	0.523	S	S	.	.	H	α-helix	trans	-67.4	-37.3	178.4	-178.1	142.4	0	0	0	112.5	A18 L19 V20 L25 L26	A18-L22 WeakPolarHBondContact O-CB 3.35Å; A18-L22 PolarHBondContact O-N 3.48Å; L19-L22 PolarHBondContact O-N 3.5Å; V20-L22 VanDerWaalsContact C-N 3.32Å; V20-L22 PolarHBondContact O-N 3.27Å; L22-L25 PolarHBondContact O-N 3.5Å; L22-L26 HydrophobicContact CD2-CD1 3.6Å; L22-L26 HydrophobicContact CD2-CG 4.28Å; L22-L26 HydrophobicContact CG-CD1 4.39Å; L22-L26 WeakPolarHBondContact O-CB 3.44Å; L22-L26 VanDerWaalsContact O-CG 3.27Å; L22-L26 WeakPolarHBondContact O-CG 3.34Å; L22-L26 PolarHBondContact O-N 3.49Å
23	V	79.6	Confident	73	Confident	83 Å²	83	93.6 Å²	93.6	50%	0.503	50%	0.502	S	S	.	.	H	α-helix	trans	-65.7	-44.5	174	170.2	0	0	0	0	111.4	L19 V20 L25 L26 F27	L19-V23 HydrophobicContact CD2-CG2 4.05Å; L19-V23 WeakPolarHBondContact O-CG2 3.23Å; L19-V23 PolarHBondContact O-N 3Å; V20-V23 PolarHBondContact O-N 2.99Å; V23-L25 VanDerWaalsContact C-N 3.34Å; V23-L25 PolarHBondContact O-N 2.84Å; V23-L26 PolarHBondContact O-N 3.14Å; V23-F27 PolarHBondContact O-N 3.36Å
24	I	78.9	Confident	73.5	Confident	115 Å²	115	94.2 Å²	94.2	59%	0.59	50%	0.501	S	S	*	.	H	α-helix	trans	-63.6	-42.3	176.6	-66.2	170.2	0	0	0	110.6	V20 A21 F27 A28	V20-I24 HydrophobicContact CG1-CD1 4.15Å; V20-I24 WeakPolarHBondContact O-CG1 3.34Å; V20-I24 PolarHBondContact O-N 3.45Å; V20-I24 VanDerWaalsContact O-N 3.14Å; A21-I24 PolarHBondContact O-N 3.36Å; I24-F27 PolarHBondContact O-N 2.98Å; I24-A28 PolarHBondContact O-N 3.41Å
25	L	76.8	Confident	74.3	Confident	110 Å²	110	94.5 Å²	94.5	58%	0.576	50%	0.5	S	S	*	.	H	α-helix	trans	-66.2	-41.7	178.1	-171.1	148.7	0	0	0	111.8	A21 L22 V23 A28 V29	A21-L25 VanDerWaalsContact O-CB 3.23Å; A21-L25 WeakPolarHBondContact O-CB 3.27Å; A21-L25 PolarHBondContact O-N 2.89Å; L22-L25 PolarHBondContact O-N 3.5Å; V23-L25 VanDerWaalsContact C-N 3.34Å; V23-L25 PolarHBondContact O-N 2.84Å; L25-A28 PolarHBondContact O-N 3.44Å; L25-V29 HydrophobicContact CD2-CG2 3.91Å; L25-V29 HydrophobicContact CG-CG2 4.5Å; L25-V29 VanDerWaalsContact O-CB 3.31Å; L25-V29 WeakPolarHBondContact O-CB 3.46Å; L25-V29 WeakPolarHBondContact O-CG2 3.21Å; L25-V29 PolarHBondContact O-N 3.43Å
26	L	77.1	Confident	74.4	Confident	100 Å²	100	94.1 Å²	94.1	52%	0.524	49%	0.494	S	S	.	.	H	α-helix	trans	-62	-42.1	173.5	-78	174.6	0	0	0	112.1	L22 V23 V29 Y30	L22-L26 HydrophobicContact CD2-CD1 3.6Å; L22-L26 HydrophobicContact CD2-CG 4.28Å; L22-L26 HydrophobicContact CG-CD1 4.39Å; L22-L26 WeakPolarHBondContact O-CB 3.44Å; L22-L26 VanDerWaalsContact O-CG 3.27Å; L22-L26 WeakPolarHBondContact O-CG 3.34Å; L22-L26 PolarHBondContact O-N 3.49Å; V23-L26 PolarHBondContact O-N 3.14Å; L26-V29 PolarHBondContact O-N 3.29Å; L26-Y30 WeakPolarHBondContact O-CB 3.43Å; L26-Y30 PolarHBondContact O-N 2.99Å
27	F	77	Confident	74.3	Confident	148 Å²	148	89.6 Å²	89.6	65%	0.649	48%	0.476	S	S	*	.	H	α-helix	trans	-64.1	-44.4	178.1	-166.8	-93.2	0	0	0	111.5	V23 I24 Y30 V31	V23-F27 PolarHBondContact O-N 3.36Å; I24-F27 PolarHBondContact O-N 2.98Å; F27-Y30 PolarHBondContact O-N 3Å; F27-V31 HydrophobicContact CD1-CG2 4.18Å; F27-V31 HydrophobicContact CD2-CG2 4.49Å; F27-V31 HydrophobicContact CE1-CG2 3.89Å; F27-V31 HydrophobicContact CE2-CG2 4.23Å; F27-V31 HydrophobicContact CG-CG2 4.47Å; F27-V31 HydrophobicContact CZ-CG2 3.93Å; F27-V31 WeakPolarHBondContact O-CB 3.46Å; F27-V31 WeakPolarHBondContact O-CG2 3.39Å; F27-V31 PolarHBondContact O-N 3.44Å
28	A	75.6	Confident	74.2	Confident	38 Å²	38	87.6 Å²	87.6	31%	0.314	47%	0.473	S	S	.	.	H	α-helix	trans	-60.2	-49.4	172.7	0	0	0	0	0	111.7	I24 L25 Y30 V31 T32	I24-A28 PolarHBondContact O-N 3.41Å; L25-A28 PolarHBondContact O-N 3.44Å; A28-Y30 VanDerWaalsContact C-N 3.26Å; A28-Y30 PolarHBondContact O-N 3.49Å; A28-V31 PolarHBondContact O-N 3.27Å; A28-T32 VanDerWaalsContact O-CB 3.3Å; A28-T32 WeakPolarHBondContact O-CB 3.31Å; A28-T32 PolarHBondContact O-N 2.85Å; A28-T32 PolarHBondContact O-OG1 3.43Å
29	V	71.1	Confident	74.2	Confident	60 Å²	60	89 Å²	89	36%	0.364	48%	0.475	S	S	.	.	H	α-helix	trans	-60.4	-33.6	-179.5	167.2	0	0	0	0	112.6	L25 L26 P33 F59	L25-V29 HydrophobicContact CD2-CG2 3.91Å; L25-V29 HydrophobicContact CG-CG2 4.5Å; L25-V29 VanDerWaalsContact O-CB 3.31Å; L25-V29 WeakPolarHBondContact O-CB 3.46Å; L25-V29 WeakPolarHBondContact O-CG2 3.21Å; L25-V29 PolarHBondContact O-N 3.43Å; L26-V29 PolarHBondContact O-N 3.29Å; V29-P33 WeakPolarHBondContact O-CD 3.37Å; V29-P33 VanDerWaalsContact O-CG 3.27Å; V29-P33 WeakPolarHBondContact O-CG 3.4Å; V29-F59 HydrophobicContact CB-CD2 4.3Å; V29-F59 HydrophobicContact CG2-CD2 3.89Å; V29-F59 HydrophobicContact CG2-CE2 4.21Å; V29-F59 HydrophobicContact CG2-CG 4.39Å
30	Y	74.3	Confident	73.8	Confident	156 Å²	156	87.6 Å²	87.6	61%	0.612	47%	0.467	S	S	*	.	H	α-helix	trans	-84.7	-37.4	179.9	-171.5	-113.6	0	0	0	114.3	L26 F27 A28 K34	L26-Y30 WeakPolarHBondContact O-CB 3.43Å; L26-Y30 PolarHBondContact O-N 2.99Å; F27-Y30 PolarHBondContact O-N 3Å; A28-Y30 VanDerWaalsContact C-N 3.26Å; A28-Y30 PolarHBondContact O-N 3.49Å; Y30-K34 PolarHBondContact OH-NZ 3.12Å
31	V	75.5	Confident	73.3	Confident	55 Å²	55	85.5 Å²	85.5	33%	0.333	46%	0.457	S	S	.	.	H	α-helix	trans	-85.7	-44.2	-174.3	177.7	0	0	0	0	112.4	F27 A28 K34 V35	F27-V31 HydrophobicContact CD1-CG2 4.18Å; F27-V31 HydrophobicContact CD2-CG2 4.49Å; F27-V31 HydrophobicContact CE1-CG2 3.89Å; F27-V31 HydrophobicContact CE2-CG2 4.23Å; F27-V31 HydrophobicContact CG-CG2 4.47Å; F27-V31 HydrophobicContact CZ-CG2 3.93Å; F27-V31 WeakPolarHBondContact O-CB 3.46Å; F27-V31 WeakPolarHBondContact O-CG2 3.39Å; F27-V31 PolarHBondContact O-N 3.44Å; A28-V31 PolarHBondContact O-N 3.27Å; V31-K34 PolarHBondContact O-N 3.27Å; V31-V35 HydrophobicContact CG1-CG2 4.21Å; V31-V35 PolarHBondContact O-N 3Å
32	T	72.1	Confident	73	Confident	66 Å²	66	85.3 Å²	85.3	41%	0.405	45%	0.452	S	S	.	.	H	α-helix	trans	-56.4	-41.7	-173.7	-57.8	0	0	0	0	113.8	A28 K34 V35 L36 F59	A28-T32 VanDerWaalsContact O-CB 3.3Å; A28-T32 WeakPolarHBondContact O-CB 3.31Å; A28-T32 PolarHBondContact O-N 2.85Å; A28-T32 PolarHBondContact O-OG1 3.43Å; T32-K34 PolarHBondContact O-N 3.43Å; T32-V35 PolarHBondContact O-N 3.43Å; T32-L36 WeakPolarHBondContact O-CB 3.3Å; T32-L36 PolarHBondContact O-N 2.69Å; T32-F59 HydrophobicContact CG2-CE2 4.3Å
33	P	65.3	Low	72.6	Confident	14 Å²	14	86.4 Å²	86.4	9%	0.091	45%	0.453	C	S	.	.	H	α-helix	trans	-63.1	-38.3	179.1	-23.6	35	0	0	0	113.8	V29 L36 V37 F57	V29-P33 WeakPolarHBondContact O-CD 3.37Å; V29-P33 VanDerWaalsContact O-CG 3.27Å; V29-P33 WeakPolarHBondContact O-CG 3.4Å; P33-L36 PolarHBondContact O-N 3.48Å; P33-V37 WeakPolarHBondContact O-CG2 3.17Å; P33-V37 PolarHBondContact O-N 2.93Å; P33-F57 HydrophobicContact CB-CB 4.01Å; P33-F57 HydrophobicContact CB-CD1 3.94Å; P33-F57 HydrophobicContact CB-CG 4.15Å
34	K	70.1	Confident	71.7	Confident	127 Å²	127	85.2 Å²	85.2	55%	0.552	44%	0.443	S	S	*	.	H	α-helix	trans	-66.9	-41.1	-179.9	-70.2	-174.5	-179.9	177.3	0	111.8	Y30 V31 T32 F38	Y30-K34 PolarHBondContact OH-NZ 3.12Å; V31-K34 PolarHBondContact O-N 3.27Å; T32-K34 PolarHBondContact O-N 3.43Å; K34-F38 PolarHBondContact O-N 3.35Å
35	V	74.6	Confident	71.1	Confident	86 Å²	86	82.6 Å²	82.6	52%	0.521	44%	0.435	S	S	.	.	H	α-helix	trans	-64.1	-42.7	174.4	-179.6	0	0	0	0	110.5	V31 T32 F38 V39	V31-V35 HydrophobicContact CG1-CG2 4.21Å; V31-V35 PolarHBondContact O-N 3Å; T32-V35 PolarHBondContact O-N 3.43Å; V35-F38 PolarHBondContact O-N 2.8Å; V35-V39 HydrophobicContact CG1-CG2 4.44Å; V35-V39 WeakPolarHBondContact O-CG2 3.27Å; V35-V39 PolarHBondContact O-N 3.34Å
36	L	69.3	Low	70.6	Confident	77 Å²	77	84.5 Å²	84.5	40%	0.403	44%	0.438	S	S	.	.	H	α-helix	trans	-64.4	-41.6	-179.2	-169.1	148.9	0	0	0	112.4	T32 P33 F38 V39 L40 F57	T32-L36 WeakPolarHBondContact O-CB 3.3Å; T32-L36 PolarHBondContact O-N 2.69Å; P33-L36 PolarHBondContact O-N 3.48Å; L36-F38 PolarHBondContact O-N 3.5Å; L36-V39 PolarHBondContact O-N 3.41Å; L36-L40 WeakPolarHBondContact O-CB 3.47Å; L36-L40 PolarHBondContact O-N 3.17Å; L36-F57 HydrophobicContact CD2-CE1 4.22Å; L36-F57 HydrophobicContact CD2-CZ 3.81Å
37	V	67.4	Low	69.6	Low	42 Å²	42	85.8 Å²	85.8	26%	0.255	44%	0.44	S	S	.	.	H	α-helix	trans	-59	-45.7	174.4	170.7	0	0	0	0	111.6	P33 L40 S41 F57	P33-V37 WeakPolarHBondContact O-CG2 3.17Å; P33-V37 PolarHBondContact O-N 2.93Å; V37-L40 PolarHBondContact O-N 3.44Å; V37-S41 WeakPolarHBondContact O-CB 3.49Å; V37-S41 PolarHBondContact O-N 3.2Å; V37-F57 HydrophobicContact CG2-CD2 3.4Å; V37-F57 VanDerWaalsContact CG2-CD2 3.4Å; V37-F57 HydrophobicContact CG2-CE2 3.4Å; V37-F57 VanDerWaalsContact CG2-CE2 3.4Å; V37-F57 HydrophobicContact CG2-CG 4.31Å; V37-F57 HydrophobicContact CG2-CZ 4.3Å
38	F	72.2	Confident	68.7	Low	155 Å²	155	81.7 Å²	81.7	68%	0.68	42%	0.424	S	S	*	.	H	α-helix	trans	-62.3	-45.4	179	-177.3	-98	0	0	0	111.9	K34 V35 L36 S42	K34-F38 PolarHBondContact O-N 3.35Å; V35-F38 PolarHBondContact O-N 2.8Å; L36-F38 PolarHBondContact O-N 3.5Å; F38-S42 VanDerWaalsContact O-CB 3.29Å; F38-S42 WeakPolarHBondContact O-CB 3.43Å; F38-S42 PolarHBondContact O-N 3.22Å
39	V	72.5	Confident	68	Low	87 Å²	87	82.8 Å²	82.8	53%	0.527	43%	0.428	S	S	.	.	H	α-helix	trans	-63.3	-43.4	176.6	172.8	0	0	0	0	111.4	V35 L36 S42 F43	V35-V39 HydrophobicContact CG1-CG2 4.44Å; V35-V39 WeakPolarHBondContact O-CG2 3.27Å; V35-V39 PolarHBondContact O-N 3.34Å; L36-V39 PolarHBondContact O-N 3.41Å; V39-S42 PolarHBondContact O-N 2.81Å; V39-F43 WeakPolarHBondContact O-CB 3.29Å; V39-F43 PolarHBondContact O-N 2.92Å
40	L	67.5	Low	67.8	Low	82 Å²	82	80.9 Å²	80.9	43%	0.429	42%	0.418	S	S	.	.	H	α-helix	trans	-65.4	-43.8	-179.9	-151.4	80.4	0	0	0	111.6	L36 V37 F43 L44 L52	L36-L40 WeakPolarHBondContact O-CB 3.47Å; L36-L40 PolarHBondContact O-N 3.17Å; V37-L40 PolarHBondContact O-N 3.44Å; L40-F43 PolarHBondContact O-N 3.02Å; L40-L44 HydrophobicContact CD2-CD1 4.42Å; L40-L44 HydrophobicContact CG-CD1 4.27Å; L40-L44 WeakPolarHBondContact O-CB 3.49Å; L40-L44 WeakPolarHBondContact O-CG 3.44Å; L40-L44 PolarHBondContact O-N 3.3Å; L40-L52 HydrophobicContact CD2-CD2 4.35Å
41	S	67.3	Low	67.7	Low	39 Å²	39	78.8 Å²	78.8	27%	0.273	42%	0.416	S	S	.	.	H	α-helix	trans	-65.2	-39.4	176.5	-166.9	0	0	0	0	112.2	V37 F43 S45	V37-S41 WeakPolarHBondContact O-CB 3.49Å; V37-S41 PolarHBondContact O-N 3.2Å; S41-F43 VanDerWaalsContact C-N 3.3Å; S41-F43 PolarHBondContact O-N 3.04Å; S41-S45 WeakPolarHBondContact O-CB 3.19Å; S41-S45 PolarHBondContact O-N 3.35Å; S41-S45 VanDerWaalsContact O-N 3.1Å; S41-S45 PolarHBondContact O-OG 3.42Å
42	S	71.4	Confident	67.6	Low	53 Å²	53	77.1 Å²	77.1	37%	0.371	41%	0.405	S	S	.	.	H	α-helix	trans	-71.5	-22.6	176.2	-169.1	0	0	0	0	113.4	F38 V39 K46	F38-S42 VanDerWaalsContact O-CB 3.29Å; F38-S42 WeakPolarHBondContact O-CB 3.43Å; F38-S42 PolarHBondContact O-N 3.22Å; V39-S42 PolarHBondContact O-N 2.81Å; S42-K46 WeakPolarHBondContact O-CE 3.01Å
43	F	69.3	Low	67.8	Low	122 Å²	122	77.1 Å²	77.1	54%	0.535	41%	0.405	S	S	.	.	H	α-helix	trans	-79.8	-49.2	171.9	-174	-95.9	0	0	0	111.4	V39 L40 S41 S45 K46 F47	V39-F43 WeakPolarHBondContact O-CB 3.29Å; V39-F43 PolarHBondContact O-N 2.92Å; L40-F43 PolarHBondContact O-N 3.02Å; S41-F43 VanDerWaalsContact C-N 3.3Å; S41-F43 PolarHBondContact O-N 3.04Å; F43-S45 PolarHBondContact O-N 3.42Å; F43-K46 PolarHBondContact O-N 2.66Å; F43-F47 HydrophobicContact CD1-CD2 4.39Å; F43-F47 HydrophobicContact CD1-CE2 4.22Å; F43-F47 HydrophobicContact CD2-CE2 4.41Å; F43-F47 HydrophobicContact CE1-CD2 4.14Å; F43-F47 AromaticContact CE1-CE2 3.73Å; F43-F47 HydrophobicContact CE1-CE2 3.73Å; F43-F47 AromaticContact CE2-CE2 3.94Å; F43-F47 HydrophobicContact CE2-CE2 3.94Å; F43-F47 HydrophobicContact CZ-CD2 4.43Å; F43-F47 AromaticContact CZ-CE2 3.58Å; F43-F47 HydrophobicContact CZ-CE2 3.58Å; F43-F47 HydrophobicContact CZ-CZ 4.27Å; F43-F47 WeakPolarHBondContact O-CD2 3.47Å
44	L	61.3	Low	68.3	Low	58 Å²	58	78.3 Å²	78.3	30%	0.304	41%	0.412	S	S	.	.	H	α-helix	trans	-62.3	-43.7	-178	-75.4	166.5	0	0	0	112.7	L40 K46 F47 I48 L52	L40-L44 HydrophobicContact CD2-CD1 4.42Å; L40-L44 HydrophobicContact CG-CD1 4.27Å; L40-L44 WeakPolarHBondContact O-CB 3.49Å; L40-L44 WeakPolarHBondContact O-CG 3.44Å; L40-L44 PolarHBondContact O-N 3.3Å; L44-K46 PolarHBondContact O-N 2.76Å; L44-K46 VanDerWaalsContact O-N 3.13Å; L44-F47 PolarHBondContact O-N 3.31Å; L44-I48 PolarHBondContact O-N 3Å; L44-L52 HydrophobicContact CD1-CD1 4.2Å; L44-L52 HydrophobicContact CD1-CD2 4.36Å
45	S	66.4	Low	68.6	Low	60 Å²	60	78.9 Å²	78.9	42%	0.42	42%	0.417	S	S	.	.	H	α-helix	trans	-59.4	-26.8	-177.1	63.5	0	0	0	0	114.3	S41 F43 I48	S41-S45 WeakPolarHBondContact O-CB 3.19Å; S41-S45 PolarHBondContact O-N 3.35Å; S41-S45 VanDerWaalsContact O-N 3.1Å; S41-S45 PolarHBondContact O-OG 3.42Å; F43-S45 PolarHBondContact O-N 3.42Å; S45-I48 WeakPolarHBondContact CA-O 3.44Å
46	K	65.6	Low	68.5	Low	149 Å²	149	83.5 Å²	83.5	65%	0.648	43%	0.425	S	S	*	.	H	α-helix	trans	-67.4	-38.2	174.8	-66.2	177.1	-177.7	178.4	0	111.7	S42 F43 L44 K121	S42-K46 WeakPolarHBondContact O-CE 3.01Å; F43-K46 PolarHBondContact O-N 2.66Å; L44-K46 PolarHBondContact O-N 2.76Å; L44-K46 VanDerWaalsContact O-N 3.13Å; K46-K121 PolarHBondContact O-NZ 3.19Å
47	F	55.7	Low	68.5	Low	128 Å²	128	83.2 Å²	83.2	56%	0.561	42%	0.42	S	S	*	.	H	α-helix	trans	-85.4	-50.3	-179.4	-64.5	-76.4	0	0	0	111.9	F43 L44 K121	F43-F47 HydrophobicContact CD1-CD2 4.39Å; F43-F47 HydrophobicContact CD1-CE2 4.22Å; F43-F47 HydrophobicContact CD2-CE2 4.41Å; F43-F47 HydrophobicContact CE1-CD2 4.14Å; F43-F47 AromaticContact CE1-CE2 3.73Å; F43-F47 HydrophobicContact CE1-CE2 3.73Å; F43-F47 AromaticContact CE2-CE2 3.94Å; F43-F47 HydrophobicContact CE2-CE2 3.94Å; F43-F47 HydrophobicContact CZ-CD2 4.43Å; F43-F47 AromaticContact CZ-CE2 3.58Å; F43-F47 HydrophobicContact CZ-CE2 3.58Å; F43-F47 HydrophobicContact CZ-CZ 4.27Å; F43-F47 WeakPolarHBondContact O-CD2 3.47Å; L44-F47 PolarHBondContact O-N 3.31Å; F47-K121 PolarHBondContact O-NZ 3.3Å
48	I	59.1	Low	68.5	Low	61 Å²	61	82 Å²	82	31%	0.313	42%	0.415	S	S	.	.	S	Bend	trans	-129.4	127.6	-176	-54.9	176.9	0	0	0	109.6	L44 S45 C50 F69 M118	L44-I48 PolarHBondContact O-N 3Å; S45-I48 WeakPolarHBondContact CA-O 3.44Å; I48-C50 HydrophobicContact CG2-CB 4.37Å; I48-C50 PolarHBondContact O-N 3.42Å; I48-C50 PolarHBondContact O-SG 3.44Å; I48-C50 VanDerWaalsContact O-SG 3.37Å; I48-F69 HydrophobicContact CG2-CD1 4.26Å; I48-F69 HydrophobicContact CG2-CE1 4.02Å; I48-M118 HydrophobicContact CD1-CE 3.92Å
49	P	61	Low	68.2	Low	61 Å²	61	80.1 Å²	80.1	40%	0.396	41%	0.407	S	S	.	.			trans	-75	90.4	176.4	32.2	-34.1	0	0	0	109.9	I70	P49-I70 HydrophobicContact CB-CD1 3.84Å; P49-I70 HydrophobicContact CG-CD1 4.44Å
50	C	66.6	Low	68.1	Low	21 Å²	21	79.4 Å²	79.4	14%	0.142	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	154.8	179.4	57.6	0	0	0	0	110	I48 I67 T68 F69	I48-C50 HydrophobicContact CG2-CB 4.37Å; I48-C50 PolarHBondContact O-N 3.42Å; I48-C50 PolarHBondContact O-SG 3.44Å; I48-C50 VanDerWaalsContact O-SG 3.37Å; C50-I67 HydrophobicContact CB-CG2 3.78Å; C50-T68 WeakPolarHBondContact CA-O 3.47Å; C50-T68 WeakPolarHBondContact CB-O 2.98Å; C50-F69 HydrophobicContact CB-CD1 3.83Å; C50-F69 HydrophobicContact CB-CE1 3.98Å
51	I	71.9	Confident	68.7	Low	111 Å²	111	80.3 Å²	80.3	57%	0.569	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.7	119.7	174.7	-59.7	172.5	0	0	0	107.4	T53 T68	I51-T53 HydrophobicContact CG2-CG2 4.33Å; I51-T68 PolarHBondContact N-O 3.02Å; I51-T68 PolarHBondContact O-N 3.29Å; I51-T68 VanDerWaalsContact O-N 3.08Å
52	L	72.9	Confident	69.2	Low	21 Å²	21	78.7 Å²	78.7	11%	0.11	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	120.5	174.1	-171.7	80.9	0	0	0	109.2	L40 L44 V54 V65 I67	L40-L52 HydrophobicContact CD2-CD2 4.35Å; L44-L52 HydrophobicContact CD1-CD1 4.2Å; L44-L52 HydrophobicContact CD1-CD2 4.36Å; L52-V54 HydrophobicContact CD2-CG2 4.37Å; L52-V54 HydrophobicContact CG-CG2 4.29Å; L52-V65 HydrophobicContact CD1-CG1 3.97Å; L52-I67 HydrophobicContact CD1-CD1 4.29Å; L52-I67 HydrophobicContact CD1-CG1 4.04Å
53	T	76.1	Confident	69.5	Low	66 Å²	66	81.9 Å²	81.9	41%	0.405	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	144.4	169.3	42.8	0	0	0	0	109.3	I51 T66	I51-T53 HydrophobicContact CG2-CG2 4.33Å; T53-T66 PolarHBondContact N-O 3.26Å; T53-T66 PolarHBondContact O-N 3.42Å; T53-T66 PolarHBondContact O-OG1 3.03Å; T53-T66 WeakPolarHBondContact OG1-CB 3.42Å; T53-T66 PolarHBondContact OG1-O 3.43Å; T53-T66 PolarHBondContact OG1-OG1 2.88Å
54	V	75.9	Confident	69.9	Low	39 Å²	39	76.4 Å²	76.4	24%	0.236	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	121.1	-178.8	-172.4	0	0	0	0	109.4	L52 F57 A62 G64 V65	L52-V54 HydrophobicContact CD2-CG2 4.37Å; L52-V54 HydrophobicContact CG-CG2 4.29Å; V54-F57 HydrophobicContact CB-CD2 4.33Å; V54-F57 HydrophobicContact CG1-CD2 3.67Å; V54-F57 HydrophobicContact CG1-CE2 4.14Å; V54-F57 HydrophobicContact CG2-CE2 4.46Å; V54-A62 HydrophobicContact CG1-CB 4.15Å; V54-G64 WeakPolarHBondContact CA-O 3.47Å; V54-V65 HydrophobicContact CB-CG2 4.45Å; V54-V65 HydrophobicContact CG1-CG2 3.77Å; V54-V65 HydrophobicContact CG2-CG1 4.27Å; V54-V65 HydrophobicContact CG2-CG2 4.04Å
55	Q	76	Confident	70.7	Confident	139 Å²	139	74 Å²	74	65%	0.65	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.2	-44.4	-175.2	-65.6	179.8	1.2	0	0	112.7	G64	Q55-G64 WeakPolarHBondContact CG-O 3.36Å; Q55-G64 PolarHBondContact N-O 3.25Å
56	R	72.2	Confident	71.2	Confident	183 Å²	183	71.8 Å²	71.8	69%	0.691	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.8	141.6	179.3	-65	-174	-179.5	173.9	1.2	111.7	W61 A62 R63	R56-W61 HydrophobicContact CB-CZ3 4.31Å; R56-A62 WeakPolarHBondContact O-CA 3.47Å; R56-R63 PolarHBondContact N-O 3.48Å; R56-R63 PolarHBondContact O-N 3.17Å
57	F	70.6	Confident	71.7	Confident	71 Å²	71	66.1 Å²	66.1	31%	0.311	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	128.6	178.5	-130.6	-72.2	0	0	0	109.4	P33 L36 V37 V54 A62	P33-F57 HydrophobicContact CB-CB 4.01Å; P33-F57 HydrophobicContact CB-CD1 3.94Å; P33-F57 HydrophobicContact CB-CG 4.15Å; L36-F57 HydrophobicContact CD2-CE1 4.22Å; L36-F57 HydrophobicContact CD2-CZ 3.81Å; V37-F57 HydrophobicContact CG2-CD2 3.4Å; V37-F57 VanDerWaalsContact CG2-CD2 3.4Å; V37-F57 HydrophobicContact CG2-CE2 3.4Å; V37-F57 VanDerWaalsContact CG2-CE2 3.4Å; V37-F57 HydrophobicContact CG2-CG 4.31Å; V37-F57 HydrophobicContact CG2-CZ 4.3Å; V54-F57 HydrophobicContact CB-CD2 4.33Å; V54-F57 HydrophobicContact CG1-CD2 3.67Å; V54-F57 HydrophobicContact CG1-CE2 4.14Å; V54-F57 HydrophobicContact CG2-CE2 4.46Å; F57-A62 HydrophobicContact CD1-CB 4.36Å; F57-A62 HydrophobicContact CD2-CB 3.87Å; F57-A62 HydrophobicContact CE1-CB 4.19Å; F57-A62 HydrophobicContact CE2-CB 3.66Å; F57-A62 HydrophobicContact CG-CB 4.21Å; F57-A62 HydrophobicContact CZ-CB 3.84Å
58	G	68	Low	72.5	Confident	15 Å²	15	62.3 Å²	62.3	16%	0.155	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	169.8	166.6	0	0	0	0	0	110.3	I60 W61	G58-I60 PolarHBondContact O-N 3.01Å; G58-W61 CarbonylContact C-O 3.5Å; G58-W61 WeakPolarHBondContact CA-O 3.16Å; G58-W61 PolarHBondContact N-O 3.17Å; G58-W61 PolarHBondContact O-N 3.32Å
59	F	63.9	Low	73.1	Confident	116 Å²	116	61.2 Å²	61.2	51%	0.509	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-24.6	-169.1	-148	-105.5	0	0	0	114.8	V29 T32	V29-F59 HydrophobicContact CB-CD2 4.3Å; V29-F59 HydrophobicContact CG2-CD2 3.89Å; V29-F59 HydrophobicContact CG2-CE2 4.21Å; V29-F59 HydrophobicContact CG2-CG 4.39Å; T32-F59 HydrophobicContact CG2-CE2 4.3Å
60	I	71.9	Confident	73.3	Confident	73 Å²	73	64.9 Å²	64.9	37%	0.374	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.9	5.2	-175.9	-62.1	-180	0	0	0	111.1	G58 L82	G58-I60 PolarHBondContact O-N 3.01Å; I60-L82 HydrophobicContact CG2-CB 4.27Å; I60-L82 WeakPolarHBondContact CG2-O 3.42Å; I60-L82 PolarHBondContact O-N 2.85Å
61	W	79.4	Confident	73	Confident	101 Å²	101	67.9 Å²	67.9	38%	0.383	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	153.6	178.7	60.6	-94.8	0	0	0	113.9	R56 G58 R63 I80 Y81	R56-W61 HydrophobicContact CB-CZ3 4.31Å; G58-W61 CarbonylContact C-O 3.5Å; G58-W61 WeakPolarHBondContact CA-O 3.16Å; G58-W61 PolarHBondContact N-O 3.17Å; G58-W61 PolarHBondContact O-N 3.32Å; W61-R63 HydrophobicContact CE3-CB 3.91Å; W61-R63 HydrophobicContact CZ3-CB 3.57Å; W61-I80 CarbonylContact C-O 3.53Å; W61-I80 WeakPolarHBondContact CA-O 3.06Å; W61-I80 WeakPolarHBondContact CB-O 3.22Å; W61-Y81 HydrophobicContact CB-CD1 3.58Å; W61-Y81 HydrophobicContact CB-CE1 3.92Å; W61-Y81 HydrophobicContact CB-CG 4.28Å; W61-Y81 HydrophobicContact CG-CD1 4.23Å; W61-Y81 HydrophobicContact CG-CE1 4.18Å
62	A	76.9	Confident	72.6	Confident	5 Å²	5	65.5 Å²	65.5	4%	0.041	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	143.8	168.5	0	0	0	0	0	109.5	V54 R56 F57 V65 S79 I80	V54-A62 HydrophobicContact CG1-CB 4.15Å; R56-A62 WeakPolarHBondContact O-CA 3.47Å; F57-A62 HydrophobicContact CD1-CB 4.36Å; F57-A62 HydrophobicContact CD2-CB 3.87Å; F57-A62 HydrophobicContact CE1-CB 4.19Å; F57-A62 HydrophobicContact CE2-CB 3.66Å; F57-A62 HydrophobicContact CG-CB 4.21Å; F57-A62 HydrophobicContact CZ-CB 3.84Å; A62-V65 HydrophobicContact CB-CG2 3.78Å; A62-S79 CarbonylContact O-C 3.48Å; A62-S79 WeakPolarHBondContact O-CA 3.35Å; A62-S79 WeakPolarHBondContact O-CB 3.35Å; A62-I80 PolarHBondContact N-O 3.49Å; A62-I80 PolarHBondContact O-N 3.05Å
63	R	79.2	Confident	72.2	Confident	119 Å²	119	64.9 Å²	64.9	45%	0.449	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	138.9	178.5	-165.6	-173.6	176.3	80.3	5.3	110.6	R56 W61 D78	R56-R63 PolarHBondContact N-O 3.48Å; R56-R63 PolarHBondContact O-N 3.17Å; W61-R63 HydrophobicContact CE3-CB 3.91Å; W61-R63 HydrophobicContact CZ3-CB 3.57Å; R63-D78 CarbonylContact C-O 3.47Å; R63-D78 WeakPolarHBondContact CA-O 3.4Å; R63-D78 WeakPolarHBondContact CG-O 3.4Å
64	G	77.4	Confident	72	Confident	7 Å²	7	63.7 Å²	63.7	7%	0.072	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	63.5	59.4	-173.5	0	0	0	0	0	111	V54 Q55 D78	V54-G64 WeakPolarHBondContact CA-O 3.47Å; Q55-G64 WeakPolarHBondContact CG-O 3.36Å; Q55-G64 PolarHBondContact N-O 3.25Å; G64-D78 PolarHBondContact N-O 3.16Å
65	V	78	Confident	71.9	Confident	7 Å²	7	64.2 Å²	64.2	4%	0.042	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	117	171.8	176.3	0	0	0	0	107.7	L52 V54 A62 I67 V77 I80	L52-V65 HydrophobicContact CD1-CG1 3.97Å; V54-V65 HydrophobicContact CB-CG2 4.45Å; V54-V65 HydrophobicContact CG1-CG2 3.77Å; V54-V65 HydrophobicContact CG2-CG1 4.27Å; V54-V65 HydrophobicContact CG2-CG2 4.04Å; A62-V65 HydrophobicContact CB-CG2 3.78Å; V65-I67 HydrophobicContact CG1-CG1 4.4Å; V65-V77 HydrophobicContact CB-CB 4.22Å; V65-V77 PolarHBondContact N-O 2.71Å; V65-V77 PolarHBondContact O-N 2.87Å; V65-I80 HydrophobicContact CG2-CD1 4.12Å
66	T	77.4	Confident	71.9	Confident	14 Å²	14	62.9 Å²	62.9	9%	0.086	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	115.8	-177.3	32.5	0	0	0	0	109.9	T53 Y76	T53-T66 PolarHBondContact N-O 3.26Å; T53-T66 PolarHBondContact O-N 3.42Å; T53-T66 PolarHBondContact O-OG1 3.03Å; T53-T66 WeakPolarHBondContact OG1-CB 3.42Å; T53-T66 PolarHBondContact OG1-O 3.43Å; T53-T66 PolarHBondContact OG1-OG1 2.88Å; T66-Y76 HydrophobicContact CG2-CD1 3.45Å; T66-Y76 VanDerWaalsContact CG2-CD1 3.45Å; T66-Y76 HydrophobicContact CG2-CD2 3.93Å; T66-Y76 HydrophobicContact CG2-CE1 3.23Å; T66-Y76 HydrophobicContact CG2-CE2 3.74Å; T66-Y76 HydrophobicContact CG2-CG 3.78Å
67	I	75.7	Confident	72.2	Confident	30 Å²	30	54.4 Å²	54.4	15%	0.154	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	110.8	176.8	-39.4	-170.9	0	0	0	107.8	C50 L52 V65 F69 M75	C50-I67 HydrophobicContact CB-CG2 3.78Å; L52-I67 HydrophobicContact CD1-CD1 4.29Å; L52-I67 HydrophobicContact CD1-CG1 4.04Å; V65-I67 HydrophobicContact CG1-CG1 4.4Å; I67-F69 HydrophobicContact CG2-CE1 4.34Å; I67-F69 HydrophobicContact CG2-CZ 4.09Å; I67-M75 HydrophobicContact CB-CB 4.22Å; I67-M75 HydrophobicContact CD1-SD 4.03Å; I67-M75 PolarHBondContact N-O 3.24Å; I67-M75 PolarHBondContact O-N 3.06Å
68	T	73.1	Confident	72.5	Confident	48 Å²	48	55.1 Å²	55.1	29%	0.294	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	130	176.1	60.2	0	0	0	0	110	C50 I51	C50-T68 WeakPolarHBondContact CA-O 3.47Å; C50-T68 WeakPolarHBondContact CB-O 2.98Å; I51-T68 PolarHBondContact N-O 3.02Å; I51-T68 PolarHBondContact O-N 3.29Å; I51-T68 VanDerWaalsContact O-N 3.08Å
69	F	72.1	Confident	73	Confident	38 Å²	38	54.6 Å²	54.6	17%	0.167	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	154.1	176.8	-59.2	-80	0	0	0	110	I48 C50 I67 N71 G72 E73 M75 F104	I48-F69 HydrophobicContact CG2-CD1 4.26Å; I48-F69 HydrophobicContact CG2-CE1 4.02Å; C50-F69 HydrophobicContact CB-CD1 3.83Å; C50-F69 HydrophobicContact CB-CE1 3.98Å; I67-F69 HydrophobicContact CG2-CE1 4.34Å; I67-F69 HydrophobicContact CG2-CZ 4.09Å; F69-N71 PolarHBondContact O-N 3.44Å; F69-G72 PolarHBondContact O-N 2.64Å; F69-E73 HydrophobicContact CD2-CB 4.29Å; F69-E73 WeakPolarHBondContact CD2-O 3.18Å; F69-E73 PolarHBondContact N-O 3.41Å; F69-M75 HydrophobicContact CE2-CB 4.19Å; F69-F104 HydrophobicContact CE2-CE2 4.1Å
70	I	63.3	Low	73.8	Confident	139 Å²	139	51.3 Å²	51.3	71%	0.713	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-22.7	-178	-68.8	-179.7	0	0	0	113	P49 G72	P49-I70 HydrophobicContact CB-CD1 3.84Å; P49-I70 HydrophobicContact CG-CD1 4.44Å; I70-G72 VanDerWaalsContact C-N 3.28Å; I70-G72 PolarHBondContact O-N 2.8Å
71	N	60.6	Low	74.1	Confident	83 Å²	83	52.2 Å²	52.2	44%	0.444	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	1.7	178.3	-57.1	-12.7	0	0	0	114.4	F69 E73 A113	F69-N71 PolarHBondContact O-N 3.44Å; N71-E73 VanDerWaalsContact C-N 3.31Å; N71-A113 WeakPolarHBondContact ND2-CB 3.17Å
72	G	63.3	Low	73.9	Confident	61 Å²	61	50.9 Å²	50.9	63%	0.629	27%	0.266	S	S	*	.	S	Bend	trans	86	-6.5	-175.7	0	0	0	0	0	115	F69 I70 C74	F69-G72 PolarHBondContact O-N 2.64Å; I70-G72 VanDerWaalsContact C-N 3.28Å; I70-G72 PolarHBondContact O-N 2.8Å; G72-C74 PolarHBondContact O-SG 3.37Å
73	E	65.8	Low	73.7	Confident	9 Å²	9	51.4 Å²	51.4	4%	0.042	27%	0.269	C	S	.	.			trans	-69.6	143	174.9	-65.8	173.3	110.7	0	0	111.4	F69 N71 A106 G110 L111 I114	F69-E73 HydrophobicContact CD2-CB 4.29Å; F69-E73 WeakPolarHBondContact CD2-O 3.18Å; F69-E73 PolarHBondContact N-O 3.41Å; N71-E73 VanDerWaalsContact C-N 3.31Å; E73-A106 WeakPolarHBondContact OE1-CB 3.35Å; E73-G110 VanDerWaalsContact CD-C 3.44Å; E73-G110 VanDerWaalsContact CD-CA 3.41Å; E73-G110 VanDerWaalsContact OE1-CA 3.3Å; E73-G110 WeakPolarHBondContact OE1-CA 3.29Å; E73-G110 WeakPolarHBondContact OE2-CA 3.49Å; E73-L111 PolarHBondContact OE1-N 3.15Å; E73-L111 VanDerWaalsContact OE1-N 3.11Å; E73-I114 VanDerWaalsContact OE2-CD1 3.25Å; E73-I114 WeakPolarHBondContact OE2-CD1 3.45Å; E73-I114 WeakPolarHBondContact OE2-CG1 3.37Å
74	C	71.8	Confident	73.4	Confident	40 Å²	40	45.9 Å²	45.9	27%	0.27	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	125.6	-171.4	-66.8	0	0	0	0	111.1	G72 Y76 H105	G72-C74 PolarHBondContact O-SG 3.37Å; C74-Y76 HydrophobicContact CB-CD2 4.49Å; C74-Y76 HydrophobicContact CB-CE2 4.45Å; C74-H105 PolarHBondContact O-N 3.39Å; C74-H105 VanDerWaalsContact O-N 3.12Å
75	M	74.6	Confident	73.1	Confident	51 Å²	51	48 Å²	48	25%	0.251	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	113.4	168	-178.8	-177.2	-177.7	0	0	108.7	I67 F69 V77 V102 F104	I67-M75 HydrophobicContact CB-CB 4.22Å; I67-M75 HydrophobicContact CD1-SD 4.03Å; I67-M75 PolarHBondContact N-O 3.24Å; I67-M75 PolarHBondContact O-N 3.06Å; F69-M75 HydrophobicContact CE2-CB 4.19Å; M75-V77 HydrophobicContact CE-CG2 3.95Å; M75-V77 HydrophobicContact CG-CG2 4.33Å; M75-V102 HydrophobicContact CE-CG1 3.52Å; M75-V102 HydrophobicContact CG-CG1 4.48Å; M75-F104 HydrophobicContact CB-CD2 3.89Å; M75-F104 HydrophobicContact CB-CE2 4.3Å; M75-F104 HydrophobicContact CG-CD2 4.08Å
76	Y	75.3	Confident	72.8	Confident	110 Å²	110	54 Å²	54	43%	0.431	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	142.2	169.1	-89	-104.4	0	0	0	109.7	T66 C74 V102 E103	T66-Y76 HydrophobicContact CG2-CD1 3.45Å; T66-Y76 VanDerWaalsContact CG2-CD1 3.45Å; T66-Y76 HydrophobicContact CG2-CD2 3.93Å; T66-Y76 HydrophobicContact CG2-CE1 3.23Å; T66-Y76 HydrophobicContact CG2-CE2 3.74Å; T66-Y76 HydrophobicContact CG2-CG 3.78Å; C74-Y76 HydrophobicContact CB-CD2 4.49Å; C74-Y76 HydrophobicContact CB-CE2 4.45Å; Y76-V102 WeakPolarHBondContact O-CA 3.3Å; Y76-E103 PolarHBondContact N-O 3.37Å; Y76-E103 PolarHBondContact O-N 3.41Å
77	V	78	Confident	72.5	Confident	6 Å²	6	61.3 Å²	61.3	4%	0.036	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	111.4	170.7	-178	0	0	0	0	108.3	V65 M75 I80 I99 G101 V102	V65-V77 HydrophobicContact CB-CB 4.22Å; V65-V77 PolarHBondContact N-O 2.71Å; V65-V77 PolarHBondContact O-N 2.87Å; M75-V77 HydrophobicContact CE-CG2 3.95Å; M75-V77 HydrophobicContact CG-CG2 4.33Å; V77-I80 HydrophobicContact CG1-CD1 4.34Å; V77-I80 HydrophobicContact CG1-CG1 3.72Å; V77-I99 HydrophobicContact CG1-CG2 3.52Å; V77-G101 CarbonylContact C-O 3.55Å; V77-G101 WeakPolarHBondContact CA-O 3.33Å; V77-V102 HydrophobicContact CG1-CG2 4.33Å; V77-V102 HydrophobicContact CG2-CG1 4.41Å; V77-V102 HydrophobicContact CG2-CG2 4.26Å
78	D	77.3	Confident	72	Confident	86 Å²	86	62.7 Å²	62.7	46%	0.46	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.4	-59.5	-178.7	-93.4	-35.9	0	0	0	110.9	R63 G64 T100 G101	R63-D78 CarbonylContact C-O 3.47Å; R63-D78 WeakPolarHBondContact CA-O 3.4Å; R63-D78 WeakPolarHBondContact CG-O 3.4Å; G64-D78 PolarHBondContact N-O 3.16Å; D78-T100 WeakPolarHBondContact CB-O 3.38Å; D78-T100 PolarHBondContact N-O 2.87Å; D78-G101 PolarHBondContact N-O 3.15Å
79	S	78.8	Confident	71.8	Confident	4 Å²	4	66.5 Å²	66.5	3%	0.028	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	137.7	174.6	28.3	0	0	0	0	114.4	A62 Y81 T100	A62-S79 CarbonylContact O-C 3.48Å; A62-S79 WeakPolarHBondContact O-CA 3.35Å; A62-S79 WeakPolarHBondContact O-CB 3.35Å; S79-Y81 WeakPolarHBondContact OG-CE2 3.45Å; S79-Y81 PolarHBondContact OG-OH 3.09Å; S79-T100 WeakPolarHBondContact CB-OG1 3.43Å; S79-T100 PolarHBondContact N-O 3.23Å; S79-T100 VanDerWaalsContact N-O 3.12Å; S79-T100 PolarHBondContact N-OG1 2.8Å; S79-T100 PolarHBondContact O-N 2.93Å; S79-T100 PolarHBondContact O-OG1 2.86Å; S79-T100 PolarHBondContact OG-OG1 3.02Å
80	I	79.2	Confident	71	Confident	47 Å²	47	73.8 Å²	73.8	24%	0.241	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	116.8	168.8	-57.2	176.4	0	0	0	107	W61 A62 V65 V77 I99	W61-I80 CarbonylContact C-O 3.53Å; W61-I80 WeakPolarHBondContact CA-O 3.06Å; W61-I80 WeakPolarHBondContact CB-O 3.22Å; A62-I80 PolarHBondContact N-O 3.49Å; A62-I80 PolarHBondContact O-N 3.05Å; V65-I80 HydrophobicContact CG2-CD1 4.12Å; V77-I80 HydrophobicContact CG1-CD1 4.34Å; V77-I80 HydrophobicContact CG1-CG1 3.72Å; I80-I99 HydrophobicContact CG1-CG1 4.39Å; I80-I99 HydrophobicContact CG1-CG2 4.3Å; I80-I99 HydrophobicContact CG2-CG1 4.35Å
81	Y	78.5	Confident	70.8	Confident	92 Å²	92	67.9 Å²	67.9	36%	0.361	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	145.4	169.2	-59.7	-89.8	0	0	0	109.5	W61 S79 A97 W98 T100	W61-Y81 HydrophobicContact CB-CD1 3.58Å; W61-Y81 HydrophobicContact CB-CE1 3.92Å; W61-Y81 HydrophobicContact CB-CG 4.28Å; W61-Y81 HydrophobicContact CG-CD1 4.23Å; W61-Y81 HydrophobicContact CG-CE1 4.18Å; S79-Y81 WeakPolarHBondContact OG-CE2 3.45Å; S79-Y81 PolarHBondContact OG-OH 3.09Å; Y81-A97 CarbonylContact O-C 3.45Å; Y81-A97 WeakPolarHBondContact O-CA 3.44Å; Y81-W98 PolarHBondContact N-O 3.47Å; Y81-W98 PolarHBondContact O-N 3.4Å; Y81-T100 HydrophobicContact CD2-CG2 4.16Å; Y81-T100 HydrophobicContact CE2-CG2 4.06Å
82	L	74.9	Confident	70.7	Confident	73 Å²	73	70.5 Å²	70.5	38%	0.382	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	150.3	166.1	-74.7	163.9	0	0	0	109.3	I60 L95 A97	I60-L82 HydrophobicContact CG2-CB 4.27Å; I60-L82 WeakPolarHBondContact CG2-O 3.42Å; I60-L82 PolarHBondContact O-N 2.85Å; L82-L95 HydrophobicContact CD2-CD2 4.37Å; L82-L95 HydrophobicContact CD2-CG 4.4Å; L82-A97 HydrophobicContact CD2-CB 4.08Å
83	S	72.6	Confident	70.8	Confident	15 Å²	15	68.9 Å²	68.9	11%	0.105	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	157.4	177.2	171.5	0	0	0	0	108.4	N88 S96	S83-N88 PolarHBondContact OG-ND2 3.28Å; S83-S96 VanDerWaalsContact C-OG 3.3Å; S83-S96 VanDerWaalsContact CB-OG 3.32Å; S83-S96 WeakPolarHBondContact CB-OG 3.32Å; S83-S96 PolarHBondContact N-O 3.41Å; S83-S96 PolarHBondContact O-N 3.12Å; S83-S96 PolarHBondContact O-OG 2.84Å; S83-S96 PolarHBondContact OG-OG 2.84Å
84	S	74.7	Confident	70.9	Confident	4 Å²	4	72.4 Å²	72.4	3%	0.028	36%	0.361	C	S	.	.			trans	-141.8	145.9	179.6	177	0	0	0	0	108.9	L86 W87 N88 L94	S84-L86 PolarHBondContact O-N 3.02Å; S84-L86 VanDerWaalsContact O-N 3.13Å; S84-L86 WeakPolarHBondContact OG-CB 3.09Å; S84-L86 PolarHBondContact OG-N 3.25Å; S84-L86 VanDerWaalsContact OG-N 3.15Å; S84-W87 PolarHBondContact O-N 3.31Å; S84-W87 VanDerWaalsContact O-N 3.17Å; S84-N88 PolarHBondContact O-N 2.82Å; S84-L94 VanDerWaalsContact CB-O 3.24Å; S84-L94 WeakPolarHBondContact CB-O 3.1Å; S84-L94 PolarHBondContact OG-O 3.47Å
85	S	69.8	Low	70.6	Confident	52 Å²	52	73.7 Å²	73.7	36%	0.364	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-19.9	168.7	58	0	0	0	0	113.4	T93	S85-T93 PolarHBondContact N-O 3.19Å; S85-T93 VanDerWaalsContact N-O 3.13Å; S85-T93 PolarHBondContact OG-O 3.32Å
86	L	71.5	Confident	70.4	Confident	132 Å²	132	71.3 Å²	71.3	69%	0.691	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-29.2	176.3	-65.8	170.5	0	0	0	113.9	S84 L94	S84-L86 PolarHBondContact O-N 3.02Å; S84-L86 VanDerWaalsContact O-N 3.13Å; S84-L86 WeakPolarHBondContact OG-CB 3.09Å; S84-L86 PolarHBondContact OG-N 3.25Å; S84-L86 VanDerWaalsContact OG-N 3.15Å; L86-L94 HydrophobicContact CD1-CD2 4.11Å; L86-L94 HydrophobicContact CD2-CD2 4.25Å; L86-L94 HydrophobicContact CG-CD2 3.94Å
87	W	72.5	Confident	70.2	Confident	167 Å²	167	66.6 Å²	66.6	63%	0.633	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.5	-4.5	-178.3	47.2	61.7	0	0	0	114.7	S84	S84-W87 PolarHBondContact O-N 3.31Å; S84-W87 VanDerWaalsContact O-N 3.17Å
88	N	64.8	Low	70	Confident	59 Å²	59	72.9 Å²	72.9	32%	0.316	36%	0.361	S	S	.	.			trans	-135.7	102.5	172.8	179.5	2.9	0	0	0	109.6	S83 S84 K90 A91	S83-N88 PolarHBondContact OG-ND2 3.28Å; S84-N88 PolarHBondContact O-N 2.82Å; N88-K90 PolarHBondContact O-N 3.02Å; N88-K90 WeakPolarHBondContact OD1-CB 3.04Å; N88-K90 PolarHBondContact OD1-N 3.04Å; N88-K90 VanDerWaalsContact OD1-N 3.1Å; N88-A91 HydrophobicContact CB-CB 4.27Å; N88-A91 VanDerWaalsContact O-CB 3.3Å; N88-A91 WeakPolarHBondContact O-CB 3.15Å; N88-A91 PolarHBondContact O-N 3.31Å
89	P	67.7	Low	69.8	Low	129 Å²	129	70.1 Å²	70.1	84%	0.838	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-3.9	-177.8	27.9	-35.4	0	0	0	113.9
90	K	55.7	Low	69.5	Low	190 Å²	190	71.5 Å²	71.5	83%	0.826	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-8.1	171.5	-57	178.4	-178.8	175.8	0	112.9	N88	N88-K90 PolarHBondContact O-N 3.02Å; N88-K90 WeakPolarHBondContact OD1-CB 3.04Å; N88-K90 PolarHBondContact OD1-N 3.04Å; N88-K90 VanDerWaalsContact OD1-N 3.1Å
91	A	58.7	Low	68.6	Low	16 Å²	16	69.8 Å²	69.8	13%	0.132	35%	0.348	C	S	.	.			trans	-80.7	129.6	177.3	0	0	0	0	0	111.2	N88 T93	N88-A91 HydrophobicContact CB-CB 4.27Å; N88-A91 VanDerWaalsContact O-CB 3.3Å; N88-A91 WeakPolarHBondContact O-CB 3.15Å; N88-A91 PolarHBondContact O-N 3.31Å; A91-T93 PolarHBondContact O-N 3.03Å
92	K	58	Low	68.1	Low	137 Å²	137	65.8 Å²	65.8	60%	0.596	33%	0.333	S	S	*	.	S	Bend	trans	-78.6	-11.1	-173.1	-89.8	-158.5	156.7	-138	0	115.4	E330	K92-E330 IonicContact NZ-OE1 2.69Å; K92-E330 PolarHBondContact NZ-OE1 2.88Å; K92-E330 VanDerWaalsContact NZ-OE1 3.12Å
93	T	66.5	Low	67.7	Low	27 Å²	27	65.6 Å²	65.6	17%	0.166	33%	0.33	C	S	.	.	S	Bend	trans	-142.8	161	-172.1	45.8	0	0	0	0	111.2	S85 A91 L95 S145	S85-T93 PolarHBondContact N-O 3.19Å; S85-T93 VanDerWaalsContact N-O 3.13Å; S85-T93 PolarHBondContact OG-O 3.32Å; A91-T93 PolarHBondContact O-N 3.03Å; T93-L95 WeakPolarHBondContact CB-O 3.4Å; T93-L95 PolarHBondContact O-N 2.88Å; T93-L95 PolarHBondContact OG1-O 2.79Å; T93-S145 WeakPolarHBondContact OG1-CB 3.3Å; T93-S145 PolarHBondContact OG1-OG 3.27Å
94	L	66.9	Low	67.6	Low	83 Å²	83	66.9 Å²	66.9	44%	0.435	33%	0.334	S	S	.	.	S	Bend	trans	-60	-29	178.7	-96.3	168.6	0	0	0	113	S84 L86 F143	S84-L94 VanDerWaalsContact CB-O 3.24Å; S84-L94 WeakPolarHBondContact CB-O 3.1Å; S84-L94 PolarHBondContact OG-O 3.47Å; L86-L94 HydrophobicContact CD1-CD2 4.11Å; L86-L94 HydrophobicContact CD2-CD2 4.25Å; L86-L94 HydrophobicContact CG-CD2 3.94Å; L94-F143 HydrophobicContact CB-CB 4.18Å; L94-F143 HydrophobicContact CB-CD1 4.3Å; L94-F143 HydrophobicContact CD1-CD1 3.78Å; L94-F143 HydrophobicContact CD1-CE1 4.12Å; L94-F143 HydrophobicContact CD1-CG 4.36Å
95	L	66.2	Low	67	Low	67 Å²	67	70.1 Å²	70.1	35%	0.351	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	137.6	162.3	-157.4	74.4	0	0	0	109.5	L82 T93 F143 I144 S145	L82-L95 HydrophobicContact CD2-CD2 4.37Å; L82-L95 HydrophobicContact CD2-CG 4.4Å; T93-L95 WeakPolarHBondContact CB-O 3.4Å; T93-L95 PolarHBondContact O-N 2.88Å; T93-L95 PolarHBondContact OG1-O 2.79Å; L95-F143 PolarHBondContact N-O 3.1Å; L95-F143 VanDerWaalsContact O-O 3.13Å; L95-I144 HydrophobicContact CB-CG1 4.33Å; L95-I144 HydrophobicContact CD2-CG1 4.36Å; L95-I144 CarbonylContact O-C 3.59Å; L95-I144 WeakPolarHBondContact O-CA 3.41Å; L95-S145 PolarHBondContact O-N 3.48Å
96	S	69.5	Low	66.5	Low	1 Å²	1	67.8 Å²	67.8	1%	0.007	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	111.6	179.5	53.6	0	0	0	0	109	S83 S145	S83-S96 VanDerWaalsContact C-OG 3.3Å; S83-S96 VanDerWaalsContact CB-OG 3.32Å; S83-S96 WeakPolarHBondContact CB-OG 3.32Å; S83-S96 PolarHBondContact N-O 3.41Å; S83-S96 PolarHBondContact O-N 3.12Å; S83-S96 PolarHBondContact O-OG 2.84Å; S83-S96 PolarHBondContact OG-OG 2.84Å; S96-S145 WeakPolarHBondContact CA-O 3.36Å; S96-S145 WeakPolarHBondContact CA-OG 3.28Å; S96-S145 WeakPolarHBondContact CB-OG 3.46Å
97	A	73	Confident	66.1	Low	12 Å²	12	64.5 Å²	64.5	10%	0.099	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	130.4	172.3	0	0	0	0	0	109.3	Y81 L82 S145 I146 D147	Y81-A97 CarbonylContact O-C 3.45Å; Y81-A97 WeakPolarHBondContact O-CA 3.44Å; L82-A97 HydrophobicContact CD2-CB 4.08Å; A97-S145 PolarHBondContact N-O 3.38Å; A97-I146 HydrophobicContact CB-CG1 4.31Å; A97-I146 HydrophobicContact CB-CG2 4.4Å; A97-I146 CarbonylContact O-C 3.58Å; A97-I146 WeakPolarHBondContact O-CA 3.48Å; A97-D147 PolarHBondContact O-N 2.95Å
98	W	72.3	Confident	65.4	Low	137 Å²	137	59.7 Å²	59.7	52%	0.519	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	104.6	177	-92.1	39	0	0	0	108.6	Y81 D147	Y81-W98 PolarHBondContact N-O 3.47Å; Y81-W98 PolarHBondContact O-N 3.4Å; W98-D147 WeakPolarHBondContact CA-O 3.24Å; W98-D147 HydrophobicContact CG-CB 4.47Å; W98-D147 PolarHBondContact NE1-OD2 3.35Å
99	I	74.4	Confident	65	Low	29 Å²	29	61.6 Å²	61.6	15%	0.149	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	128.1	-177.4	-52.1	-177.8	0	0	0	109.2	V77 I80 V102 I146 D147 I148 S149	V77-I99 HydrophobicContact CG1-CG2 3.52Å; I80-I99 HydrophobicContact CG1-CG1 4.39Å; I80-I99 HydrophobicContact CG1-CG2 4.3Å; I80-I99 HydrophobicContact CG2-CG1 4.35Å; I99-V102 HydrophobicContact CG2-CG2 3.42Å; I99-V102 VanDerWaalsContact CG2-CG2 3.42Å; I99-I146 HydrophobicContact CD1-CG2 3.68Å; I99-I146 HydrophobicContact CG1-CG2 4.07Å; I99-D147 PolarHBondContact N-O 3.16Å; I99-I148 HydrophobicContact CB-CG1 4.22Å; I99-I148 HydrophobicContact CB-CG2 4.17Å; I99-I148 HydrophobicContact CD1-CG1 4.41Å; I99-I148 HydrophobicContact CG2-CG2 4.44Å; I99-I148 WeakPolarHBondContact O-CA 3.37Å; I99-S149 PolarHBondContact O-N 3.23Å; I99-S149 PolarHBondContact O-OG 3.11Å
100	T	71.2	Confident	64.7	Low	32 Å²	32	55.7 Å²	55.7	20%	0.196	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	137.6	-176.9	59.8	0	0	0	0	110.1	D78 S79 Y81 S149	D78-T100 WeakPolarHBondContact CB-O 3.38Å; D78-T100 PolarHBondContact N-O 2.87Å; S79-T100 WeakPolarHBondContact CB-OG1 3.43Å; S79-T100 PolarHBondContact N-O 3.23Å; S79-T100 VanDerWaalsContact N-O 3.12Å; S79-T100 PolarHBondContact N-OG1 2.8Å; S79-T100 PolarHBondContact O-N 2.93Å; S79-T100 PolarHBondContact O-OG1 2.86Å; S79-T100 PolarHBondContact OG-OG1 3.02Å; Y81-T100 HydrophobicContact CD2-CG2 4.16Å; Y81-T100 HydrophobicContact CE2-CG2 4.06Å; T100-S149 WeakPolarHBondContact CA-OG 3.09Å
101	G	60.8	Low	64.8	Low	11 Å²	11	49.5 Å²	49.5	11%	0.113	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	58.7	62.9	175.5	0	0	0	0	0	113.7	V77 D78 S150	V77-G101 CarbonylContact C-O 3.55Å; V77-G101 WeakPolarHBondContact CA-O 3.33Å; D78-G101 PolarHBondContact N-O 3.15Å; G101-S150 PolarHBondContact N-OG 2.97Å; G101-S150 VanDerWaalsContact N-OG 3.11Å
102	V	67.7	Low	64.5	Low	9 Å²	9	55.8 Å²	55.8	6%	0.055	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	110.4	170.4	-178	0	0	0	0	109	M75 Y76 V77 I99 I148 S150 I151 Q152	M75-V102 HydrophobicContact CE-CG1 3.52Å; M75-V102 HydrophobicContact CG-CG1 4.48Å; Y76-V102 WeakPolarHBondContact O-CA 3.3Å; V77-V102 HydrophobicContact CG1-CG2 4.33Å; V77-V102 HydrophobicContact CG2-CG1 4.41Å; V77-V102 HydrophobicContact CG2-CG2 4.26Å; I99-V102 HydrophobicContact CG2-CG2 3.42Å; I99-V102 VanDerWaalsContact CG2-CG2 3.42Å; V102-I148 HydrophobicContact CG2-CG2 3.95Å; V102-S150 PolarHBondContact N-O 2.87Å; V102-I151 HydrophobicContact CB-CG1 4.35Å; V102-I151 HydrophobicContact CB-CG2 4.44Å; V102-I151 HydrophobicContact CG1-CG2 4.37Å; V102-I151 WeakPolarHBondContact O-CA 3.18Å; V102-Q152 PolarHBondContact O-N 2.83Å
103	E	66.1	Low	64.4	Low	69 Å²	69	50.8 Å²	50.8	32%	0.322	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	120	172	-59.9	-160.7	133	0	0	110.1	Y76 Q152	Y76-E103 PolarHBondContact N-O 3.37Å; Y76-E103 PolarHBondContact O-N 3.41Å; E103-Q152 WeakPolarHBondContact CA-O 3.45Å; E103-Q152 HydrophobicContact CG-CB 4.33Å; E103-Q152 PolarHBondContact OE1-NE2 2.71Å
104	F	71.3	Confident	64	Low	41 Å²	41	51.2 Å²	51.2	18%	0.18	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	108.6	179.4	-168.9	-103.3	0	0	0	110	F69 M75 A106 I114 Q152 I153 V154	F69-F104 HydrophobicContact CE2-CE2 4.1Å; M75-F104 HydrophobicContact CB-CD2 3.89Å; M75-F104 HydrophobicContact CB-CE2 4.3Å; M75-F104 HydrophobicContact CG-CD2 4.08Å; F104-A106 HydrophobicContact CD1-CB 3.97Å; F104-A106 HydrophobicContact CE1-CB 3.56Å; F104-A106 HydrophobicContact CZ-CB 4.41Å; F104-I114 HydrophobicContact CZ-CD1 4.21Å; F104-Q152 PolarHBondContact N-O 2.89Å; F104-I153 HydrophobicContact CD1-CG2 4.31Å; F104-V154 PolarHBondContact O-N 2.89Å
105	H	61.4	Low	63.6	Low	72 Å²	72	51.2 Å²	51.2	33%	0.333	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	113.7	176.9	-69.5	-96.8	0	0	0	109.8	C74	C74-H105 PolarHBondContact O-N 3.39Å; C74-H105 VanDerWaalsContact O-N 3.12Å
106	A	61.1	Low	63	Low	4 Å²	4	51.8 Å²	51.8	3%	0.033	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	145.9	-179	0	0	0	0	0	111.7	E73 F104 L111 V154	E73-A106 WeakPolarHBondContact OE1-CB 3.35Å; F104-A106 HydrophobicContact CD1-CB 3.97Å; F104-A106 HydrophobicContact CE1-CB 3.56Å; F104-A106 HydrophobicContact CZ-CB 4.41Å; A106-L111 HydrophobicContact CB-CD1 4.15Å; A106-L111 HydrophobicContact CB-CG 4.21Å; A106-V154 PolarHBondContact N-O 2.8Å
107	T	61.6	Low	62.4	Low	62 Å²	62	55 Å²	55	38%	0.38	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	158	167.8	59.9	0	0	0	0	110	T109 G110 L111	T107-T109 PolarHBondContact O-N 3.36Å; T107-T109 PolarHBondContact OG1-OG1 2.9Å; T107-T109 VanDerWaalsContact OG1-OG1 3.12Å; T107-G110 PolarHBondContact O-N 2.98Å; T107-G110 PolarHBondContact OG1-N 2.67Å; T107-L111 PolarHBondContact O-N 3.49Å; T107-L111 VanDerWaalsContact O-N 3.1Å
108	D	57.5	Low	61.3	Low	67 Å²	67	60 Å²	60	36%	0.358	31%	0.305	S	S	.	.	H	α-helix	trans	-55.9	-34.3	174.2	63	-17.4	0	0	0	113.1
109	T	58.2	Low	60.4	Low	98 Å²	98	59.4 Å²	59.4	60%	0.601	31%	0.308	S	S	*	.	H	α-helix	trans	-75.6	-41.9	175.6	44.2	0	0	0	0	113.6	T107 A113	T107-T109 PolarHBondContact O-N 3.36Å; T107-T109 PolarHBondContact OG1-OG1 2.9Å; T107-T109 VanDerWaalsContact OG1-OG1 3.12Å; T109-A113 PolarHBondContact O-N 3.1Å
110	G	60.4	Low	59.3	Low	6 Å²	6	66.9 Å²	66.9	6%	0.062	33%	0.334	C	S	.	.	H	α-helix	trans	-68.6	-44.3	-178.4	0	0	0	0	0	113.2	E73 T107 Y112 A113 I114	E73-G110 VanDerWaalsContact CD-C 3.44Å; E73-G110 VanDerWaalsContact CD-CA 3.41Å; E73-G110 VanDerWaalsContact OE1-CA 3.3Å; E73-G110 WeakPolarHBondContact OE1-CA 3.29Å; E73-G110 WeakPolarHBondContact OE2-CA 3.49Å; T107-G110 PolarHBondContact O-N 2.98Å; T107-G110 PolarHBondContact OG1-N 2.67Å; G110-Y112 VanDerWaalsContact C-N 3.28Å; G110-Y112 PolarHBondContact O-N 2.91Å; G110-A113 CarbonylContact O-C 3.55Å; G110-A113 WeakPolarHBondContact O-CA 3.35Å; G110-A113 WeakPolarHBondContact O-CB 3.45Å; G110-A113 PolarHBondContact O-N 3.08Å; G110-I114 PolarHBondContact O-N 2.93Å
111	L	57.2	Low	58.2	Low	60 Å²	60	69.6 Å²	69.6	31%	0.314	34%	0.343	S	S	.	.	H	α-helix	trans	-60.2	-38.8	-180	-133.3	172	0	0	0	111.8	E73 A106 T107 I114 I115	E73-L111 PolarHBondContact OE1-N 3.15Å; E73-L111 VanDerWaalsContact OE1-N 3.11Å; A106-L111 HydrophobicContact CB-CD1 4.15Å; A106-L111 HydrophobicContact CB-CG 4.21Å; T107-L111 PolarHBondContact O-N 3.49Å; T107-L111 VanDerWaalsContact O-N 3.1Å; L111-I114 PolarHBondContact O-N 3.12Å; L111-I115 HydrophobicContact CD2-CD1 4.11Å; L111-I115 WeakPolarHBondContact O-CG1 3.33Å; L111-I115 PolarHBondContact O-N 3.49Å
112	Y	54.3	Low	57.4	Low	148 Å²	148	71.4 Å²	71.4	58%	0.58	36%	0.362	S	S	*	.	H	α-helix	trans	-65.6	-36.9	172.6	-178.5	-99.9	0	0	0	112.2	G110 K116	G110-Y112 VanDerWaalsContact C-N 3.28Å; G110-Y112 PolarHBondContact O-N 2.91Å; Y112-K116 HydrophobicContact CE1-CD 3.91Å; Y112-K116 WeakPolarHBondContact O-CB 3.38Å; Y112-K116 PolarHBondContact O-N 3.22Å
113	A	55.7	Low	56	Low	31 Å²	31	77.9 Å²	77.9	26%	0.256	40%	0.396	S	S	.	.	H	α-helix	trans	-68.4	-41	175.6	0	0	0	0	0	112.6	N71 T109 G110 I115 K116 V117	N71-A113 WeakPolarHBondContact ND2-CB 3.17Å; T109-A113 PolarHBondContact O-N 3.1Å; G110-A113 CarbonylContact O-C 3.55Å; G110-A113 WeakPolarHBondContact O-CA 3.35Å; G110-A113 WeakPolarHBondContact O-CB 3.45Å; G110-A113 PolarHBondContact O-N 3.08Å; A113-I115 PolarHBondContact O-N 3.23Å; A113-K116 PolarHBondContact O-N 2.9Å; A113-V117 WeakPolarHBondContact O-CG2 3.36Å; A113-V117 PolarHBondContact O-N 3.17Å
114	I	57.8	Low	54.7	Low	36 Å²	36	77.7 Å²	77.7	19%	0.185	41%	0.412	C	S	.	.	H	α-helix	trans	-57.6	-49.2	173.8	-71.7	179	0	0	0	110.7	E73 F104 G110 L111 K116 V117 M118	E73-I114 VanDerWaalsContact OE2-CD1 3.25Å; E73-I114 WeakPolarHBondContact OE2-CD1 3.45Å; E73-I114 WeakPolarHBondContact OE2-CG1 3.37Å; F104-I114 HydrophobicContact CZ-CD1 4.21Å; G110-I114 PolarHBondContact O-N 2.93Å; L111-I114 PolarHBondContact O-N 3.12Å; I114-K116 VanDerWaalsContact C-N 3.3Å; I114-K116 PolarHBondContact O-N 2.76Å; I114-V117 PolarHBondContact O-N 3.47Å; I114-M118 PolarHBondContact O-N 2.96Å
115	I	58.6	Low	53.2	Low	83 Å²	83	82.3 Å²	82.3	43%	0.426	44%	0.437	S	S	.	.	H	α-helix	trans	-58.7	-44	178.3	-67.7	166.6	0	0	0	110.5	L111 A113 V117 M118 Q119	L111-I115 HydrophobicContact CD2-CD1 4.11Å; L111-I115 WeakPolarHBondContact O-CG1 3.33Å; L111-I115 PolarHBondContact O-N 3.49Å; A113-I115 PolarHBondContact O-N 3.23Å; I115-V117 PolarHBondContact O-N 3.01Å; I115-M118 PolarHBondContact O-N 2.84Å; I115-Q119 WeakPolarHBondContact O-CB 3.43Å; I115-Q119 WeakPolarHBondContact O-CG 3.46Å; I115-Q119 PolarHBondContact O-N 3.3Å
116	K	53.5	Low	51.7	Low	80 Å²	80	90 Å²	90	35%	0.348	46%	0.464	S	S	.	.	H	α-helix	trans	-68.8	-30.8	-179.9	-161.3	165.3	-170.3	164.7	0	113.2	Y112 A113 I114 R120	Y112-K116 HydrophobicContact CE1-CD 3.91Å; Y112-K116 WeakPolarHBondContact O-CB 3.38Å; Y112-K116 PolarHBondContact O-N 3.22Å; A113-K116 PolarHBondContact O-N 2.9Å; I114-K116 VanDerWaalsContact C-N 3.3Å; I114-K116 PolarHBondContact O-N 2.76Å; K116-R120 WeakPolarHBondContact O-CB 3.43Å; K116-R120 VanDerWaalsContact O-CG 3.27Å; K116-R120 WeakPolarHBondContact O-CG 3.48Å; K116-R120 PolarHBondContact O-N 2.87Å; K116-R120 VanDerWaalsContact O-N 3.1Å
117	V	57.6	Low	50.5	Low	68 Å²	68	96.1 Å²	96.1	41%	0.412	50%	0.5	S	S	.	.	H	α-helix	trans	-72.8	-43	172.7	168.5	0	0	0	0	111.2	A113 I114 I115 R120 K121	A113-V117 WeakPolarHBondContact O-CG2 3.36Å; A113-V117 PolarHBondContact O-N 3.17Å; I114-V117 PolarHBondContact O-N 3.47Å; I115-V117 PolarHBondContact O-N 3.01Å; V117-R120 PolarHBondContact O-N 3.39Å; V117-K121 PolarHBondContact O-N 3.16Å; V117-K121 VanDerWaalsContact O-N 3.08Å
118	M	49.5	Very low	49.1	Very low	116 Å²	116	102 Å²	102	57%	0.571	52%	0.523	S	S	*	.	H	α-helix	trans	-63.6	-41.9	175.5	-73.6	-164.1	172.9	0	0	112.1	I48 I114 I115 K121 G122	I48-M118 HydrophobicContact CD1-CE 3.92Å; I114-M118 PolarHBondContact O-N 2.96Å; I115-M118 PolarHBondContact O-N 2.84Å; M118-K121 PolarHBondContact O-N 2.74Å; M118-G122 PolarHBondContact O-N 2.75Å; M118-G122 VanDerWaalsContact O-N 3.13Å
119	Q	53.7	Low	48	Very low	125 Å²	125	107.1 Å²	107.1	58%	0.584	55%	0.55	S	S	*	.	H	α-helix	trans	-59.1	-53	173.4	-74.5	171.7	-14	0	0	111.3	I115 K121 G122	I115-Q119 WeakPolarHBondContact O-CB 3.43Å; I115-Q119 WeakPolarHBondContact O-CG 3.46Å; I115-Q119 PolarHBondContact O-N 3.3Å; Q119-K121 PolarHBondContact O-N 2.99Å; Q119-K121 VanDerWaalsContact O-N 3.13Å; Q119-G122 PolarHBondContact O-N 2.86Å
120	R	49.8	Very low	47	Very low	187 Å²	187	108.4 Å²	108.4	71%	0.706	55%	0.553	S	S	*	*	H	α-helix	trans	-60.8	-23.1	179.6	-78.1	172.4	166.6	177.9	-7.6	114.9	K116 V117	K116-R120 WeakPolarHBondContact O-CB 3.43Å; K116-R120 VanDerWaalsContact O-CG 3.27Å; K116-R120 WeakPolarHBondContact O-CG 3.48Å; K116-R120 PolarHBondContact O-N 2.87Å; K116-R120 VanDerWaalsContact O-N 3.1Å; V117-R120 PolarHBondContact O-N 3.39Å
121	K	48.6	Very low	46	Very low	89 Å²	89	118 Å²	118	39%	0.387	59%	0.593	S	S	.	*	H	α-helix	trans	-90.9	-16.7	175.6	-156.7	171.9	178.3	-176.1	0	112.9	K46 F47 V117 M118 Q119	K46-K121 PolarHBondContact O-NZ 3.19Å; F47-K121 PolarHBondContact O-NZ 3.3Å; V117-K121 PolarHBondContact O-N 3.16Å; V117-K121 VanDerWaalsContact O-N 3.08Å; M118-K121 PolarHBondContact O-N 2.74Å; Q119-K121 PolarHBondContact O-N 2.99Å; Q119-K121 VanDerWaalsContact O-N 3.13Å
122	G	43.7	Very low	45.4	Very low	49 Å²	49	118.1 Å²	118.1	51%	0.505	61%	0.609	S	S	.	*	H	α-helix	trans	-68.2	-41.6	175.7	0	0	0	0	0	113.2	M118 Q119 G124	M118-G122 PolarHBondContact O-N 2.75Å; M118-G122 VanDerWaalsContact O-N 3.13Å; Q119-G122 PolarHBondContact O-N 2.86Å; G122-G124 PolarHBondContact O-N 2.83Å
123	D	39.6	Very low	44.8	Very low	145 Å²	145	118.3 Å²	118.3	78%	0.775	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	-16	-176.7	-60.7	-40.3	0	0	0	113.7
124	G	38.3	Very low	44.2	Very low	64 Å²	64	122.5 Å²	122.5	66%	0.66	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	-8.9	-177.8	0	0	0	0	0	116.1	G122	G122-G124 PolarHBondContact O-N 2.83Å
125	I	38.7	Very low	44.1	Very low	138 Å²	138	124 Å²	124	71%	0.708	64%	0.642	S	S	*	*			trans	-112.9	61.7	-171.7	-47	179.6	0	0	0	110.5
126	R	31.1	Very low	43.8	Very low	235 Å²	235	128.1 Å²	128.1	89%	0.887	65%	0.652	S	S	*	*			trans	-132.4	27.6	-177.8	-145.1	-177.2	-179.6	-165.7	-1.2	116.2
127	T	35.3	Very low	43.7	Very low	131 Å²	131	130.3 Å²	130.3	80%	0.804	66%	0.662	S	S	*	*	S	Bend	trans	-136	142.3	169.7	43.8	0	0	0	0	112.7
128	H	32.2	Very low	43.5	Very low	185 Å²	185	132.1 Å²	132.1	86%	0.856	67%	0.668	S	S	*	*			trans	39.8	84.4	164.1	-90.7	-98.3	0	0	0	119.8
129	L	34.9	Very low	43.6	Very low	176 Å²	176	134.6 Å²	134.6	92%	0.921	67%	0.671	S	S	*	*			trans	-141.7	141.7	147.1	-100.1	173.4	0	0	0	110.9
130	N	37.5	Very low	43.6	Very low	125 Å²	125	132.6 Å²	132.6	67%	0.668	66%	0.664	S	S	*	*			trans	-70.8	130.1	-162.7	-81.6	-25.5	0	0	0	114.8	G132 F133	N130-G132 PolarHBondContact O-N 2.79Å; N130-G132 VanDerWaalsContact O-N 3.07Å; N130-F133 PolarHBondContact O-N 2.72Å; N130-F133 VanDerWaalsContact O-N 3.16Å
131	K	38.3	Very low	43.9	Very low	207 Å²	207	129.3 Å²	129.3	90%	0.9	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.6	-26.9	-178.5	-74	-178.1	176	176.5	0	114.8
132	G	45.9	Very low	44.2	Very low	62 Å²	62	126.5 Å²	126.5	64%	0.639	65%	0.651	S	S	*	*	H	α-helix	trans	-66.2	-38.2	178	0	0	0	0	0	114.3	N130 M134 S135	N130-G132 PolarHBondContact O-N 2.79Å; N130-G132 VanDerWaalsContact O-N 3.07Å; G132-M134 VanDerWaalsContact C-N 3.32Å; G132-M134 PolarHBondContact O-N 3.32Å; G132-S135 PolarHBondContact O-N 3.09Å
133	F	41.6	Very low	44.8	Very low	152 Å²	152	129.1 Å²	129.1	67%	0.667	65%	0.648	S	S	*	*	H	α-helix	trans	-76	-15.3	-171.1	-104.2	-84.4	0	0	0	114.7	N130	N130-F133 PolarHBondContact O-N 2.72Å; N130-F133 VanDerWaalsContact O-N 3.16Å
134	M	42	Very low	45.6	Very low	119 Å²	119	126.2 Å²	126.2	59%	0.586	63%	0.632	S	S	*	*	H	α-helix	trans	-74.8	-29.4	175.6	-85	-62.2	-168.6	0	0	113.1	G132 W136 K137 I138	G132-M134 VanDerWaalsContact C-N 3.32Å; G132-M134 PolarHBondContact O-N 3.32Å; M134-W136 PolarHBondContact O-N 2.8Å; M134-K137 PolarHBondContact O-N 3.1Å; M134-I138 HydrophobicContact CB-CD1 4.2Å; M134-I138 WeakPolarHBondContact O-CB 3.31Å; M134-I138 VanDerWaalsContact O-CG1 3.29Å; M134-I138 WeakPolarHBondContact O-CG1 3.41Å; M134-I138 PolarHBondContact O-N 3.34Å
135	S	55.1	Low	46.8	Very low	67 Å²	67	124.4 Å²	124.4	47%	0.469	61%	0.609	S	S	.	*	H	α-helix	trans	-58.1	-48.6	-176.1	-175.2	0	0	0	0	112.4	G132 R139	G132-S135 PolarHBondContact O-N 3.09Å; S135-R139 WeakPolarHBondContact O-CG 3.42Å; S135-R139 PolarHBondContact O-N 3.11Å
136	W	53.8	Low	48	Very low	171 Å²	171	122.7 Å²	122.7	65%	0.648	60%	0.601	S	S	*	*	H	α-helix	trans	-70.7	-37.8	179.2	-177.3	29.4	0	0	0	112.9	M134 I138 R139 L140	M134-W136 PolarHBondContact O-N 2.8Å; W136-I138 PolarHBondContact O-N 3.04Å; W136-R139 CarbonylContact O-C 3.54Å; W136-R139 PolarHBondContact O-N 2.71Å; W136-L140 HydrophobicContact CD2-CD1 4.3Å; W136-L140 HydrophobicContact CG-CD1 4.46Å; W136-L140 HydrophobicContact CZ2-CD1 4.12Å; W136-L140 PolarHBondContact O-N 3.45Å
137	K	49.6	Very low	49.3	Very low	125 Å²	125	112.8 Å²	112.8	54%	0.543	57%	0.565	S	S	.	*	H	α-helix	trans	-64.4	-39.3	176.7	-72.2	-169.8	175.6	-175.3	0	112.4	M134 L140 I141	M134-K137 PolarHBondContact O-N 3.1Å; K137-L140 PolarHBondContact O-N 2.82Å; K137-I141 WeakPolarHBondContact O-CD1 3.42Å; K137-I141 WeakPolarHBondContact O-CG1 3.47Å; K137-I141 PolarHBondContact O-N 2.99Å
138	I	55.1	Low	50.6	Low	106 Å²	106	108.5 Å²	108.5	54%	0.544	54%	0.537	S	S	.	.	H	α-helix	trans	-67.1	-40.4	174.8	-66.1	166.7	0	0	0	110.5	M134 W136 L140 I141 S142	M134-I138 HydrophobicContact CB-CD1 4.2Å; M134-I138 WeakPolarHBondContact O-CB 3.31Å; M134-I138 VanDerWaalsContact O-CG1 3.29Å; M134-I138 WeakPolarHBondContact O-CG1 3.41Å; M134-I138 PolarHBondContact O-N 3.34Å; W136-I138 PolarHBondContact O-N 3.04Å; I138-L140 VanDerWaalsContact C-N 3.32Å; I138-L140 PolarHBondContact O-N 2.94Å; I138-I141 PolarHBondContact O-N 3.21Å; I138-S142 PolarHBondContact O-N 3.34Å
139	R	50.1	Low	51.5	Low	169 Å²	169	102.3 Å²	102.3	64%	0.638	51%	0.514	S	S	*	.	H	α-helix	trans	-66	-25.9	171.6	-74.4	179.3	176.3	-175.8	-0.8	114.4	S135 W136 S142 F143	S135-R139 WeakPolarHBondContact O-CG 3.42Å; S135-R139 PolarHBondContact O-N 3.11Å; W136-R139 CarbonylContact O-C 3.54Å; W136-R139 PolarHBondContact O-N 2.71Å; R139-S142 WeakPolarHBondContact CA-OG 3.45Å; R139-S142 PolarHBondContact O-OG 3.19Å; R139-F143 WeakPolarHBondContact O-CD2 3.34Å; R139-F143 VanDerWaalsContact O-CE2 3.23Å; R139-F143 WeakPolarHBondContact O-CE2 3.11Å
140	L	55.2	Low	52.5	Low	83 Å²	83	96.2 Å²	96.2	44%	0.435	49%	0.487	S	S	.	.	H	α-helix	trans	-75.3	-39.9	172.4	-86	167	0	0	0	111.3	W136 K137 I138 S142 F143	W136-L140 HydrophobicContact CD2-CD1 4.3Å; W136-L140 HydrophobicContact CG-CD1 4.46Å; W136-L140 HydrophobicContact CZ2-CD1 4.12Å; W136-L140 PolarHBondContact O-N 3.45Å; K137-L140 PolarHBondContact O-N 2.82Å; I138-L140 VanDerWaalsContact C-N 3.32Å; I138-L140 PolarHBondContact O-N 2.94Å; L140-S142 VanDerWaalsContact C-N 3.25Å; L140-S142 PolarHBondContact O-N 3.39Å; L140-F143 PolarHBondContact O-N 2.76Å; L140-F143 VanDerWaalsContact O-N 3.1Å
141	I	54.6	Low	53.5	Low	117 Å²	117	92.9 Å²	92.9	60%	0.6	47%	0.468	S	S	*	.	H	α-helix	trans	-61.2	-33.8	176	-69.7	160.9	0	0	0	111.4	K137 I138 F143 I144	K137-I141 WeakPolarHBondContact O-CD1 3.42Å; K137-I141 WeakPolarHBondContact O-CG1 3.47Å; K137-I141 PolarHBondContact O-N 2.99Å; I138-I141 PolarHBondContact O-N 3.21Å; I141-F143 PolarHBondContact O-N 2.87Å; I141-F143 VanDerWaalsContact O-N 3.15Å; I141-I144 PolarHBondContact O-N 3.5Å; I141-I144 VanDerWaalsContact O-N 3.1Å
142	S	55.3	Low	54	Low	30 Å²	30	87.7 Å²	87.7	21%	0.21	45%	0.447	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-19	175.4	51.5	0	0	0	0	114.8	I138 R139 L140 L329	I138-S142 PolarHBondContact O-N 3.34Å; R139-S142 WeakPolarHBondContact CA-OG 3.45Å; R139-S142 PolarHBondContact O-OG 3.19Å; L140-S142 VanDerWaalsContact C-N 3.25Å; L140-S142 PolarHBondContact O-N 3.39Å; S142-L329 WeakPolarHBondContact O-CD2 3.35Å
143	F	57	Low	54.5	Low	105 Å²	105	90 Å²	90	46%	0.461	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-1.5	176.8	-65.7	-63.8	0	0	0	114.1	L94 L95 R139 L140 I141	L94-F143 HydrophobicContact CB-CB 4.18Å; L94-F143 HydrophobicContact CB-CD1 4.3Å; L94-F143 HydrophobicContact CD1-CD1 3.78Å; L94-F143 HydrophobicContact CD1-CE1 4.12Å; L94-F143 HydrophobicContact CD1-CG 4.36Å; L95-F143 PolarHBondContact N-O 3.1Å; L95-F143 VanDerWaalsContact O-O 3.13Å; R139-F143 WeakPolarHBondContact O-CD2 3.34Å; R139-F143 VanDerWaalsContact O-CE2 3.23Å; R139-F143 WeakPolarHBondContact O-CE2 3.11Å; L140-F143 PolarHBondContact O-N 2.76Å; L140-F143 VanDerWaalsContact O-N 3.1Å; I141-F143 PolarHBondContact O-N 2.87Å; I141-F143 VanDerWaalsContact O-N 3.15Å
144	I	56.6	Low	54.8	Low	83 Å²	83	84.6 Å²	84.6	43%	0.426	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	116.9	-175.8	-55.5	173.5	0	0	0	109.6	L95 I141 I146	L95-I144 HydrophobicContact CB-CG1 4.33Å; L95-I144 HydrophobicContact CD2-CG1 4.36Å; L95-I144 CarbonylContact O-C 3.59Å; L95-I144 WeakPolarHBondContact O-CA 3.41Å; I141-I144 PolarHBondContact O-N 3.5Å; I141-I144 VanDerWaalsContact O-N 3.1Å; I144-I146 HydrophobicContact CG2-CG1 4.46Å
145	S	62.2	Low	55.2	Low	26 Å²	26	82.7 Å²	82.7	18%	0.182	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	153.8	162.2	83.3	0	0	0	0	110.9	T93 L95 S96 A97	T93-S145 WeakPolarHBondContact OG1-CB 3.3Å; T93-S145 PolarHBondContact OG1-OG 3.27Å; L95-S145 PolarHBondContact O-N 3.48Å; S96-S145 WeakPolarHBondContact CA-O 3.36Å; S96-S145 WeakPolarHBondContact CA-OG 3.28Å; S96-S145 WeakPolarHBondContact CB-OG 3.46Å; A97-S145 PolarHBondContact N-O 3.38Å
146	I	64.1	Low	54.7	Low	103 Å²	103	85 Å²	85	53%	0.528	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	106.7	166.6	-51.8	-178.6	0	0	0	106.5	A97 I99 I144 I148	A97-I146 HydrophobicContact CB-CG1 4.31Å; A97-I146 HydrophobicContact CB-CG2 4.4Å; A97-I146 CarbonylContact O-C 3.58Å; A97-I146 WeakPolarHBondContact O-CA 3.48Å; I99-I146 HydrophobicContact CD1-CG2 3.68Å; I99-I146 HydrophobicContact CG1-CG2 4.07Å; I144-I146 HydrophobicContact CG2-CG1 4.46Å; I146-I148 HydrophobicContact CG2-CD1 4.43Å; I146-I148 HydrophobicContact CG2-CG1 3.98Å
147	D	59.5	Low	54.3	Low	26 Å²	26	80.6 Å²	80.6	14%	0.139	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	128	168.9	-70.3	-59	0	0	0	107	A97 W98 I99 R325	A97-D147 PolarHBondContact O-N 2.95Å; W98-D147 WeakPolarHBondContact CA-O 3.24Å; W98-D147 HydrophobicContact CG-CB 4.47Å; W98-D147 PolarHBondContact NE1-OD2 3.35Å; I99-D147 PolarHBondContact N-O 3.16Å; D147-R325 IonicContact OD1-CZ 3.63Å; D147-R325 IonicContact OD1-NE 2.77Å; D147-R325 PolarHBondContact OD1-NE 2.67Å; D147-R325 IonicContact OD1-NH2 2.76Å; D147-R325 PolarHBondContact OD1-NH2 2.92Å; D147-R325 IonicContact OD2-NH2 2.72Å; D147-R325 PolarHBondContact OD2-NH2 3Å; D147-R325 VanDerWaalsContact OD2-NH2 3.14Å
148	I	61.2	Low	53.7	Low	42 Å²	42	79.6 Å²	79.6	22%	0.215	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	117.2	177.2	-48.6	-179.8	0	0	0	108.8	I99 V102 I146 I151 L324	I99-I148 HydrophobicContact CB-CG1 4.22Å; I99-I148 HydrophobicContact CB-CG2 4.17Å; I99-I148 HydrophobicContact CD1-CG1 4.41Å; I99-I148 HydrophobicContact CG2-CG2 4.44Å; I99-I148 WeakPolarHBondContact O-CA 3.37Å; V102-I148 HydrophobicContact CG2-CG2 3.95Å; I146-I148 HydrophobicContact CG2-CD1 4.43Å; I146-I148 HydrophobicContact CG2-CG1 3.98Å; I148-I151 HydrophobicContact CB-CD1 4.37Å; I148-I151 HydrophobicContact CB-CG1 4.42Å; I148-I151 HydrophobicContact CD1-CD1 4.18Å; I148-I151 HydrophobicContact CG2-CD1 3.93Å; I148-I151 HydrophobicContact CG2-CG1 3.52Å; I148-L324 PolarHBondContact O-N 2.91Å
149	S	52.6	Low	52.8	Low	55 Å²	55	82.2 Å²	82.2	39%	0.385	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	-37.3	-171.6	67.8	0	0	0	0	113.3	I99 T100 G323	I99-S149 PolarHBondContact O-N 3.23Å; I99-S149 PolarHBondContact O-OG 3.11Å; T100-S149 WeakPolarHBondContact CA-OG 3.09Å; S149-G323 PolarHBondContact O-N 3.13Å
150	S	54.9	Low	52.2	Low	48 Å²	48	83.6 Å²	83.6	34%	0.336	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	132.9	-178	44.2	0	0	0	0	110.4	G101 V102	G101-S150 PolarHBondContact N-OG 2.97Å; G101-S150 VanDerWaalsContact N-OG 3.11Å; V102-S150 PolarHBondContact N-O 2.87Å
151	I	59.1	Low	51.1	Low	55 Å²	55	86.9 Å²	86.9	28%	0.282	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	119.8	170.5	-53.8	176.5	0	0	0	107.2	V102 I148 I153	V102-I151 HydrophobicContact CB-CG1 4.35Å; V102-I151 HydrophobicContact CB-CG2 4.44Å; V102-I151 HydrophobicContact CG1-CG2 4.37Å; V102-I151 WeakPolarHBondContact O-CA 3.18Å; I148-I151 HydrophobicContact CB-CD1 4.37Å; I148-I151 HydrophobicContact CB-CG1 4.42Å; I148-I151 HydrophobicContact CD1-CD1 4.18Å; I148-I151 HydrophobicContact CG2-CD1 3.93Å; I148-I151 HydrophobicContact CG2-CG1 3.52Å; I151-I153 HydrophobicContact CG2-CD1 4.43Å; I151-I153 HydrophobicContact CG2-CG1 3.95Å
152	Q	47.9	Very low	50	Low	98 Å²	98	87.6 Å²	87.6	46%	0.458	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	117.1	174.7	-171.2	171.1	-72.9	0	0	108.1	V102 E103 F104 V154	V102-Q152 PolarHBondContact O-N 2.83Å; E103-Q152 WeakPolarHBondContact CA-O 3.45Å; E103-Q152 HydrophobicContact CG-CB 4.33Å; E103-Q152 PolarHBondContact OE1-NE2 2.71Å; F104-Q152 PolarHBondContact N-O 2.89Å; Q152-V154 HydrophobicContact CG-CG2 4.13Å
153	I	58.1	Low	49	Very low	110 Å²	110	94 Å²	94	56%	0.564	50%	0.497	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.8	110.2	178.6	-53.9	-179.1	0	0	0	107.3	F104 I151 V155	F104-I153 HydrophobicContact CD1-CG2 4.31Å; I151-I153 HydrophobicContact CG2-CD1 4.43Å; I151-I153 HydrophobicContact CG2-CG1 3.95Å; I153-V155 HydrophobicContact CG2-CG2 3.93Å
154	V	47.2	Very low	47.9	Very low	39 Å²	39	93.5 Å²	93.5	24%	0.236	51%	0.512	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	98.4	-179.5	-175.6	0	0	0	0	108.3	F104 A106 Q152 L156	F104-V154 PolarHBondContact O-N 2.89Å; A106-V154 PolarHBondContact N-O 2.8Å; Q152-V154 HydrophobicContact CG-CG2 4.13Å; V154-L156 HydrophobicContact CG1-CG 4.27Å
155	V	49.8	Very low	46.7	Very low	79 Å²	79	97.1 Å²	97.1	48%	0.479	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	104.4	173.9	-173.6	0	0	0	0	109	I153 S157	I153-V155 HydrophobicContact CG2-CG2 3.93Å; V155-S157 PolarHBondContact O-N 2.85Å
156	L	44.6	Very low	45.3	Very low	114 Å²	114	106.6 Å²	106.6	60%	0.597	56%	0.564	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-83.7	102.2	175.8	-74.9	159.5	0	0	0	109.4	V154	V154-L156 HydrophobicContact CG1-CG 4.27Å
157	S	44.8	Very low	43.7	Very low	79 Å²	79	106.4 Å²	106.4	55%	0.552	57%	0.572	S	S	*	*			trans	-91.7	117.3	173.3	-169.9	0	0	0	0	110.4	V155	V155-S157 PolarHBondContact O-N 2.85Å
158	T	37.7	Very low	42.4	Very low	105 Å²	105	112.9 Å²	112.9	64%	0.644	61%	0.607	S	S	*	*			trans	-93.7	8.1	-170.7	49.2	0	0	0	0	114.6
159	K	36.4	Very low	40.9	Very low	161 Å²	161	121.7 Å²	121.7	70%	0.7	64%	0.639	S	S	*	*			trans	-109.7	46.9	-168.4	-69.1	-170.5	171.1	-176.3	0	115
160	F	36.7	Very low	40	Very low	197 Å²	197	125.9 Å²	125.9	86%	0.864	65%	0.651	S	S	*	*	S	Bend	trans	-133.8	17.9	-179.5	-108.2	-75.7	0	0	0	114.8
161	L	32.7	Very low	38.7	Very low	153 Å²	153	134.2 Å²	134.2	80%	0.801	68%	0.681	S	S	*	*	S	Bend	trans	-128.6	-15	-174.5	-79.6	169.3	0	0	0	117
162	D	32.6	Very low	37.4	Very low	132 Å²	132	134.4 Å²	134.4	71%	0.706	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-83.8	-25.6	-168.3	-66.4	-38.7	0	0	0	115.7	A164	D162-A164 PolarHBondContact O-N 2.94Å
163	D	34.4	Very low	36.7	Very low	165 Å²	165	137.3 Å²	137.3	88%	0.882	70%	0.704	S	S	*	*	G	3₁₀ helix	trans	-70.6	-1.9	-174.6	-73	-31.3	0	0	0	114.4	L165	D163-L165 VanDerWaalsContact C-N 3.3Å; D163-L165 PolarHBondContact O-N 2.93Å
164	A	32.7	Very low	35.3	Very low	93 Å²	93	140.6 Å²	140.6	77%	0.769	72%	0.723	S	S	*	*	G	3₁₀ helix	trans	-77.5	-7.6	-179.9	0	0	0	0	0	114.7	D162	D162-A164 PolarHBondContact O-N 2.94Å
165	L	31.5	Very low	34.5	Very low	160 Å²	160	142.1 Å²	142.1	84%	0.838	75%	0.746	S	S	*	*	G	3₁₀ helix	trans	-105.9	-5.8	-172.5	-85.4	167.8	0	0	0	115.9	D163 S167	D163-L165 VanDerWaalsContact C-N 3.3Å; D163-L165 PolarHBondContact O-N 2.93Å; L165-S167 VanDerWaalsContact C-N 3.3Å; L165-S167 PolarHBondContact O-N 3.37Å
166	Y	33.7	Very low	33.7	Very low	224 Å²	224	143 Å²	143	88%	0.878	76%	0.762	S	S	*	*			trans	-91.8	43.8	-175.5	-135.3	-90.6	0	0	0	114.6
167	S	30.4	Very low	33.3	Very low	99 Å²	99	144.6 Å²	144.6	69%	0.692	77%	0.77	S	S	*	*			trans	-128.5	95.3	176	-167.9	0	0	0	0	111.1	L165	L165-S167 VanDerWaalsContact C-N 3.3Å; L165-S167 PolarHBondContact O-N 3.37Å
168	N	31	Very low	32.8	Very low	163 Å²	163	146.7 Å²	146.7	87%	0.872	78%	0.775	S	S	*	*	S	Bend	trans	170.9	-9.7	149.4	-94.2	-37.2	0	0	0	114.3
169	Y	31.2	Very low	32.6	Very low	227 Å²	227	148.3 Å²	148.3	89%	0.89	78%	0.78	S	S	*	*	S	Bend	trans	-83.2	136.6	178.7	-111.9	-98.1	0	0	0	113.5
170	K	32.3	Very low	32.6	Very low	143 Å²	143	145.6 Å²	145.6	62%	0.622	78%	0.777	S	S	*	*			trans	65.8	60	172.3	-144.4	-179.2	-178	-172.4	0	117.9	A172 E173	K170-A172 HydrophobicContact CG-CB 3.88Å; K170-A172 PolarHBondContact O-N 2.95Å; K170-E173 WeakPolarHBondContact CE-OE2 3.39Å; K170-E173 IonicContact NZ-OE2 3.91Å; K170-E173 PolarHBondContact NZ-OE2 2.96Å
171	K	28.7	Very low	32.4	Very low	222 Å²	222	143.3 Å²	143.3	97%	0.965	77%	0.774	S	S	*	*			trans	-71.4	84.4	132.1	-87.3	-169.3	175.1	-176.9	0	108.9
172	A	30.3	Very low	32.5	Very low	60 Å²	60	141 Å²	141	50%	0.496	77%	0.771	S	S	.	*			trans	-157.7	143.3	167.8	0	0	0	0	0	109.1	K170	K170-A172 HydrophobicContact CG-CB 3.88Å; K170-A172 PolarHBondContact O-N 2.95Å
173	E	33.7	Very low	32.4	Very low	159 Å²	159	141.6 Å²	141.6	74%	0.743	77%	0.774	S	S	*	*			trans	74	57.4	178.9	-55.2	172.3	126	0	0	115.7	K170	K170-E173 WeakPolarHBondContact CE-OE2 3.39Å; K170-E173 IonicContact NZ-OE2 3.91Å; K170-E173 PolarHBondContact NZ-OE2 2.96Å
174	D	29.2	Very low	32.2	Very low	179 Å²	179	138.2 Å²	138.2	96%	0.957	76%	0.763	S	S	*	*			trans	-75.1	120.5	138.2	-85.4	-54.2	0	0	0	107.9
175	G	30.7	Very low	32	Very low	70 Å²	70	138.7 Å²	138.7	72%	0.722	76%	0.761	S	S	*	*			trans	172.7	121.8	175.1	0	0	0	0	0	116.3
176	A	33.2	Very low	31.7	Very low	98 Å²	98	137.9 Å²	137.9	81%	0.81	76%	0.762	S	S	*	*			trans	65.7	142.7	164.7	0	0	0	0	0	118.8
177	L	35.5	Very low	31.4	Very low	148 Å²	148	133.4 Å²	133.4	78%	0.775	76%	0.762	S	S	*	*			cis	-159.7	134	-27.4	-150.1	80.1	0	0	0	110.8
178	N	33.4	Very low	31.3	Very low	123 Å²	123	136.9 Å²	136.9	66%	0.658	77%	0.767	S	S	*	*			trans	28.8	138.7	143	-60.9	-6.9	0	0	0	124.1
179	N	35	Very low	31	Very low	138 Å²	138	136.1 Å²	136.1	74%	0.738	76%	0.758	S	S	*	*			trans	79.8	146.8	137.5	-66.9	-3.5	0	0	0	119.7
180	T	35.8	Very low	30.7	Very low	105 Å²	105	129.5 Å²	129.5	64%	0.644	74%	0.744	S	S	*	*			cis	-160.3	157.9	-6.5	16	0	0	0	0	111.3
181	N	33.6	Very low	30.5	Very low	149 Å²	149	127 Å²	127	80%	0.797	74%	0.737	S	S	*	*			trans	22.9	127.5	145.8	-51.6	-12.9	0	0	0	118.3
182	S	33.3	Very low	30.4	Very low	105 Å²	105	122.2 Å²	122.2	73%	0.734	72%	0.72	S	S	*	*			cis	-165.5	-162.6	15.7	51.9	0	0	0	0	108.7
183	N	31.7	Very low	30.2	Very low	143 Å²	143	125.3 Å²	125.3	77%	0.765	72%	0.724	S	S	*	*			cis	-159.5	-163	13.5	-150.4	-13.6	0	0	0	112.5
184	S	29.5	Very low	29.9	Very low	94 Å²	94	123.6 Å²	123.6	66%	0.657	72%	0.719	S	S	*	*			trans	-54.4	148.6	172.8	54	0	0	0	0	115.5
185	S	28.4	Very low	29.9	Very low	104 Å²	104	119.8 Å²	119.8	73%	0.727	70%	0.699	S	S	*	*			cis	-172.6	150.5	-5.7	47.4	0	0	0	0	112
186	V	26.2	Very low	29.7	Very low	143 Å²	143	123.2 Å²	123.2	87%	0.867	70%	0.701	S	S	*	*			trans	39.8	99.3	153.9	-173.2	0	0	0	0	118.2
187	C	26.6	Very low	29.5	Very low	130 Å²	130	124.4 Å²	124.4	88%	0.878	69%	0.693	S	S	*	*			trans	-160.3	-179.3	138.7	-151.4	0	0	0	0	111.9
188	H	27.5	Very low	29.1	Very low	172 Å²	172	121.9 Å²	121.9	80%	0.796	69%	0.688	S	S	*	*			trans	-84.3	124.9	-170	-94.1	-78.3	0	0	0	115.5
189	H	24.9	Very low	28.8	Very low	147 Å²	147	121.9 Å²	121.9	68%	0.681	69%	0.688	S	S	*	*				69	133.5	125.5	-132.2	38.9	0	0	0	121.3
190	C	25.3	Very low	28.6	Very low	87 Å²	87	120.8 Å²	120.8	59%	0.588	69%	0.686	S	S	*	*			trans	70.9	157.3	157.6	-61.5	0	0	0	0	117.4
191	L	28	Very low	28.2	Very low	92 Å²	92	125.4 Å²	125.4	48%	0.482	69%	0.693	S	S	.	*			cis	-150	131.7	-10	-139	71.5	0	0	0	106.4	P203	L191-P203 HydrophobicContact CD2-CG 4.26Å
192	I	27.3	Very low	28	Very low	120 Å²	120	123.7 Å²	123.7	62%	0.615	69%	0.69	S	S	*	*				48.2	138.2	102	-45.6	169.8	0	0	0	116.1
193	H	26.4	Very low	28	Very low	125 Å²	125	122.9 Å²	122.9	58%	0.579	68%	0.682	S	S	*	*			trans	160.2	70.2	179.7	-40.4	-42.6	0	0	0	116.1
194	I	27.6	Very low	27.7	Very low	124 Å²	124	124 Å²	124	64%	0.636	69%	0.686	S	S	*	*				38.1	127.3	117.7	-90.7	175.1	0	0	0	119.1
195	N	28.2	Very low	27.6	Very low	98 Å²	98	125 Å²	125	52%	0.524	68%	0.681	S	S	.	*				-171.6	167.3	106.6	-111.7	-28.3	0	0	0	108.8	L197	N195-L197 WeakPolarHBondContact OD1-CA 3.45Å
196	D	26.7	Very low	27.5	Very low	143 Å²	143	128.9 Å²	128.9	77%	0.765	69%	0.685	S	S	*	*	S	Bend	cis	-111.3	154.1	21.2	-75.6	-19.2	0	0	0	113.7
197	L	28.4	Very low	27.4	Very low	122 Å²	122	129.4 Å²	129.4	64%	0.639	68%	0.682	S	S	*	*	S	Bend	cis	-152.6	168.2	-3.8	-121.2	165.3	0	0	0	111.7	N195	N195-L197 WeakPolarHBondContact OD1-CA 3.45Å
198	S	27.2	Very low	27.3	Very low	96 Å²	96	131.8 Å²	131.8	67%	0.671	67%	0.673	S	S	*	*			trans	69.8	63.1	170	54	0	0	0	0	118.2
199	D	27.9	Very low	27.2	Very low	123 Å²	123	131 Å²	131	66%	0.658	67%	0.67	S	S	*	*				88	106.8	112.7	-62.1	-22.1	0	0	0	123.6
200	V	29.6	Very low	27.1	Very low	115 Å²	115	131.5 Å²	131.5	70%	0.697	68%	0.683	S	S	*	*				97.2	90.8	124.2	176.8	0	0	0	0	119.6
201	Y	27	Very low	27	Very low	201 Å²	201	130.1 Å²	130.1	79%	0.788	67%	0.674	S	S	*	*			trans	47.2	152.4	131.3	-67.6	-88.8	0	0	0	122.1
202	P	30.5	Very low	26.7	Very low	113 Å²	113	135.6 Å²	135.6	73%	0.734	70%	0.695	S	S	*	*			cis	-132.2	174.3	-33.9	29.4	-8.8	0	0	0	114.7
203	P	32.3	Very low	26.5	Very low	89 Å²	89	140.7 Å²	140.7	58%	0.578	71%	0.706	S	S	*	*			trans	-111.7	175.1	-163.8	41.9	-35.8	0	0	0	117	L191	L191-P203 HydrophobicContact CD2-CG 4.26Å
204	I	27.1	Very low	26.4	Very low	166 Å²	166	142.5 Å²	142.5	85%	0.851	72%	0.719	S	S	*	*			trans	-128.8	132.4	163.1	-61.7	177	0	0	0	109.4
205	Q	25.7	Very low	26.4	Very low	116 Å²	116	142.7 Å²	142.7	54%	0.542	72%	0.722	S	S	.	*			trans	-87.8	151.5	177.4	-70	-177.9	-22.6	0	0	113.1
206	F	27.3	Very low	26.3	Very low	185 Å²	185	147.8 Å²	147.8	81%	0.811	74%	0.739	S	S	*	*			trans	-154.7	128.1	158	-116.5	-72.9	0	0	0	113.8
207	N	23.4	Very low	26.3	Very low	153 Å²	153	146.5 Å²	146.5	82%	0.818	74%	0.737	S	S	*	*			trans	-73.9	142.3	165.2	-86.7	-36.5	0	0	0	111.8
208	R	25.8	Very low	26.3	Very low	181 Å²	181	144.3 Å²	144.3	68%	0.683	73%	0.732	S	S	*	*			trans	-172.5	125.1	148.7	-98.5	138.2	-164	-96.1	-0.7	108.7
209	Q	25.2	Very low	26.3	Very low	156 Å²	156	148.5 Å²	148.5	73%	0.729	74%	0.738	S	S	*	*				55.3	123.4	84.2	-66	-179.9	-35.5	0	0	113.3	S211	Q209-S211 PolarHBondContact O-N 3.12Å
210	T	23.1	Very low	26.4	Very low	156 Å²	156	147.1 Å²	147.1	96%	0.957	73%	0.73	S	S	*	*			trans	-68.8	61.6	169.2	35.8	0	0	0	0	111.7
211	S	23.2	Very low	26.3	Very low	58 Å²	58	144 Å²	144	41%	0.406	72%	0.716	S	S	.	*			trans	-75	130.4	176	57.3	0	0	0	0	111.3	Q209 R213	Q209-S211 PolarHBondContact O-N 3.12Å; S211-R213 VanDerWaalsContact C-N 3.34Å; S211-R213 PolarHBondContact O-N 2.97Å
212	F	21.3	Very low	26.7	Very low	208 Å²	208	138.6 Å²	138.6	91%	0.912	70%	0.7	S	S	*	*			trans	-59	96.2	160.4	-90.5	-96.9	0	0	0	109	L214	F212-L214 VanDerWaalsContact C-N 3.28Å; F212-L214 PolarHBondContact O-N 2.99Å
213	R	22.9	Very low	26.8	Very low	226 Å²	226	136.4 Å²	136.4	85%	0.853	69%	0.685	S	S	*	*			trans	-75.6	78.5	175.8	-86.5	-172.6	170.8	-174	-1.1	110.8	S211	S211-R213 VanDerWaalsContact C-N 3.34Å; S211-R213 PolarHBondContact O-N 2.97Å
214	L	24.6	Very low	27	Very low	163 Å²	163	135.3 Å²	135.3	85%	0.853	67%	0.674	S	S	*	*			trans	-59.7	134.4	149.6	-100.3	138.9	0	0	0	108.4	F212	F212-L214 VanDerWaalsContact C-N 3.28Å; F212-L214 PolarHBondContact O-N 2.99Å
215	N	26.6	Very low	27.5	Very low	129 Å²	129	134.4 Å²	134.4	69%	0.69	66%	0.66	S	S	*	*			trans	-73.2	138.6	-161.9	-157.2	2.2	0	0	0	112.1	T217	N215-T217 PolarHBondContact O-N 2.97Å
216	K	26	Very low	28.3	Very low	204 Å²	204	131 Å²	131	89%	0.887	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	11.5	-157.6	-139.4	-173.9	-178.2	-166.6	0	115.2
217	T	26.3	Very low	29.1	Very low	117 Å²	117	124.5 Å²	124.5	72%	0.718	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129	24.7	-166.5	47.7	0	0	0	0	114	N215	N215-T217 PolarHBondContact O-N 2.97Å
218	S	29.8	Very low	30.1	Very low	76 Å²	76	120.6 Å²	120.6	53%	0.531	60%	0.596	S	S	.	*			trans	-127.5	113	166.8	61	0	0	0	0	111.6	L220	S218-L220 PolarHBondContact O-N 3.18Å; S218-L220 VanDerWaalsContact O-N 3.15Å
219	K	27.9	Very low	30.9	Very low	183 Å²	183	113.7 Å²	113.7	80%	0.796	57%	0.572	S	S	*	*			trans	-85.4	64.9	170.7	-75.4	-174.6	177.6	176.7	0	109.9	A221	K219-A221 PolarHBondContact O-N 3.4Å
220	L	28.8	Very low	31.9	Very low	94 Å²	94	107.2 Å²	107.2	49%	0.492	54%	0.544	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	99.9	172.9	-81.4	166.5	0	0	0	109.9	S218 L222 L253	S218-L220 PolarHBondContact O-N 3.18Å; S218-L220 VanDerWaalsContact O-N 3.15Å; L220-L222 PolarHBondContact O-N 3.24Å; L220-L222 VanDerWaalsContact O-N 3.17Å; L220-L253 HydrophobicContact CD2-CD1 4.2Å; L220-L253 HydrophobicContact CD2-CD2 3.8Å; L220-L253 HydrophobicContact CD2-CG 4Å
221	A	28.7	Very low	32.8	Very low	50 Å²	50	102 Å²	102	41%	0.413	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	92.6	171.5	0	0	0	0	0	109.3	K219 T223 L254	K219-A221 PolarHBondContact O-N 3.4Å; A221-T223 PolarHBondContact O-N 2.72Å; A221-L254 HydrophobicContact CB-CB 4.13Å; A221-L254 HydrophobicContact CB-CD1 4.42Å; A221-L254 PolarHBondContact O-N 3.04Å
222	L	33.4	Very low	33.7	Very low	87 Å²	87	103.4 Å²	103.4	46%	0.455	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	95.6	178.5	-175.6	74.2	0	0	0	110	L220 L224 L253	L220-L222 PolarHBondContact O-N 3.24Å; L220-L222 VanDerWaalsContact O-N 3.17Å; L222-L224 HydrophobicContact CD1-CD2 4.09Å; L222-L224 HydrophobicContact CD2-CD1 4.03Å; L222-L224 HydrophobicContact CD2-CD2 3.73Å; L222-L224 HydrophobicContact CD2-CG 3.83Å; L222-L224 HydrophobicContact CG-CD2 3.65Å; L222-L224 HydrophobicContact CG-CG 3.87Å; L222-L224 PolarHBondContact O-N 2.79Å; L222-L253 HydrophobicContact CD1-CD1 4.18Å
223	T	34	Very low	34.5	Very low	67 Å²	67	96.5 Å²	96.5	41%	0.411	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	84.4	179.7	44.4	0	0	0	0	110.8	A221 R225 G251 K252	A221-T223 PolarHBondContact O-N 2.72Å; T223-R225 PolarHBondContact O-N 2.77Å; T223-G251 WeakPolarHBondContact O-CA 3.48Å; T223-K252 PolarHBondContact N-O 2.97Å; T223-K252 VanDerWaalsContact N-O 3.08Å; T223-K252 PolarHBondContact O-N 2.75Å; T223-K252 PolarHBondContact OG1-O 2.94Å
224	L	37	Very low	35.6	Very low	66 Å²	66	88.3 Å²	88.3	35%	0.346	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	105.7	177	-63.8	-171.9	0	0	0	112	L222 I249	L222-L224 HydrophobicContact CD1-CD2 4.09Å; L222-L224 HydrophobicContact CD2-CD1 4.03Å; L222-L224 HydrophobicContact CD2-CD2 3.73Å; L222-L224 HydrophobicContact CD2-CG 3.83Å; L222-L224 HydrophobicContact CG-CD2 3.65Å; L222-L224 HydrophobicContact CG-CG 3.87Å; L222-L224 PolarHBondContact O-N 2.79Å; L224-I249 HydrophobicContact CD1-CG2 4.3Å; L224-I249 HydrophobicContact CD2-CG2 3.69Å; L224-I249 HydrophobicContact CG-CG2 4.4Å
225	R	36.3	Very low	36.4	Very low	147 Å²	147	84.6 Å²	84.6	56%	0.555	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.6	104.7	164.2	-178.8	178.5	176.8	179	-2	109.2	T223 C250	T223-R225 PolarHBondContact O-N 2.77Å; R225-C250 HydrophobicContact CB-CB 4.42Å; R225-C250 WeakPolarHBondContact CB-O 3.32Å; R225-C250 PolarHBondContact N-O 3.39Å; R225-C250 PolarHBondContact O-N 3Å
226	M	43.7	Very low	37.2	Very low	45 Å²	45	79.8 Å²	79.8	22%	0.222	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	128.4	166.7	-51.1	-54.8	-149.3	0	0	108.7	L246 I249	M226-L246 HydrophobicContact CB-CD2 4.19Å; M226-L246 HydrophobicContact CE-CD1 3.82Å; M226-L246 HydrophobicContact CE-CD2 4.15Å; M226-L246 HydrophobicContact CG-CD2 4.25Å; M226-L246 HydrophobicContact SD-CD1 4.47Å; M226-L246 HydrophobicContact SD-CD2 3.71Å; M226-I249 HydrophobicContact CE-CD1 4.25Å; M226-I249 HydrophobicContact CE-CG1 4.24Å; M226-I249 HydrophobicContact SD-CB 4.19Å; M226-I249 HydrophobicContact SD-CD1 4.41Å; M226-I249 HydrophobicContact SD-CG1 3.77Å; M226-I249 HydrophobicContact SD-CG2 3.99Å
227	T	42.3	Very low	37.8	Very low	48 Å²	48	77.4 Å²	77.4	29%	0.294	40%	0.403	S	S	.	.	S	Bend	trans	-94.2	-38.5	-177	60.1	0	0	0	0	113.7	H248	T227-H248 HydrophobicContact CG2-CB 4.4Å; T227-H248 PolarHBondContact N-O 3.18Å; T227-H248 WeakPolarHBondContact OG1-CB 3.5Å; T227-H248 PolarHBondContact OG1-O 3.34Å
228	K	44.3	Very low	38.5	Very low	72 Å²	72	80.6 Å²	80.6	31%	0.313	40%	0.402	S	S	.	.			trans	-154.5	114.2	171.6	164.4	170.8	-175.9	145.7	0	109	T230 S247 E466	K228-T230 HydrophobicContact CD-CG2 4.48Å; K228-T230 HydrophobicContact CG-CG2 4.18Å; K228-S247 WeakPolarHBondContact CB-OG 3.38Å; K228-S247 PolarHBondContact O-N 2.96Å; K228-S247 VanDerWaalsContact O-N 3.11Å; K228-S247 PolarHBondContact O-OG 3.45Å; K228-S247 VanDerWaalsContact O-OG 3.12Å; K228-E466 VanDerWaalsContact CD-OE1 3.23Å; K228-E466 WeakPolarHBondContact CD-OE1 3.39Å; K228-E466 WeakPolarHBondContact CE-OE1 3.27Å; K228-E466 IonicContact NZ-OE1 3.76Å; K228-E466 PolarHBondContact NZ-OE1 2.92Å; K228-E466 IonicContact NZ-OE2 2.8Å; K228-E466 PolarHBondContact NZ-OE2 3.31Å
229	L	44.4	Very low	39.2	Very low	36 Å²	36	80.1 Å²	80.1	19%	0.188	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	120.1	167.4	165.3	64.5	0	0	0	107.3	M231 L246 I467	L229-M231 HydrophobicContact CD1-CG 3.79Å; L229-M231 HydrophobicContact CD2-CG 4.16Å; L229-M231 HydrophobicContact CD2-SD 4.26Å; L229-M231 HydrophobicContact CG-CG 3.91Å; L229-L246 HydrophobicContact CB-CD2 4.28Å; L229-L246 HydrophobicContact CB-CG 4.32Å; L229-L246 HydrophobicContact CD1-CD1 4.25Å; L229-L246 HydrophobicContact CD1-CG 3.84Å; L229-I467 HydrophobicContact CB-CB 4.38Å; L229-I467 HydrophobicContact CD2-CD1 4.02Å; L229-I467 PolarHBondContact N-O 3.02Å; L229-I467 PolarHBondContact O-N 3.49Å
230	T	44.7	Very low	40	Very low	20 Å²	20	71.7 Å²	71.7	12%	0.123	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	116.9	170.1	41.7	0	0	0	0	108	K228 H245	K228-T230 HydrophobicContact CD-CG2 4.48Å; K228-T230 HydrophobicContact CG-CG2 4.18Å; T230-H245 PolarHBondContact N-O 2.89Å; T230-H245 PolarHBondContact O-N 3.02Å; T230-H245 VanDerWaalsContact O-O 3.13Å; T230-H245 WeakPolarHBondContact OG1-CB 3.39Å; T230-H245 PolarHBondContact OG1-ND1 2.75Å; T230-H245 VanDerWaalsContact OG1-ND1 3.11Å; T230-H245 PolarHBondContact OG1-O 2.89Å
231	M	42.3	Very low	40.8	Very low	47 Å²	47	70.4 Å²	70.4	23%	0.232	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	125.3	171.8	-60.6	-163.8	-69.7	0	0	108.7	L229 F233 L244 F465 I467	L229-M231 HydrophobicContact CD1-CG 3.79Å; L229-M231 HydrophobicContact CD2-CG 4.16Å; L229-M231 HydrophobicContact CD2-SD 4.26Å; L229-M231 HydrophobicContact CG-CG 3.91Å; M231-F233 HydrophobicContact CB-CD2 4.23Å; M231-F233 HydrophobicContact CB-CE2 3.66Å; M231-F233 HydrophobicContact CB-CZ 4.46Å; M231-F233 HydrophobicContact CE-CE2 4.1Å; M231-F233 HydrophobicContact CE-CZ 4.45Å; M231-F233 HydrophobicContact SD-CE2 4.16Å; M231-F233 HydrophobicContact SD-CZ 4.22Å; M231-L244 HydrophobicContact CB-CD2 4.2Å; M231-L244 HydrophobicContact CG-CD2 3.59Å; M231-L244 HydrophobicContact SD-CD2 3.5Å; M231-L244 VanDerWaalsContact SD-CD2 3.5Å; M231-F465 PolarHBondContact N-O 2.68Å; M231-I467 HydrophobicContact CE-CD1 4.1Å
232	L	41.6	Very low	41.7	Very low	86 Å²	86	69 Å²	69	45%	0.45	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	114	175.7	-156.3	165.9	0	0	0	108.1	N243	L232-N243 HydrophobicContact CB-CB 4.4Å; L232-N243 PolarHBondContact N-O 3.13Å; L232-N243 PolarHBondContact O-N 2.88Å
233	F	39.8	Very low	42.4	Very low	63 Å²	63	67.5 Å²	67.5	28%	0.276	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	120.1	176.9	-68.9	-91.2	0	0	0	109.2	M231 V242 F463 F465	M231-F233 HydrophobicContact CB-CD2 4.23Å; M231-F233 HydrophobicContact CB-CE2 3.66Å; M231-F233 HydrophobicContact CB-CZ 4.46Å; M231-F233 HydrophobicContact CE-CE2 4.1Å; M231-F233 HydrophobicContact CE-CZ 4.45Å; M231-F233 HydrophobicContact SD-CE2 4.16Å; M231-F233 HydrophobicContact SD-CZ 4.22Å; F233-V242 HydrophobicContact CD1-CB 4.4Å; F233-V242 HydrophobicContact CD1-CG1 4.02Å; F233-V242 HydrophobicContact CD1-CG2 3.76Å; F233-V242 HydrophobicContact CE1-CB 4.3Å; F233-V242 HydrophobicContact CE1-CG1 3.57Å; F233-V242 HydrophobicContact CE1-CG2 3.77Å; F233-V242 HydrophobicContact CZ-CG1 3.99Å; F233-F463 PolarHBondContact N-O 3.02Å; F233-F463 PolarHBondContact O-N 3.41Å; F233-F465 HydrophobicContact CD2-CD2 4.39Å; F233-F465 HydrophobicContact CD2-CE2 4.49Å
234	H	45.9	Very low	43.1	Very low	55 Å²	55	66.6 Å²	66.6	26%	0.255	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	116.2	172.2	176.5	-105.4	0	0	0	108.9	A240 H241	H234-A240 CarbonylContact O-C 3.58Å; H234-A240 WeakPolarHBondContact O-CA 3.41Å; H234-H241 HydrophobicContact CB-CB 4.45Å; H234-H241 PolarHBondContact N-O 2.98Å; H234-H241 PolarHBondContact O-N 3.1Å
235	I	40.6	Very low	43.7	Very low	85 Å²	85	66.7 Å²	66.7	44%	0.436	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	110.4	-178.7	-57.3	177.6	0	0	0	108.7	A240	I235-A240 HydrophobicContact CG1-CB 4.15Å; I235-A240 HydrophobicContact CG2-CB 4.42Å
236	S	42.5	Very low	44.4	Very low	28 Å²	28	60.5 Å²	60.5	20%	0.196	29%	0.294	C	S	.	.			trans	-94.8	165.8	164.6	77.6	0	0	0	0	110.3	R238 Q239	S236-R238 PolarHBondContact O-N 3.13Å; S236-Q239 WeakPolarHBondContact CB-O 3.46Å; S236-Q239 PolarHBondContact N-O 3.36Å; S236-Q239 PolarHBondContact OG-N 3.15Å; S236-Q239 PolarHBondContact OG-O 3.17Å
237	M	38.6	Very low	44.7	Very low	153 Å²	153	59.3 Å²	59.3	75%	0.754	29%	0.291	S	S	*	.	S	Bend	trans	-64.3	-3.4	-179.2	-71.3	-74.5	-76.4	0	0	115.4	V458	M237-V458 HydrophobicContact CB-CG1 4Å; M237-V458 HydrophobicContact CG-CG1 3.67Å
238	R	40.9	Very low	45.2	Very low	184 Å²	184	60.9 Å²	60.9	69%	0.694	29%	0.294	S	S	*	.	S	Bend	trans	-134	-28.5	175.8	-70.3	-174.9	177.9	173.6	0.5	114.4	S236 C298	S236-R238 PolarHBondContact O-N 3.13Å; R238-C298 PolarHBondContact O-N 3.36Å
239	Q	46.4	Very low	45.4	Very low	66 Å²	66	58.5 Å²	58.5	31%	0.308	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	133.5	-176.2	-70	172	-1.2	0	0	111.5	S236 L296 E297	S236-Q239 WeakPolarHBondContact CB-O 3.46Å; S236-Q239 PolarHBondContact N-O 3.36Å; S236-Q239 PolarHBondContact OG-N 3.15Å; S236-Q239 PolarHBondContact OG-O 3.17Å; Q239-L296 CarbonylContact C-O 3.58Å; Q239-L296 WeakPolarHBondContact CA-O 3.47Å; Q239-E297 HydrophobicContact CG-CB 4.34Å; Q239-E297 HydrophobicContact CG-CG 4.22Å; Q239-E297 PolarHBondContact NE2-OE1 3.37Å
240	A	44.6	Very low	45.6	Very low	7 Å²	7	58 Å²	58	6%	0.058	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	126.8	174.2	0	0	0	0	0	109.8	H234 I235 L296 W312	H234-A240 CarbonylContact O-C 3.58Å; H234-A240 WeakPolarHBondContact O-CA 3.41Å; I235-A240 HydrophobicContact CG1-CB 4.15Å; I235-A240 HydrophobicContact CG2-CB 4.42Å; A240-L296 HydrophobicContact CB-CB 4.21Å; A240-L296 HydrophobicContact CB-CD1 4.29Å; A240-L296 PolarHBondContact N-O 2.93Å; A240-L296 WeakPolarHBondContact O-CB 3.35Å; A240-L296 PolarHBondContact O-N 2.93Å; A240-W312 HydrophobicContact CB-CE3 4.29Å; A240-W312 HydrophobicContact CB-CH2 4.19Å; A240-W312 HydrophobicContact CB-CZ3 3.84Å
241	H	45.6	Very low	45.5	Very low	67 Å²	67	57 Å²	57	31%	0.31	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	128.1	176.1	-71	-97.5	0	0	0	109.7	H234 I294	H234-H241 HydrophobicContact CB-CB 4.45Å; H234-H241 PolarHBondContact N-O 2.98Å; H234-H241 PolarHBondContact O-N 3.1Å; H241-I294 WeakPolarHBondContact CA-O 3.49Å
242	V	46.5	Very low	45.3	Very low	21 Å²	21	58 Å²	58	13%	0.127	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	104.3	171.2	-173.1	0	0	0	0	107.8	F233 L244 T292 I294	F233-V242 HydrophobicContact CD1-CB 4.4Å; F233-V242 HydrophobicContact CD1-CG1 4.02Å; F233-V242 HydrophobicContact CD1-CG2 3.76Å; F233-V242 HydrophobicContact CE1-CB 4.3Å; F233-V242 HydrophobicContact CE1-CG1 3.57Å; F233-V242 HydrophobicContact CE1-CG2 3.77Å; F233-V242 HydrophobicContact CZ-CG1 3.99Å; V242-L244 HydrophobicContact CG1-CD2 3.64Å; V242-L244 HydrophobicContact CG1-CG 4.17Å; V242-T292 VanDerWaalsContact O-O 3.12Å; V242-I294 HydrophobicContact CB-CB 4.31Å; V242-I294 PolarHBondContact N-O 3.06Å; V242-I294 PolarHBondContact O-N 3.2Å
243	N	48.8	Very low	45.1	Very low	55 Å²	55	55.6 Å²	55.6	29%	0.294	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	101	174.1	-67	-3.4	0	0	0	107.8	L232 T292 N293	L232-N243 HydrophobicContact CB-CB 4.4Å; L232-N243 PolarHBondContact N-O 3.13Å; L232-N243 PolarHBondContact O-N 2.88Å; N243-T292 WeakPolarHBondContact CA-O 3.47Å; N243-N293 WeakPolarHBondContact OD1-CB 3.44Å; N243-N293 VanDerWaalsContact OD1-CG 3.25Å; N243-N293 PolarHBondContact OD1-OD1 2.62Å
244	L	48.5	Very low	44.9	Very low	47 Å²	47	56 Å²	56	25%	0.246	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	119.7	168.6	-47.5	-179.3	0	0	0	107.7	M231 V242 S291 T292	M231-L244 HydrophobicContact CB-CD2 4.2Å; M231-L244 HydrophobicContact CG-CD2 3.59Å; M231-L244 HydrophobicContact SD-CD2 3.5Å; M231-L244 VanDerWaalsContact SD-CD2 3.5Å; V242-L244 HydrophobicContact CG1-CD2 3.64Å; V242-L244 HydrophobicContact CG1-CG 4.17Å; L244-S291 CarbonylContact O-C 3.56Å; L244-S291 WeakPolarHBondContact O-CA 3.34Å; L244-T292 WeakPolarHBondContact CB-OG1 3.44Å; L244-T292 WeakPolarHBondContact CD1-OG1 3.49Å; L244-T292 WeakPolarHBondContact CG-OG1 3.38Å; L244-T292 PolarHBondContact N-O 2.78Å; L244-T292 PolarHBondContact O-N 3.17Å
245	H	50.3	Low	44.3	Very low	69 Å²	69	56.1 Å²	56.1	32%	0.319	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	119.2	172.9	172	-93.9	0	0	0	109.8	T230 Q289 L290	T230-H245 PolarHBondContact N-O 2.89Å; T230-H245 PolarHBondContact O-N 3.02Å; T230-H245 VanDerWaalsContact O-O 3.13Å; T230-H245 WeakPolarHBondContact OG1-CB 3.39Å; T230-H245 PolarHBondContact OG1-ND1 2.75Å; T230-H245 VanDerWaalsContact OG1-ND1 3.11Å; T230-H245 PolarHBondContact OG1-O 2.89Å; H245-Q289 PolarHBondContact NE2-NE2 2.81Å; H245-L290 WeakPolarHBondContact CA-O 3.47Å
246	L	51	Low	43.8	Very low	16 Å²	16	58.2 Å²	58.2	8%	0.084	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	104.5	-172.8	-118.1	163.2	0	0	0	108	M226 L229 I249 Q289 L290	M226-L246 HydrophobicContact CB-CD2 4.19Å; M226-L246 HydrophobicContact CE-CD1 3.82Å; M226-L246 HydrophobicContact CE-CD2 4.15Å; M226-L246 HydrophobicContact CG-CD2 4.25Å; M226-L246 HydrophobicContact SD-CD1 4.47Å; M226-L246 HydrophobicContact SD-CD2 3.71Å; L229-L246 HydrophobicContact CB-CD2 4.28Å; L229-L246 HydrophobicContact CB-CG 4.32Å; L229-L246 HydrophobicContact CD1-CD1 4.25Å; L229-L246 HydrophobicContact CD1-CG 3.84Å; L246-I249 HydrophobicContact CD1-CD1 4.45Å; L246-I249 HydrophobicContact CD2-CG1 4.06Å; L246-Q289 VanDerWaalsContact O-CA 3.28Å; L246-Q289 WeakPolarHBondContact O-CA 3.26Å; L246-L290 HydrophobicContact CB-CB 3.99Å; L246-L290 PolarHBondContact N-O 2.95Å; L246-L290 PolarHBondContact O-N 2.98Å
247	S	49.4	Very low	43.4	Very low	21 Å²	21	61.1 Å²	61.1	15%	0.147	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	-50	-165.9	60.9	0	0	0	0	112.9	K228	K228-S247 WeakPolarHBondContact CB-OG 3.38Å; K228-S247 PolarHBondContact O-N 2.96Å; K228-S247 VanDerWaalsContact O-N 3.11Å; K228-S247 PolarHBondContact O-OG 3.45Å; K228-S247 VanDerWaalsContact O-OG 3.12Å
248	H	52.6	Low	43	Very low	80 Å²	80	58.7 Å²	58.7	37%	0.37	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	116	167.9	-39.7	-49.1	0	0	0	111.3	T227	T227-H248 HydrophobicContact CG2-CB 4.4Å; T227-H248 PolarHBondContact N-O 3.18Å; T227-H248 WeakPolarHBondContact OG1-CB 3.5Å; T227-H248 PolarHBondContact OG1-O 3.34Å
249	I	48.2	Very low	42.4	Very low	23 Å²	23	58.7 Å²	58.7	12%	0.118	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	123.6	156	-54.5	-176.1	0	0	0	107.7	L224 M226 L246 L286 R287 L288	L224-I249 HydrophobicContact CD1-CG2 4.3Å; L224-I249 HydrophobicContact CD2-CG2 3.69Å; L224-I249 HydrophobicContact CG-CG2 4.4Å; M226-I249 HydrophobicContact CE-CD1 4.25Å; M226-I249 HydrophobicContact CE-CG1 4.24Å; M226-I249 HydrophobicContact SD-CB 4.19Å; M226-I249 HydrophobicContact SD-CD1 4.41Å; M226-I249 HydrophobicContact SD-CG1 3.77Å; M226-I249 HydrophobicContact SD-CG2 3.99Å; L246-I249 HydrophobicContact CD1-CD1 4.45Å; L246-I249 HydrophobicContact CD2-CG1 4.06Å; I249-L286 VanDerWaalsContact O-O 3.11Å; I249-R287 WeakPolarHBondContact O-CA 3.37Å; I249-L288 HydrophobicContact CB-CB 4.32Å; I249-L288 HydrophobicContact CD1-CD2 4.16Å; I249-L288 PolarHBondContact N-O 3.2Å
250	C	47.9	Very low	41.6	Very low	25 Å²	25	62.4 Å²	62.4	17%	0.169	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	100.9	175.1	-179.9	0	0	0	0	110.6	R225 H285 L286	R225-C250 HydrophobicContact CB-CB 4.42Å; R225-C250 WeakPolarHBondContact CB-O 3.32Å; R225-C250 PolarHBondContact N-O 3.39Å; R225-C250 PolarHBondContact O-N 3Å; C250-H285 PolarHBondContact SG-ND1 2.9Å; C250-L286 WeakPolarHBondContact CA-O 3.32Å
251	G	43.9	Very low	40.8	Very low	0 Å²	0	71.6 Å²	71.6	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	132.8	178.5	0	0	0	0	0	113.2	T223	T223-G251 WeakPolarHBondContact O-CA 3.48Å
252	K	38	Very low	40	Very low	66 Å²	66	73.9 Å²	73.9	29%	0.287	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	140.2	155	-76.7	-157.9	171.2	-140.3	0	109.1	T223 E331	T223-K252 PolarHBondContact N-O 2.97Å; T223-K252 VanDerWaalsContact N-O 3.08Å; T223-K252 PolarHBondContact O-N 2.75Å; T223-K252 PolarHBondContact OG1-O 2.94Å; K252-E331 IonicContact NZ-OE1 2.77Å; K252-E331 PolarHBondContact NZ-OE1 2.89Å
253	L	36.4	Very low	39.3	Very low	36 Å²	36	84.7 Å²	84.7	19%	0.188	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	103.8	-176.7	-170	136.4	0	0	0	110.2	L220 L222 L283	L220-L253 HydrophobicContact CD2-CD1 4.2Å; L220-L253 HydrophobicContact CD2-CD2 3.8Å; L220-L253 HydrophobicContact CD2-CG 4Å; L222-L253 HydrophobicContact CD1-CD1 4.18Å; L253-L283 HydrophobicContact CB-CB 4.23Å; L253-L283 HydrophobicContact CB-CD1 4.44Å; L253-L283 HydrophobicContact CD2-CD1 4.32Å; L253-L283 PolarHBondContact N-O 2.96Å
254	L	35.5	Very low	38.2	Very low	72 Å²	72	90 Å²	90	38%	0.377	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	128.8	174.7	-74	167	0	0	0	110	A221 Y281	A221-L254 HydrophobicContact CB-CB 4.13Å; A221-L254 HydrophobicContact CB-CD1 4.42Å; A221-L254 PolarHBondContact O-N 3.04Å; L254-Y281 HydrophobicContact CD2-CD1 4Å; L254-Y281 HydrophobicContact CD2-CE1 3.76Å
255	C	34	Very low	37.2	Very low	58 Å²	58	92.1 Å²	92.1	39%	0.392	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	110	177.2	-169	0	0	0	0	109.8	I282	C255-I282 HydrophobicContact CB-CD1 3.83Å
256	I	31.1	Very low	36.3	Very low	128 Å²	128	96.4 Å²	96.4	66%	0.656	50%	0.497	S	S	*	.			trans	-91	118.2	170.9	-58.3	173.3	0	0	0	107.2	V258	I256-V258 PolarHBondContact O-N 2.92Å
257	P	32.4	Very low	35.2	Very low	90 Å²	90	103.1 Å²	103.1	58%	0.584	53%	0.533	S	S	*	.			trans	-71.3	117.3	-179.5	28.2	-33.2	0	0	0	110.7	F259	P257-F259 HydrophobicContact CB-CE2 4.41Å; P257-F259 PolarHBondContact O-N 2.95Å
258	V	30.7	Very low	34.3	Very low	102 Å²	102	109.8 Å²	109.8	62%	0.618	57%	0.567	S	S	*	*			trans	-82.6	104.1	166.7	-179.8	0	0	0	0	107.8	I256 M260	I256-V258 PolarHBondContact O-N 2.92Å; V258-M260 HydrophobicContact CG1-CE 4.26Å
259	F	28.8	Very low	33.3	Very low	183 Å²	183	115 Å²	115	80%	0.803	59%	0.589	S	S	*	*			trans	-70	139.6	165.3	-81.5	-89.3	0	0	0	109.6	P257	P257-F259 HydrophobicContact CB-CE2 4.41Å; P257-F259 PolarHBondContact O-N 2.95Å
260	M	30.3	Very low	32.5	Very low	145 Å²	145	121 Å²	121	71%	0.714	63%	0.626	S	S	*	*			trans	-76.9	144.1	179.3	-72.9	-76.1	123.7	0	0	111.2	V258 T262	V258-M260 HydrophobicContact CG1-CE 4.26Å; M260-T262 PolarHBondContact O-N 3.17Å
261	E	27	Very low	31.8	Very low	199 Å²	199	129.4 Å²	129.4	93%	0.93	66%	0.659	S	S	*	*	S	Bend	trans	-76.1	63.4	-174.6	-63.1	171.5	129.3	0	0	112.5
262	T	29.4	Very low	31.2	Very low	115 Å²	115	136.1 Å²	136.1	71%	0.706	70%	0.695	S	S	*	*			trans	-138.4	34.1	177.6	68.6	0	0	0	0	113.5	M260	M260-T262 PolarHBondContact O-N 3.17Å
263	W	30.6	Very low	30.8	Very low	248 Å²	248	142.3 Å²	142.3	94%	0.939	72%	0.717	S	S	*	*			trans	-123.8	126.6	168.9	-80.9	69.1	0	0	0	109.7
264	L	26.6	Very low	30.4	Very low	167 Å²	167	148.5 Å²	148.5	87%	0.874	75%	0.751	S	S	*	*			trans	-79.5	152.3	-162.9	-78.2	147.2	0	0	0	113.9
265	S	27.4	Very low	30.3	Very low	91 Å²	91	151.1 Å²	151.1	64%	0.636	77%	0.769	S	S	*	*			trans	4.7	118.3	152.8	57.8	0	0	0	0	118.5
266	N	31	Very low	30.1	Very low	159 Å²	159	154.8 Å²	154.8	85%	0.85	78%	0.783	S	S	*	*				-172.1	154.4	108	-90.2	-16.6	0	0	0	111.1
267	D	27.8	Very low	30	Very low	157 Å²	157	156.2 Å²	156.2	84%	0.84	79%	0.785	S	S	*	*			trans	-70.8	171.4	172.7	-76.7	-65.3	0	0	0	112.8
268	L	30.4	Very low	29.7	Very low	162 Å²	162	160.2 Å²	160.2	85%	0.848	80%	0.796	S	S	*	*			trans	75.3	83.8	-177.5	-56.4	155.7	0	0	0	115.4
269	F	32.8	Very low	29.7	Very low	190 Å²	190	160.2 Å²	160.2	83%	0.833	79%	0.793	S	S	*	*				-168.6	40.2	128.1	-108.2	-63.9	0	0	0	115.6	K271	F269-K271 PolarHBondContact O-N 2.97Å
270	V	31.2	Very low	29.8	Very low	148 Å²	148	154.7 Å²	154.7	90%	0.897	78%	0.781	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	91.7	171.6	-178.5	0	0	0	0	110.5
271	K	33.1	Very low	30	Very low	201 Å²	201	152.3 Å²	152.3	87%	0.874	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-167.9	-12	156.1	-114.6	161.6	-172.6	176.7	0	119.3	F269	F269-K271 PolarHBondContact O-N 2.97Å
272	N	31	Very low	30.6	Very low	141 Å²	141	148.1 Å²	148.1	75%	0.754	75%	0.747	S	S	*	*			trans	-129	26	-165.1	-123.8	10.8	0	0	0	117.1
273	W	29	Very low	31	Very low	196 Å²	196	144.5 Å²	144.5	74%	0.742	72%	0.724	S	S	*	*			trans	-89	-3.9	-174.5	-88.7	70.9	0	0	0	116.2	V275 F277	W273-V275 VanDerWaalsContact C-N 3.3Å; W273-V275 PolarHBondContact O-N 3.22Å; W273-V275 VanDerWaalsContact O-N 3.13Å; W273-F277 HydrophobicContact CZ3-CD2 4.41Å; W273-F277 HydrophobicContact CZ3-CE2 4.02Å
274	N	29.4	Very low	31.2	Very low	167 Å²	167	133.1 Å²	133.1	89%	0.893	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	17.2	-168.4	-74	8	0	0	0	116.2
275	V	32.7	Very low	32.1	Very low	127 Å²	127	129.4 Å²	129.4	77%	0.77	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130	-8.1	-168.9	-171.2	0	0	0	0	114.5	W273	W273-V275 VanDerWaalsContact C-N 3.3Å; W273-V275 PolarHBondContact O-N 3.22Å; W273-V275 VanDerWaalsContact O-N 3.13Å
276	I	30.1	Very low	32.8	Very low	134 Å²	134	127 Å²	127	69%	0.687	64%	0.64	S	S	*	*	S	Bend	trans	-116.2	-4.5	-164.9	-65.5	179.4	0	0	0	114.7
277	F	27.7	Very low	33.3	Very low	159 Å²	159	125.7 Å²	125.7	70%	0.697	62%	0.624	S	S	*	*			trans	-131.5	62.8	-176.8	-76	-75.6	0	0	0	115.1	W273	W273-F277 HydrophobicContact CZ3-CD2 4.41Å; W273-F277 HydrophobicContact CZ3-CE2 4.02Å
278	E	27.5	Very low	34.3	Very low	174 Å²	174	120.2 Å²	120.2	81%	0.813	59%	0.594	S	S	*	*	S	Bend	trans	-107.8	153.5	150.4	-68.3	-164.9	133.2	0	0	110
279	N	30	Very low	35.1	Very low	102 Å²	102	116 Å²	116	55%	0.545	57%	0.57	S	S	.	*			trans	64.6	68.5	170.2	-52.7	-43.3	0	0	0	117.5	Y281	N279-Y281 HydrophobicContact CB-CE2 4.09Å; N279-Y281 WeakPolarHBondContact OD1-CE2 3.27Å; N279-Y281 PolarHBondContact OD1-OH 3Å
280	A	30.1	Very low	35.8	Very low	67 Å²	67	108.9 Å²	108.9	55%	0.554	54%	0.541	S	S	*	.			trans	-119.9	77.9	162.2	0	0	0	0	0	111.3
281	Y	34.3	Very low	36.6	Very low	94 Å²	94	102.9 Å²	102.9	37%	0.369	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	134.6	177	-53.9	-70.3	0	0	0	110.9	L254 N279	L254-Y281 HydrophobicContact CD2-CD1 4Å; L254-Y281 HydrophobicContact CD2-CE1 3.76Å; N279-Y281 HydrophobicContact CB-CE2 4.09Å; N279-Y281 WeakPolarHBondContact OD1-CE2 3.27Å; N279-Y281 PolarHBondContact OD1-OH 3Å
282	I	40.3	Very low	37.2	Very low	111 Å²	111	93.9 Å²	93.9	57%	0.569	47%	0.467	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.9	-22.8	-175.4	-57	-177.4	0	0	0	112.4	C255	C255-I282 HydrophobicContact CB-CD1 3.83Å
283	L	38.5	Very low	37.6	Very low	40 Å²	40	89.7 Å²	89.7	21%	0.209	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	116.8	164.2	-75.4	95	0	0	0	109.9	L253 L286 I326	L253-L283 HydrophobicContact CB-CB 4.23Å; L253-L283 HydrophobicContact CB-CD1 4.44Å; L253-L283 HydrophobicContact CD2-CD1 4.32Å; L253-L283 PolarHBondContact N-O 2.96Å; L283-L286 HydrophobicContact CD2-CD1 4.23Å; L283-L286 HydrophobicContact CD2-CD2 4.49Å; L283-L286 HydrophobicContact CD2-CG 4.04Å; L283-I326 HydrophobicContact CD2-CG2 3.68Å
284	G	34.8	Very low	38.5	Very low	8 Å²	8	82.6 Å²	82.6	8%	0.082	42%	0.421	C	S	.	.	S	Bend	trans	-80.6	-41.9	178	0	0	0	0	0	113.7	E331	G284-E331 WeakPolarHBondContact CA-OE2 3.47Å
285	H	44.3	Very low	39.3	Very low	89 Å²	89	75.4 Å²	75.4	41%	0.412	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	101	179.1	-70.3	-61.3	0	0	0	113.4	C250 A327	C250-H285 PolarHBondContact SG-ND1 2.9Å; H285-A327 HydrophobicContact CB-CB 4.3Å; H285-A327 PolarHBondContact O-N 2.94Å; H285-A327 VanDerWaalsContact O-N 3.08Å
286	L	42.9	Very low	39.9	Very low	40 Å²	40	71.2 Å²	71.2	21%	0.209	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	140.7	147.2	-83.3	158.4	0	0	0	109.4	I249 C250 L283 L324 R325 I326	I249-L286 VanDerWaalsContact O-O 3.11Å; C250-L286 WeakPolarHBondContact CA-O 3.32Å; L283-L286 HydrophobicContact CD2-CD1 4.23Å; L283-L286 HydrophobicContact CD2-CD2 4.49Å; L283-L286 HydrophobicContact CD2-CG 4.04Å; L286-L324 HydrophobicContact CD2-CD1 3.92Å; L286-R325 CarbonylContact C-O 3.59Å; L286-I326 HydrophobicContact CD2-CG1 4.11Å
287	R	41.7	Very low	40.5	Very low	132 Å²	132	67.7 Å²	67.7	50%	0.498	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	133.1	154.2	-61.2	-171.2	-173.9	-165.9	2.8	109	I249 R325	I249-R287 WeakPolarHBondContact O-CA 3.37Å; R287-R325 HydrophobicContact CB-CB 4.29Å; R287-R325 PolarHBondContact N-O 2.88Å; R287-R325 PolarHBondContact O-N 3.22Å
288	L	48.7	Very low	41.2	Very low	42 Å²	42	61.5 Å²	61.5	22%	0.22	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	128.4	178.8	-166.6	163.1	0	0	0	107.4	I249 L290 L321 L324	I249-L288 HydrophobicContact CB-CB 4.32Å; I249-L288 HydrophobicContact CD1-CD2 4.16Å; I249-L288 PolarHBondContact N-O 3.2Å; L288-L290 HydrophobicContact CD2-CB 4.02Å; L288-L290 HydrophobicContact CD2-CD1 4.39Å; L288-L321 HydrophobicContact CD1-CD1 4.4Å; L288-L321 HydrophobicContact CD1-CD2 4.46Å; L288-L321 HydrophobicContact CD2-CD1 4.28Å; L288-L321 HydrophobicContact CD2-CD2 4.02Å; L288-L321 HydrophobicContact CD2-CG 3.89Å; L288-L321 HydrophobicContact CG-CD2 3.99Å; L288-L321 HydrophobicContact CG-CG 4.35Å; L288-L324 HydrophobicContact CD1-CD1 4.26Å; L288-L324 HydrophobicContact CG-CD1 4.44Å
289	Q	46.9	Very low	41.9	Very low	74 Å²	74	62.1 Å²	62.1	35%	0.346	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	115.9	173.6	-177.2	179.2	-0.7	0	0	109	H245 L246 C322	H245-Q289 PolarHBondContact NE2-NE2 2.81Å; L246-Q289 VanDerWaalsContact O-CA 3.28Å; L246-Q289 WeakPolarHBondContact O-CA 3.26Å; Q289-C322 HydrophobicContact CB-CB 4.21Å; Q289-C322 WeakPolarHBondContact CB-O 3.33Å; Q289-C322 HydrophobicContact CG-CB 4.34Å; Q289-C322 PolarHBondContact N-O 2.65Å; Q289-C322 VanDerWaalsContact N-O 3.16Å; Q289-C322 PolarHBondContact O-N 3.47Å; Q289-C322 VanDerWaalsContact O-O 3.06Å
290	L	48.7	Very low	42.3	Very low	40 Å²	40	63 Å²	63	21%	0.209	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	123.5	-176.4	-171.5	76.7	0	0	0	109.5	H245 L246 L288 T292 L319 L321	H245-L290 WeakPolarHBondContact CA-O 3.47Å; L246-L290 HydrophobicContact CB-CB 3.99Å; L246-L290 PolarHBondContact N-O 2.95Å; L246-L290 PolarHBondContact O-N 2.98Å; L288-L290 HydrophobicContact CD2-CB 4.02Å; L288-L290 HydrophobicContact CD2-CD1 4.39Å; L290-T292 HydrophobicContact CD1-CG2 4.35Å; L290-T292 HydrophobicContact CD2-CG2 3.9Å; L290-T292 HydrophobicContact CG-CG2 3.89Å; L290-L319 HydrophobicContact CD1-CD2 4.06Å; L290-L321 HydrophobicContact CD1-CG 4.41Å
291	S	48.1	Very low	42.7	Very low	23 Å²	23	68.4 Å²	68.4	16%	0.161	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	125.2	163.8	37.9	0	0	0	0	109.7	L244 K320	L244-S291 CarbonylContact O-C 3.56Å; L244-S291 WeakPolarHBondContact O-CA 3.34Å; S291-K320 PolarHBondContact N-O 3.19Å; S291-K320 CarbonylContact O-C 3.57Å; S291-K320 PolarHBondContact O-N 2.85Å; S291-K320 WeakPolarHBondContact OG-CB 3.21Å; S291-K320 PolarHBondContact OG-O 2.87Å
292	T	45.5	Very low	42.5	Very low	11 Å²	11	70.9 Å²	70.9	7%	0.067	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	116.2	171.6	75.9	0	0	0	0	109.3	V242 N243 L244 L290 D318 L319	V242-T292 VanDerWaalsContact O-O 3.12Å; N243-T292 WeakPolarHBondContact CA-O 3.47Å; L244-T292 WeakPolarHBondContact CB-OG1 3.44Å; L244-T292 WeakPolarHBondContact CD1-OG1 3.49Å; L244-T292 WeakPolarHBondContact CG-OG1 3.38Å; L244-T292 PolarHBondContact N-O 2.78Å; L244-T292 PolarHBondContact O-N 3.17Å; L290-T292 HydrophobicContact CD1-CG2 4.35Å; L290-T292 HydrophobicContact CD2-CG2 3.9Å; L290-T292 HydrophobicContact CG-CG2 3.89Å; T292-D318 WeakPolarHBondContact CA-O 3.44Å; T292-L319 HydrophobicContact CG2-CD2 3.55Å; T292-L319 HydrophobicContact CG2-CG 4.15Å
293	N	38.3	Very low	42.1	Very low	54 Å²	54	73.1 Å²	73.1	29%	0.289	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	112	170.6	-58.3	-6.4	0	0	0	107.8	N243 D318	N243-N293 WeakPolarHBondContact OD1-CB 3.44Å; N243-N293 VanDerWaalsContact OD1-CG 3.25Å; N243-N293 PolarHBondContact OD1-OD1 2.62Å; N293-D318 HydrophobicContact CB-CB 4.21Å; N293-D318 PolarHBondContact N-O 3.44Å; N293-D318 VanDerWaalsContact N-O 3.09Å; N293-D318 PolarHBondContact O-N 3.13Å
294	I	48.6	Very low	41.8	Very low	46 Å²	46	75.2 Å²	75.2	24%	0.236	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	119.4	173.1	-54.5	172.7	0	0	0	106.9	H241 V242 L296 V314 V317	H241-I294 WeakPolarHBondContact CA-O 3.49Å; V242-I294 HydrophobicContact CB-CB 4.31Å; V242-I294 PolarHBondContact N-O 3.06Å; V242-I294 PolarHBondContact O-N 3.2Å; I294-L296 HydrophobicContact CG2-CD2 4.27Å; I294-L296 HydrophobicContact CG2-CG 4.24Å; I294-V314 HydrophobicContact CG2-CG1 4.03Å; I294-V317 HydrophobicContact CG1-CG1 4.36Å
295	S	45.1	Very low	41.5	Very low	16 Å²	16	81.4 Å²	81.4	11%	0.112	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	125.7	168.7	66.4	0	0	0	0	109.7	K315 S316	S295-K315 PolarHBondContact O-N 3.21Å; S295-S316 PolarHBondContact N-O 3.36Å; S295-S316 PolarHBondContact O-N 2.84Å; S295-S316 PolarHBondContact OG-N 2.82Å; S295-S316 PolarHBondContact OG-OG 2.87Å
296	L	45.4	Very low	41.1	Very low	39 Å²	39	85.5 Å²	85.5	20%	0.204	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	134.1	176.6	-63.7	166.6	0	0	0	108.8	Q239 A240 I294 W312 F313 V314	Q239-L296 CarbonylContact C-O 3.58Å; Q239-L296 WeakPolarHBondContact CA-O 3.47Å; A240-L296 HydrophobicContact CB-CB 4.21Å; A240-L296 HydrophobicContact CB-CD1 4.29Å; A240-L296 PolarHBondContact N-O 2.93Å; A240-L296 WeakPolarHBondContact O-CB 3.35Å; A240-L296 PolarHBondContact O-N 2.93Å; I294-L296 HydrophobicContact CG2-CD2 4.27Å; I294-L296 HydrophobicContact CG2-CG 4.24Å; L296-W312 HydrophobicContact CB-CB 4.48Å; L296-W312 HydrophobicContact CB-CE3 3.88Å; L296-F313 CarbonylContact C-O 3.57Å; L296-F313 WeakPolarHBondContact CA-O 3.37Å; L296-V314 HydrophobicContact CD2-CB 4.42Å; L296-V314 HydrophobicContact CD2-CG2 3.79Å
297	E	44.3	Very low	40.4	Very low	60 Å²	60	89.3 Å²	89.3	28%	0.28	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	139.5	175.8	-175	162	-106.1	0	0	110.9	Q239 F313 K315	Q239-E297 HydrophobicContact CG-CB 4.34Å; Q239-E297 HydrophobicContact CG-CG 4.22Å; Q239-E297 PolarHBondContact NE2-OE1 3.37Å; E297-F313 PolarHBondContact N-O 2.88Å; E297-F313 PolarHBondContact O-N 2.9Å; E297-K315 HydrophobicContact CB-CB 4.29Å; E297-K315 HydrophobicContact CB-CD 4.02Å; E297-K315 IonicContact OE1-NZ 3.27Å; E297-K315 PolarHBondContact OE1-NZ 3.08Å; E297-K315 WeakPolarHBondContact OE2-CD 3.41Å; E297-K315 WeakPolarHBondContact OE2-CE 3.25Å; E297-K315 IonicContact OE2-NZ 3.49Å; E297-K315 PolarHBondContact OE2-NZ 2.96Å
298	C	41.9	Very low	39.9	Very low	29 Å²	29	88 Å²	88	20%	0.196	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	116.3	178.7	-174	0	0	0	0	110.3	R238 W312	R238-C298 PolarHBondContact O-N 3.36Å; C298-W312 HydrophobicContact CB-CD2 4.19Å; C298-W312 HydrophobicContact CB-CE3 4.08Å; C298-W312 HydrophobicContact CB-CZ3 4.27Å
299	R	41.8	Very low	39.3	Very low	187 Å²	187	93.8 Å²	93.8	71%	0.706	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-88.8	121.5	171.2	-85.6	-170	173.2	-168.2	-0.9	110.7
300	N	37.6	Very low	38.6	Very low	121 Å²	121	96.4 Å²	96.4	65%	0.647	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-80.7	122.1	162.1	-72.8	-1.5	0	0	0	109	N302	N300-N302 PolarHBondContact O-N 2.63Å
301	F	38.6	Very low	38.2	Very low	180 Å²	180	95.5 Å²	95.5	79%	0.789	53%	0.529	S	S	*	.			trans	-84	102.7	167	-88.7	-87.2	0	0	0	109.8	N303	F301-N303 VanDerWaalsContact C-N 3.28Å; F301-N303 PolarHBondContact O-N 2.77Å
302	N	30.7	Very low	37.9	Very low	147 Å²	147	100 Å²	100	79%	0.786	54%	0.543	S	S	*	.			trans	-78.1	77.9	169.7	-76.4	3.6	0	0	0	110.2	N300	N300-N302 PolarHBondContact O-N 2.63Å
303	N	32.4	Very low	37.9	Very low	157 Å²	157	106 Å²	106	84%	0.84	57%	0.568	S	S	*	*	S	Bend	trans	-155.4	149.5	156.6	-104.3	-30.6	0	0	0	110	F301	F301-N303 VanDerWaalsContact C-N 3.28Å; F301-N303 PolarHBondContact O-N 2.77Å
304	A	31.8	Very low	38.2	Very low	85 Å²	85	107.6 Å²	107.6	70%	0.702	58%	0.58	S	S	*	*	S	Bend	trans	-70.4	158.6	-172.1	0	0	0	0	0	113.1
305	T	28.6	Very low	38	Very low	137 Å²	137	111 Å²	111	84%	0.84	59%	0.593	S	S	*	*	S	Bend	trans	72.4	54.4	168.8	64	0	0	0	0	118.9
306	L	35.3	Very low	38	Very low	175 Å²	175	112.2 Å²	112.2	92%	0.916	60%	0.601	S	S	*	*			trans	-154.7	121.6	132.8	-137.7	75.7	0	0	0	112.6
307	S	28.5	Very low	37.7	Very low	120 Å²	120	114.1 Å²	114.1	84%	0.839	61%	0.614	S	S	*	*			trans	-104.2	65.5	-170.2	58	0	0	0	0	113.9
308	S	30	Very low	37.6	Very low	104 Å²	104	114.4 Å²	114.4	73%	0.727	62%	0.618	S	S	*	*			trans	173.8	108.8	149.7	37.8	0	0	0	0	113
309	L	36.6	Very low	37.5	Very low	165 Å²	165	118.7 Å²	118.7	86%	0.864	64%	0.638	S	S	*	*			trans	164.9	90.6	142.9	-93.3	158.3	0	0	0	110.7	G311	L309-G311 VanDerWaalsContact C-N 3.28Å; L309-G311 PolarHBondContact O-N 2.75Å
310	N	33.4	Very low	37.5	Very low	128 Å²	128	115.6 Å²	115.6	68%	0.684	63%	0.63	S	S	*	*			trans	-77.8	84.5	164.3	-74.3	29	0	0	0	108.6
311	G	38.8	Very low	37.7	Very low	22 Å²	22	113 Å²	113	23%	0.227	62%	0.615	C	S	.	*			trans	-77.3	129.4	177.4	0	0	0	0	0	112.3	L309 F313	L309-G311 VanDerWaalsContact C-N 3.28Å; L309-G311 PolarHBondContact O-N 2.75Å; G311-F313 WeakPolarHBondContact O-CD2 3.44Å
312	W	42.7	Very low	37.9	Very low	116 Å²	116	106.6 Å²	106.6	44%	0.439	59%	0.593	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.6	122.8	162.5	-68.9	85.9	0	0	0	108.6	A240 L296 C298	A240-W312 HydrophobicContact CB-CE3 4.29Å; A240-W312 HydrophobicContact CB-CH2 4.19Å; A240-W312 HydrophobicContact CB-CZ3 3.84Å; L296-W312 HydrophobicContact CB-CB 4.48Å; L296-W312 HydrophobicContact CB-CE3 3.88Å; C298-W312 HydrophobicContact CB-CD2 4.19Å; C298-W312 HydrophobicContact CB-CE3 4.08Å; C298-W312 HydrophobicContact CB-CZ3 4.27Å
313	F	44.4	Very low	38.4	Very low	138 Å²	138	101.1 Å²	101.1	61%	0.605	57%	0.571	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-106.9	143.9	178	-68.2	-89.8	0	0	0	110.4	L296 E297 G311 K315	L296-F313 CarbonylContact C-O 3.57Å; L296-F313 WeakPolarHBondContact CA-O 3.37Å; E297-F313 PolarHBondContact N-O 2.88Å; E297-F313 PolarHBondContact O-N 2.9Å; G311-F313 WeakPolarHBondContact O-CD2 3.44Å; F313-K315 PolarHBondContact O-N 2.92Å
314	V	44.9	Very low	38.9	Very low	88 Å²	88	96.2 Å²	96.2	53%	0.533	54%	0.544	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	115.1	176.9	-171.6	0	0	0	0	109	I294 L296 S316 V317	I294-V314 HydrophobicContact CG2-CG1 4.03Å; L296-V314 HydrophobicContact CD2-CB 4.42Å; L296-V314 HydrophobicContact CD2-CG2 3.79Å; V314-S316 WeakPolarHBondContact CG1-O 3.45Å; V314-V317 HydrophobicContact CG1-CG2 3.45Å; V314-V317 VanDerWaalsContact CG1-CG2 3.45Å
315	K	44.8	Very low	39.2	Very low	117 Å²	117	96.9 Å²	96.9	51%	0.509	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	-36.3	179.1	-178.1	173.6	-172.2	159.7	0	111.5	S295 E297 F313	S295-K315 PolarHBondContact O-N 3.21Å; E297-K315 HydrophobicContact CB-CB 4.29Å; E297-K315 HydrophobicContact CB-CD 4.02Å; E297-K315 IonicContact OE1-NZ 3.27Å; E297-K315 PolarHBondContact OE1-NZ 3.08Å; E297-K315 WeakPolarHBondContact OE2-CD 3.41Å; E297-K315 WeakPolarHBondContact OE2-CE 3.25Å; E297-K315 IonicContact OE2-NZ 3.49Å; E297-K315 PolarHBondContact OE2-NZ 2.96Å; F313-K315 PolarHBondContact O-N 2.92Å
316	S	45.4	Very low	39.8	Very low	42 Å²	42	94.2 Å²	94.2	29%	0.294	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	155.7	167.3	79.6	0	0	0	0	112	S295 V314 D318	S295-S316 PolarHBondContact N-O 3.36Å; S295-S316 PolarHBondContact O-N 2.84Å; S295-S316 PolarHBondContact OG-N 2.82Å; S295-S316 PolarHBondContact OG-OG 2.87Å; V314-S316 WeakPolarHBondContact CG1-O 3.45Å; S316-D318 WeakPolarHBondContact CB-OD1 3.29Å; S316-D318 PolarHBondContact OG-OD1 3.09Å
317	V	39.5	Very low	39.9	Very low	78 Å²	78	88 Å²	88	47%	0.473	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	97	164.5	-175.7	0	0	0	0	108	I294 V314 L319	I294-V317 HydrophobicContact CG1-CG1 4.36Å; V314-V317 HydrophobicContact CG1-CG2 3.45Å; V314-V317 VanDerWaalsContact CG1-CG2 3.45Å; V317-L319 HydrophobicContact CG1-CD1 4.11Å; V317-L319 HydrophobicContact CG1-CG 4.24Å; V317-L319 PolarHBondContact O-N 3.34Å
318	D	41.7	Very low	40.4	Very low	66 Å²	66	87.7 Å²	87.7	35%	0.353	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	93.5	179.9	-61.1	18.3	0	0	0	108.7	T292 N293 S316 K320	T292-D318 WeakPolarHBondContact CA-O 3.44Å; N293-D318 HydrophobicContact CB-CB 4.21Å; N293-D318 PolarHBondContact N-O 3.44Å; N293-D318 VanDerWaalsContact N-O 3.09Å; N293-D318 PolarHBondContact O-N 3.13Å; S316-D318 WeakPolarHBondContact CB-OD1 3.29Å; S316-D318 PolarHBondContact OG-OD1 3.09Å; D318-K320 PolarHBondContact O-N 3.23Å
319	L	40.3	Very low	40.9	Very low	120 Å²	120	85.5 Å²	85.5	63%	0.628	45%	0.45	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.3	94.7	174.8	-93.8	151.4	0	0	0	110.5	L290 T292 V317	L290-L319 HydrophobicContact CD1-CD2 4.06Å; T292-L319 HydrophobicContact CG2-CD2 3.55Å; T292-L319 HydrophobicContact CG2-CG 4.15Å; V317-L319 HydrophobicContact CG1-CD1 4.11Å; V317-L319 HydrophobicContact CG1-CG 4.24Å; V317-L319 PolarHBondContact O-N 3.34Å
320	K	40.5	Very low	40.8	Very low	121 Å²	121	83.8 Å²	83.8	53%	0.526	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	106.6	175.5	-74.2	178.3	179.3	174.8	0	109.9	S291 D318	S291-K320 PolarHBondContact N-O 3.19Å; S291-K320 CarbonylContact O-C 3.57Å; S291-K320 PolarHBondContact O-N 2.85Å; S291-K320 WeakPolarHBondContact OG-CB 3.21Å; S291-K320 PolarHBondContact OG-O 2.87Å; D318-K320 PolarHBondContact O-N 3.23Å
321	L	43.4	Very low	41.1	Very low	66 Å²	66	81.5 Å²	81.5	35%	0.346	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	107.1	-178.6	-160.6	162.7	0	0	0	109.5	L288 L290	L288-L321 HydrophobicContact CD1-CD1 4.4Å; L288-L321 HydrophobicContact CD1-CD2 4.46Å; L288-L321 HydrophobicContact CD2-CD1 4.28Å; L288-L321 HydrophobicContact CD2-CD2 4.02Å; L288-L321 HydrophobicContact CD2-CG 3.89Å; L288-L321 HydrophobicContact CG-CD2 3.99Å; L288-L321 HydrophobicContact CG-CG 4.35Å; L290-L321 HydrophobicContact CD1-CG 4.41Å
322	C	41.6	Very low	41.1	Very low	46 Å²	46	84.6 Å²	84.6	31%	0.311	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	136.6	-175.9	-62.3	0	0	0	0	110.1	Q289	Q289-C322 HydrophobicContact CB-CB 4.21Å; Q289-C322 WeakPolarHBondContact CB-O 3.33Å; Q289-C322 HydrophobicContact CG-CB 4.34Å; Q289-C322 PolarHBondContact N-O 2.65Å; Q289-C322 VanDerWaalsContact N-O 3.16Å; Q289-C322 PolarHBondContact O-N 3.47Å; Q289-C322 VanDerWaalsContact O-O 3.06Å
323	G	42	Very low	40.9	Very low	32 Å²	32	84.2 Å²	84.2	33%	0.33	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	51.5	90.3	168.6	0	0	0	0	0	116	S149	S149-G323 PolarHBondContact O-N 3.13Å
324	L	42.1	Very low	40.7	Very low	54 Å²	54	83 Å²	83	28%	0.283	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	113.3	164.9	-176.8	67.9	0	0	0	109.3	I148 L286 L288 I326	I148-L324 PolarHBondContact O-N 2.91Å; L286-L324 HydrophobicContact CD2-CD1 3.92Å; L288-L324 HydrophobicContact CD1-CD1 4.26Å; L288-L324 HydrophobicContact CG-CD1 4.44Å; L324-I326 HydrophobicContact CD2-CD1 4.16Å; L324-I326 HydrophobicContact CD2-CG1 4.35Å; L324-I326 HydrophobicContact CG-CD1 4.48Å; L324-I326 HydrophobicContact CG-CG1 4.12Å
325	R	37.6	Very low	40.6	Very low	100 Å²	100	83.4 Å²	83.4	38%	0.377	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	122.9	171.1	-165.8	171.5	-128.5	-177.8	4.4	110.9	D147 L286 R287	D147-R325 IonicContact OD1-CZ 3.63Å; D147-R325 IonicContact OD1-NE 2.77Å; D147-R325 PolarHBondContact OD1-NE 2.67Å; D147-R325 IonicContact OD1-NH2 2.76Å; D147-R325 PolarHBondContact OD1-NH2 2.92Å; D147-R325 IonicContact OD2-NH2 2.72Å; D147-R325 PolarHBondContact OD2-NH2 3Å; D147-R325 VanDerWaalsContact OD2-NH2 3.14Å; L286-R325 CarbonylContact C-O 3.59Å; R287-R325 HydrophobicContact CB-CB 4.29Å; R287-R325 PolarHBondContact N-O 2.88Å; R287-R325 PolarHBondContact O-N 3.22Å
326	I	42.8	Very low	40.3	Very low	81 Å²	81	82.1 Å²	82.1	42%	0.415	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	109.6	175.8	-40	-177.4	0	0	0	108.3	L283 L286 L324 I328	L283-I326 HydrophobicContact CD2-CG2 3.68Å; L286-I326 HydrophobicContact CD2-CG1 4.11Å; L324-I326 HydrophobicContact CD2-CD1 4.16Å; L324-I326 HydrophobicContact CD2-CG1 4.35Å; L324-I326 HydrophobicContact CG-CD1 4.48Å; L324-I326 HydrophobicContact CG-CG1 4.12Å; I326-I328 HydrophobicContact CB-CG1 4.34Å; I326-I328 HydrophobicContact CG2-CD1 4.02Å; I326-I328 HydrophobicContact CG2-CG1 3.62Å
327	A	36.8	Very low	39.8	Very low	43 Å²	43	83 Å²	83	36%	0.355	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	103.7	171.4	0	0	0	0	0	109.1	H285	H285-A327 HydrophobicContact CB-CB 4.3Å; H285-A327 PolarHBondContact O-N 2.94Å; H285-A327 VanDerWaalsContact O-N 3.08Å
328	I	39.2	Very low	39.9	Very low	114 Å²	114	88.4 Å²	88.4	59%	0.585	45%	0.452	S	S	*	.			trans	-96.3	-20.5	-175.7	-60.3	179.6	0	0	0	112.1	I326	I326-I328 HydrophobicContact CB-CG1 4.34Å; I326-I328 HydrophobicContact CG2-CD1 4.02Å; I326-I328 HydrophobicContact CG2-CG1 3.62Å
329	L	41	Very low	39.5	Very low	59 Å²	59	93.1 Å²	93.1	31%	0.309	47%	0.47	S	S	.	.	S	Bend	trans	-107.4	-24.6	-153.4	-150.3	79.1	0	0	0	117.1	S142 L332 M333	S142-L329 WeakPolarHBondContact O-CD2 3.35Å; L329-L332 PolarHBondContact O-N 2.96Å; L329-M333 PolarHBondContact O-N 2.89Å
330	E	35	Very low	39.3	Very low	128 Å²	128	93.9 Å²	93.9	60%	0.598	47%	0.474	S	S	*	.	H	α-helix	trans	-68.6	-51.2	-172.5	-71.8	164	169.3	0	0	110.8	K92 L332 M333	K92-E330 IonicContact NZ-OE1 2.69Å; K92-E330 PolarHBondContact NZ-OE1 2.88Å; K92-E330 VanDerWaalsContact NZ-OE1 3.12Å; E330-L332 VanDerWaalsContact C-N 3.32Å; E330-L332 PolarHBondContact O-N 2.99Å; E330-M333 PolarHBondContact O-N 2.88Å
331	E	38.8	Very low	38.9	Very low	81 Å²	81	97.8 Å²	97.8	38%	0.379	49%	0.487	S	S	.	.	H	α-helix	trans	-68.2	-22.3	175.8	-68.7	177.8	158.4	0	0	113.7	K252 G284 L335	K252-E331 IonicContact NZ-OE1 2.77Å; K252-E331 PolarHBondContact NZ-OE1 2.89Å; G284-E331 WeakPolarHBondContact CA-OE2 3.47Å; E331-L335 PolarHBondContact O-N 3.27Å
332	L	39.1	Very low	38.4	Very low	86 Å²	86	100 Å²	100	45%	0.45	50%	0.498	S	S	.	.	H	α-helix	trans	-73.6	-28.5	-179.8	-161.3	92.3	0	0	0	112.4	L329 E330 L336	L329-L332 PolarHBondContact O-N 2.96Å; E330-L332 VanDerWaalsContact C-N 3.32Å; E330-L332 PolarHBondContact O-N 2.99Å; L332-L336 HydrophobicContact CD2-CD1 4.26Å; L332-L336 WeakPolarHBondContact O-CB 3.3Å; L332-L336 WeakPolarHBondContact O-CG 3.32Å; L332-L336 PolarHBondContact O-N 3.01Å
333	M	38.6	Very low	37.8	Very low	109 Å²	109	104.9 Å²	104.9	54%	0.537	52%	0.521	S	S	.	.	H	α-helix	trans	-70.6	-36.3	178	-74.2	-62.5	-62.2	0	0	111.9	L329 E330 L336 S337	L329-M333 PolarHBondContact O-N 2.89Å; E330-M333 PolarHBondContact O-N 2.88Å; M333-L336 PolarHBondContact O-N 2.92Å; M333-L336 HydrophobicContact SD-CD1 4.45Å; M333-S337 PolarHBondContact O-N 3.12Å
334	D	40.8	Very low	37.2	Very low	112 Å²	112	111.7 Å²	111.7	60%	0.599	54%	0.544	S	S	*	.	H	α-helix	trans	-69.8	-38.8	174.3	-67.5	-31.5	0	0	0	111.7	L336 S337 W338	D334-L336 PolarHBondContact O-N 3.31Å; D334-S337 PolarHBondContact O-N 3.23Å; D334-S337 PolarHBondContact O-OG 3.37Å; D334-W338 PolarHBondContact O-N 3.06Å
335	L	41.1	Very low	36.6	Very low	96 Å²	96	115.2 Å²	115.2	50%	0.503	57%	0.568	S	S	.	*	H	α-helix	trans	-64.4	-27.3	171.3	-94.6	164.9	0	0	0	113.3	E331 K339	E331-L335 PolarHBondContact O-N 3.27Å; L335-K339 PolarHBondContact O-N 2.76Å
336	L	38.2	Very low	36	Very low	91 Å²	91	116.4 Å²	116.4	48%	0.476	59%	0.59	S	S	.	*	H	α-helix	trans	-80.5	-32.6	173	-79.5	166	0	0	0	112.9	L332 M333 D334 K339 L340	L332-L336 HydrophobicContact CD2-CD1 4.26Å; L332-L336 WeakPolarHBondContact O-CB 3.3Å; L332-L336 WeakPolarHBondContact O-CG 3.32Å; L332-L336 PolarHBondContact O-N 3.01Å; M333-L336 PolarHBondContact O-N 2.92Å; M333-L336 HydrophobicContact SD-CD1 4.45Å; D334-L336 PolarHBondContact O-N 3.31Å; L336-K339 PolarHBondContact O-N 3.43Å; L336-L340 PolarHBondContact O-N 2.97Å
337	S	36.8	Very low	35.2	Very low	59 Å²	59	120.7 Å²	120.7	41%	0.413	61%	0.612	S	S	.	*	H	α-helix	trans	-68.9	-42.3	175	76.5	0	0	0	0	111.2	M333 D334 K339 L340	M333-S337 PolarHBondContact O-N 3.12Å; D334-S337 PolarHBondContact O-N 3.23Å; D334-S337 PolarHBondContact O-OG 3.37Å; S337-K339 VanDerWaalsContact C-N 3.3Å; S337-K339 PolarHBondContact O-N 3.17Å; S337-L340 WeakPolarHBondContact O-CB 3.35Å; S337-L340 PolarHBondContact O-N 2.9Å; S337-L340 VanDerWaalsContact O-N 3.08Å
338	W	39.9	Very low	34.9	Very low	192 Å²	192	126 Å²	126	73%	0.727	63%	0.633	S	S	*	*	H	α-helix	trans	-62.3	-36.1	175.2	-123.8	49.7	0	0	0	112.7	D334 L340 Y341 I342	D334-W338 PolarHBondContact O-N 3.06Å; W338-L340 PolarHBondContact O-N 2.79Å; W338-Y341 PolarHBondContact O-N 3.28Å; W338-I342 HydrophobicContact CE3-CD1 4.21Å
339	K	33.7	Very low	34.5	Very low	165 Å²	165	125.7 Å²	125.7	72%	0.717	64%	0.637	S	S	*	*	H	α-helix	trans	-70.8	-12	175.3	-105.1	-179.6	177.5	173.5	0	115.2	L335 L336 S337	L335-K339 PolarHBondContact O-N 2.76Å; L336-K339 PolarHBondContact O-N 3.43Å; S337-K339 VanDerWaalsContact C-N 3.3Å; S337-K339 PolarHBondContact O-N 3.17Å
340	L	35.4	Very low	33.8	Very low	136 Å²	136	128.7 Å²	128.7	71%	0.712	66%	0.658	S	S	*	*	H	α-helix	trans	-84.7	-23.3	171.9	-74.1	164.8	0	0	0	112.7	L336 S337 W338	L336-L340 PolarHBondContact O-N 2.97Å; S337-L340 WeakPolarHBondContact O-CB 3.35Å; S337-L340 PolarHBondContact O-N 2.9Å; S337-L340 VanDerWaalsContact O-N 3.08Å; W338-L340 PolarHBondContact O-N 2.79Å
341	Y	32.4	Very low	33.5	Very low	204 Å²	204	130.7 Å²	130.7	80%	0.8	67%	0.668	S	S	*	*	H	α-helix	trans	-87.2	-21.2	-177	-113.9	-83.3	0	0	0	115	W338	W338-Y341 PolarHBondContact O-N 3.28Å
342	I	33.2	Very low	32.9	Very low	113 Å²	113	132.6 Å²	132.6	58%	0.579	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.3	-11.3	-171.4	-67.8	174.2	0	0	0	113.3	W338	W338-I342 HydrophobicContact CE3-CD1 4.21Å
343	N	30	Very low	32.3	Very low	148 Å²	148	133.2 Å²	133.2	79%	0.791	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.1	19.1	-177.8	-95	7.7	0	0	0	114.8
344	Q	29.4	Very low	31.9	Very low	175 Å²	175	133.6 Å²	133.6	82%	0.818	71%	0.71	S	S	*	*	S	Bend	trans	-130.7	22.4	178.3	-80.3	-163.1	-30.9	0	0	116.4
345	T	28.2	Very low	31.3	Very low	128 Å²	128	136.5 Å²	136.5	79%	0.785	72%	0.717	S	S	*	*			trans	-145.9	82.5	159.5	49.7	0	0	0	0	113
346	C	24.7	Very low	30.7	Very low	125 Å²	125	139.1 Å²	139.1	85%	0.845	73%	0.727	S	S	*	*			trans	-120.3	159.7	142.8	-79.1	0	0	0	0	107.7
347	I	27.9	Very low	30.1	Very low	170 Å²	170	139.6 Å²	139.6	87%	0.872	74%	0.738	S	S	*	*			trans	75.2	85.2	-172.2	-46.1	170.3	0	0	0	113.5
348	L	30.2	Very low	29.7	Very low	154 Å²	154	144 Å²	144	81%	0.806	76%	0.762	S	S	*	*				-153.2	119.3	129.8	-111.4	165.8	0	0	0	108.6
349	T	30.2	Very low	28.8	Very low	109 Å²	109	140.6 Å²	140.6	67%	0.669	77%	0.766	S	S	*	*			trans	33.3	114.9	158.7	51	0	0	0	0	118.4
350	T	25.3	Very low	28.5	Very low	121 Å²	121	136.6 Å²	136.6	74%	0.742	76%	0.76	S	S	*	*			cis	49.5	107.3	36.8	81.4	0	0	0	0	115.5
351	Q	30.4	Very low	28.1	Very low	171 Å²	171	138.2 Å²	138.2	80%	0.799	76%	0.763	S	S	*	*			trans	157.7	123.1	134.7	-83.3	178.3	-13.4	0	0	107.7
352	T	25.8	Very low	27.9	Very low	121 Å²	121	131.9 Å²	131.9	74%	0.742	75%	0.748	S	S	*	*				67.8	141.9	53.4	71.3	0	0	0	0	113.1
353	S	25.9	Very low	27.6	Very low	98 Å²	98	135.1 Å²	135.1	69%	0.685	76%	0.76	S	S	*	*			cis	178.1	137.2	-11.4	47.5	0	0	0	0	109.6
354	S	30.4	Very low	27.3	Very low	117 Å²	117	133.6 Å²	133.6	82%	0.818	75%	0.748	S	S	*	*			trans	-177.9	156	169.5	40.3	0	0	0	0	111.5
355	F	28.5	Very low	27.3	Very low	173 Å²	173	130.5 Å²	130.5	76%	0.759	75%	0.746	S	S	*	*			cis	-157.9	174.4	-29.3	-130.2	-94.2	0	0	0	106.8
356	E	28.8	Very low	27	Very low	152 Å²	152	128.8 Å²	128.8	71%	0.71	74%	0.735	S	S	*	*			trans	28.2	106.2	162.2	-78.4	146	-156.7	0	0	119.6
357	S	25	Very low	27.1	Very low	100 Å²	100	129.1 Å²	129.1	70%	0.699	73%	0.727	S	S	*	*				69.8	109	68.4	79.7	0	0	0	0	116.7
358	T	28.1	Very low	27.1	Very low	151 Å²	151	127.9 Å²	127.9	93%	0.926	72%	0.718	S	S	*	*			trans	-159.2	152.9	135.9	0.2	0	0	0	0	111.2
359	C	22.2	Very low	27.2	Very low	121 Å²	121	127 Å²	127	82%	0.818	71%	0.709	S	S	*	*			trans	-110.8	174.8	172	-139.8	0	0	0	0	106.5
360	S	26.2	Very low	26.9	Very low	82 Å²	82	128 Å²	128	57%	0.573	71%	0.706	S	S	*	*			cis	-158.1	173.9	18.1	53.8	0	0	0	0	113.3
361	H	27.1	Very low	26.8	Very low	170 Å²	170	129 Å²	129	79%	0.787	70%	0.702	S	S	*	*			trans	67.7	138.8	166.7	-64.4	-69.1	0	0	0	118.2
362	C	28.3	Very low	26.5	Very low	70 Å²	70	126.8 Å²	126.8	47%	0.473	70%	0.696	S	S	.	*			trans	-47.2	148.2	145.1	-74.1	0	0	0	0	111.6	Q364	C362-Q364 HydrophobicContact CB-CB 3.66Å; C362-Q364 HydrophobicContact CB-CG 3.46Å; C362-Q364 VanDerWaalsContact CB-CG 3.46Å
363	H	27.9	Very low	26.6	Very low	182 Å²	182	126.2 Å²	126.2	84%	0.843	69%	0.693	S	S	*	*				-104.7	122.3	93.2	-82.6	-79.5	0	0	0	107.2
364	Q	24	Very low	26.5	Very low	115 Å²	115	128.5 Å²	128.5	54%	0.537	70%	0.696	S	S	.	*			cis	53.7	72.5	45.4	-84.9	163.8	-27	0	0	108.8	C362 T366	C362-Q364 HydrophobicContact CB-CB 3.66Å; C362-Q364 HydrophobicContact CB-CG 3.46Å; C362-Q364 VanDerWaalsContact CB-CG 3.46Å; Q364-T366 HydrophobicContact CB-CG2 3.78Å; Q364-T366 HydrophobicContact CG-CG2 3.92Å
365	S	27.5	Very low	26.1	Very low	111 Å²	111	130.9 Å²	130.9	78%	0.776	69%	0.694	S	S	*	*				-62.9	122.3	67.4	53.3	0	0	0	0	116
366	T	23.4	Very low	26	Very low	92 Å²	92	130.1 Å²	130.1	56%	0.564	70%	0.695	S	S	*	*			cis	70.3	150.7	26	87.2	0	0	0	0	116.4	Q364	Q364-T366 HydrophobicContact CB-CG2 3.78Å; Q364-T366 HydrophobicContact CG-CG2 3.92Å
367	I	25.6	Very low	25.7	Very low	131 Å²	131	129.9 Å²	129.9	67%	0.672	70%	0.698	S	S	*	*			trans	92.2	126.4	145.3	-85.5	170.7	0	0	0	119.1
368	H	29.2	Very low	25.7	Very low	145 Å²	145	132.1 Å²	132.1	67%	0.671	70%	0.697	S	S	*	*			trans	58.1	132.8	169.9	-52.5	-35.8	0	0	0	119.3
369	H	31.3	Very low	25.5	Very low	135 Å²	135	132.4 Å²	132.4	63%	0.625	69%	0.688	S	S	*	*			cis	-149.4	145.8	-28.5	-98.5	-46.9	0	0	0	104.5
370	Q	23.9	Very low	25.6	Very low	129 Å²	129	130.3 Å²	130.3	60%	0.603	67%	0.674	S	S	*	*				66.5	151.1	54.4	-147	-177.7	-24.5	0	0	112.1
371	E	23.6	Very low	25.7	Very low	143 Å²	143	132 Å²	132	67%	0.668	69%	0.686	S	S	*	*			trans	16.8	145.8	150.1	-73.9	137.8	-131.8	0	0	120.5
372	D	24.4	Very low	25.6	Very low	125 Å²	125	132.3 Å²	132.3	67%	0.668	69%	0.686	S	S	*	*			cis	-162.2	-162.1	26.9	-144.5	-26.9	0	0	0	113.4
373	T	27.8	Very low	25.5	Very low	109 Å²	109	133.2 Å²	133.2	67%	0.669	69%	0.691	S	S	*	*			trans	58.4	101.7	149.6	43.5	0	0	0	0	116.2
374	L	22.6	Very low	25.4	Very low	145 Å²	145	134 Å²	134	76%	0.759	69%	0.692	S	S	*	*			cis	52	113.8	43.2	-136.2	177.3	0	0	0	111
375	Q	23.5	Very low	25.5	Very low	167 Å²	167	137.8 Å²	137.8	78%	0.78	71%	0.707	S	S	*	*			trans	74.1	152.5	-173.2	-45.7	177	7.3	0	0	113.1
376	M	25.2	Very low	25.2	Very low	158 Å²	158	140 Å²	140	78%	0.778	71%	0.71	S	S	*	*			cis	-138.4	163.2	9	-154.5	171.3	73.2	0	0	112.3
377	L	22.6	Very low	25.3	Very low	146 Å²	146	142.1 Å²	142.1	76%	0.764	72%	0.718	S	S	*	*			trans	-59.3	139.5	155.4	-71.6	108.4	0	0	0	109.6
378	E	24.7	Very low	25.2	Very low	147 Å²	147	144.3 Å²	144.3	69%	0.687	72%	0.723	S	S	*	*				152.1	133.2	118.3	-81.7	-159.6	158.6	0	0	113.2
379	H	25.6	Very low	24.9	Very low	158 Å²	158	142.5 Å²	142.5	73%	0.731	73%	0.726	S	S	*	*			trans	56.5	157.7	145.7	-58.1	-35.5	0	0	0	122
380	S	24.2	Very low	24.5	Very low	76 Å²	76	141.3 Å²	141.3	53%	0.531	73%	0.732	S	S	.	*			cis	-167.4	130.7	-36.9	57.4	0	0	0	0	110.9
381	S	27.7	Very low	24.6	Very low	118 Å²	118	145.1 Å²	145.1	83%	0.825	74%	0.742	S	S	*	*			trans	-169.6	94.9	153.3	10.1	0	0	0	0	107.7
382	F	24	Very low	24.7	Very low	177 Å²	177	144.6 Å²	144.6	78%	0.776	74%	0.743	S	S	*	*				56.1	141.5	66.8	-72.4	-57.2	0	0	0	115
383	P	27.9	Very low	24.7	Very low	89 Å²	89	147.4 Å²	147.4	58%	0.578	75%	0.749	S	S	*	*			cis	-128.1	-167.3	-20.9	39.6	-19.7	0	0	0	110.6
384	F	25.6	Very low	24.7	Very low	198 Å²	198	150.5 Å²	150.5	87%	0.868	76%	0.756	S	S	*	*				-152.7	142.1	71.5	-102.6	-81.6	0	0	0	113.3
385	K	24.5	Very low	24.8	Very low	195 Å²	195	149.4 Å²	149.4	85%	0.848	76%	0.755	S	S	*	*			trans	-79.7	158.1	170.4	-74.1	178.8	176.1	175.3	0	111.2	N387	K385-N387 PolarHBondContact O-N 3.46Å
386	N	22.4	Very low	24.9	Very low	156 Å²	156	147.1 Å²	147.1	83%	0.834	76%	0.758	S	S	*	*			trans	-30	126.9	165.7	-59.5	-14.8	0	0	0	114.7
387	N	24.4	Very low	25	Very low	138 Å²	138	142.8 Å²	142.8	74%	0.738	75%	0.754	S	S	*	*			trans	-167.4	136.5	135	-103.5	-47.7	0	0	0	113.3	K385	K385-N387 PolarHBondContact O-N 3.46Å
388	K	24.5	Very low	25.3	Very low	177 Å²	177	143.3 Å²	143.3	77%	0.77	76%	0.757	S	S	*	*			trans	51.6	116.1	141.4	-61.9	173.8	-174.5	-177.8	0	121.1
389	S	23.8	Very low	25.5	Very low	106 Å²	106	143.2 Å²	143.2	74%	0.741	76%	0.76	S	S	*	*			trans	56.2	111.8	134.7	62.2	0	0	0	0	121.8
390	C	22.7	Very low	25.6	Very low	110 Å²	110	141.8 Å²	141.8	74%	0.743	76%	0.757	S	S	*	*				57.9	106.6	129.4	-65.5	0	0	0	0	122
391	Y	25.9	Very low	25.8	Very low	210 Å²	210	142.9 Å²	142.9	82%	0.824	76%	0.764	S	S	*	*				83.9	124.5	127.6	-76.9	-56	0	0	0	123.8
392	L	25.7	Very low	25.9	Very low	132 Å²	132	144.3 Å²	144.3	69%	0.691	76%	0.758	S	S	*	*			trans	89.9	104.2	134.2	-74.2	165.6	0	0	0	123.1
393	K	23.8	Very low	26.1	Very low	184 Å²	184	142.4 Å²	142.4	80%	0.8	76%	0.755	S	S	*	*			trans	53	123.2	130.8	-74.7	-178	-174.3	173.3	0	121.6
394	Q	27.3	Very low	26.1	Very low	174 Å²	174	143.1 Å²	143.1	81%	0.813	76%	0.762	S	S	*	*				-172.7	126.7	102.4	-104.3	173.6	-13.9	0	0	110.6
395	T	25	Very low	26.1	Very low	121 Å²	121	141.1 Å²	141.1	74%	0.742	76%	0.76	S	S	*	*				54.4	138.6	107.3	59.7	0	0	0	0	116.8
396	S	25	Very low	26.2	Very low	120 Å²	120	141.1 Å²	141.1	84%	0.839	76%	0.76	S	S	*	*			cis	-177.8	157.1	0.1	43.5	0	0	0	0	113.1
397	G	28.5	Very low	26.7	Very low	66 Å²	66	138.6 Å²	138.6	68%	0.68	75%	0.752	S	S	*	*			trans	134.8	130.2	164.9	0	0	0	0	0	113.2
398	N	27.7	Very low	26.7	Very low	158 Å²	158	139.3 Å²	139.3	85%	0.845	76%	0.756	S	S	*	*			cis	74.9	142.2	45.4	-67.8	3.5	0	0	0	112.7
399	I	29.9	Very low	26.8	Very low	145 Å²	145	140 Å²	140	74%	0.744	76%	0.759	S	S	*	*			cis	-165.2	159	15.8	-119.1	156.5	0	0	0	107
400	I	27.8	Very low	26.8	Very low	128 Å²	128	143.5 Å²	143.5	66%	0.656	76%	0.764	S	S	*	*			cis	-168.1	144.6	-21.3	-155.4	173.4	0	0	0	111.7
401	S	28.8	Very low	26.8	Very low	98.5 Å²	98.5	144.1 Å²	144.1	69%	0.689	77%	0.768	S	S	*	*				-170.6	148.7	70.8	56.9	0	0	0	0	109
402	H	29.3	Very low	26.9	Very low	148.5 Å²	148.5	141 Å²	141	69%	0.688	77%	0.77	S	S	*	*			cis	133.7	134.5	47.2	-99.1	-64.6	0	0	0	111.5
403	N	28.8	Very low	26.8	Very low	135.5 Å²	135.5	143.7 Å²	143.7	73%	0.725	78%	0.78	S	S	*	*				135.5	154.1	87	-78.4	-15	0	0	0	119.4
404	S	26.8	Very low	26.9	Very low	104.5 Å²	104.5	143.4 Å²	143.4	73%	0.731	78%	0.781	S	S	*	*				115.4	128	72.9	53.1	0	0	0	0	115.2
405	L	26.7	Very low	26.9	Very low	156 Å²	156	141 Å²	141	82%	0.817	78%	0.782	S	S	*	*				-160.8	99.3	69.4	-115.6	174	0	0	0	111.5
406	K	25	Very low	26.8	Very low	195 Å²	195	143.6 Å²	143.6	85%	0.848	79%	0.791	S	S	*	*			trans	123.4	160	152.7	-90.9	-178.6	-178.1	-178.9	0	115.4
407	P	34.1	Very low	26.8	Very low	103 Å²	103	145.5 Å²	145.5	67%	0.669	79%	0.792	S	S	*	*			cis	-131.3	172.1	-27.4	41.2	-27.1	0	0	0	115.2
408	N	24.4	Very low	26.6	Very low	153 Å²	153	147.3 Å²	147.3	82%	0.818	79%	0.793	S	S	*	*			trans	146.2	118.7	145.7	-88.7	-11.7	0	0	0	116.7
409	F	24.9	Very low	26.5	Very low	193 Å²	193	146.8 Å²	146.8	85%	0.846	79%	0.789	S	S	*	*			trans	-4.5	152.5	165.4	-79.3	-95.8	0	0	0	111.7
410	Q	24.3	Very low	26.1	Very low	178.5 Å²	178.5	149 Å²	149	83%	0.834	79%	0.793	S	S	*	*				140.7	129.5	-88.8	-104	166.6	-41.8	0	0	113.6
411	C	23.8	Very low	26	Very low	123.5 Å²	123.5	150.4 Å²	150.4	83%	0.834	80%	0.801	S	S	*	*			trans	-118.8	113	165.2	-100.3	0	0	0	0	115.1
412	V	27	Very low	25.6	Very low	143 Å²	143	151.2 Å²	151.2	87%	0.867	81%	0.806	S	S	*	*			trans	152	80.5	164.5	-169.3	0	0	0	0	112
413	Q	24.4	Very low	25.4	Very low	189.5 Å²	189.5	150.7 Å²	150.7	89%	0.886	81%	0.807	S	S	*	*			trans	-141.2	85.7	162.6	-165.1	172.1	-1.6	0	0	109.7
414	E	26	Very low	25.1	Very low	177 Å²	177	148.8 Å²	148.8	83%	0.827	80%	0.804	S	S	*	*			trans	-123.2	151.7	172.4	-92	175.5	170.8	0	0	110.8	L416	E414-L416 PolarHBondContact O-N 3.34Å
415	C	26.5	Very low	25	Very low	124.5 Å²	124.5	152.6 Å²	152.6	84%	0.841	81%	0.808	S	S	*	*			trans	51.5	60.3	165.6	-65.2	0	0	0	0	118.1	N417	C415-N417 PolarHBondContact O-N 3.11Å
416	L	23.3	Very low	25	Very low	176.5 Å²	176.5	149.7 Å²	149.7	92%	0.924	80%	0.796	S	S	*	*			trans	-85.9	109.8	151.9	-81.4	168.3	0	0	0	110.8	E414	E414-L416 PolarHBondContact O-N 3.34Å
417	N	25.2	Very low	25.1	Very low	160 Å²	160	144.7 Å²	144.7	86%	0.856	78%	0.784	S	S	*	*			trans	-136.8	125.3	162.6	-111.1	-31	0	0	0	109.4	C415 I419	C415-N417 PolarHBondContact O-N 3.11Å; N417-I419 PolarHBondContact O-N 2.58Å
418	S	23.5	Very low	24.9	Very low	102.5 Å²	102.5	145.9 Å²	145.9	72%	0.717	78%	0.782	S	S	*	*			trans	-84.1	119.8	-165.5	55.9	0	0	0	0	113.3	K420	S418-K420 PolarHBondContact O-N 2.9Å
419	I	25.9	Very low	25.3	Very low	148.5 Å²	148.5	145.8 Å²	145.8	76%	0.762	78%	0.777	S	S	*	*			trans	-86.7	105.2	161.1	-60.1	179.4	0	0	0	108.1	N417	N417-I419 PolarHBondContact O-N 2.58Å
420	K	21.5	Very low	25.5	Very low	189.5 Å²	189.5	142.4 Å²	142.4	82%	0.824	77%	0.767	S	S	*	*			trans	-78.5	127.6	166.1	-66.3	178.4	-179.4	176.5	0	108.7	S418	S418-K420 PolarHBondContact O-N 2.9Å
421	L	24.7	Very low	25.7	Very low	158 Å²	158	141.5 Å²	141.5	83%	0.827	76%	0.76	S	S	*	*			trans	-117	133.3	161.5	-157.7	115.2	0	0	0	108.5	I423	L421-I423 HydrophobicContact CD2-CD1 4.02Å; L421-I423 HydrophobicContact CD2-CG1 3.64Å
422	C	22.3	Very low	25.8	Very low	116 Å²	116	142.6 Å²	142.6	78%	0.784	76%	0.758	S	S	*	*			trans	-116.3	163.6	-174.7	-160.5	0	0	0	0	109.5
423	I	24.1	Very low	25.8	Very low	138 Å²	138	144.3 Å²	144.3	71%	0.708	75%	0.754	S	S	*	*			trans	152.7	126.7	172	-57.4	167.4	0	0	0	110.8	L421 F425	L421-I423 HydrophobicContact CD2-CD1 4.02Å; L421-I423 HydrophobicContact CD2-CG1 3.64Å; I423-F425 HydrophobicContact CG2-CE1 4.39Å; I423-F425 HydrophobicContact CG2-CZ 4.21Å
424	S	22.6	Very low	25.9	Very low	95 Å²	95	141.4 Å²	141.4	66%	0.664	74%	0.744	S	S	*	*				-139.4	146.5	-102.1	52.7	0	0	0	0	109.7
425	F	25.6	Very low	26.1	Very low	185 Å²	185	141.3 Å²	141.3	81%	0.811	74%	0.744	S	S	*	*			trans	-83.2	129.1	173	-58.5	-86.3	0	0	0	110.6	I423 H484	I423-F425 HydrophobicContact CG2-CE1 4.39Å; I423-F425 HydrophobicContact CG2-CZ 4.21Å; F425-H484 AromaticContact CE1-NE2 3.88Å; F425-H484 AromaticContact CZ-NE2 3.57Å
426	V	26.7	Very low	26	Very low	95 Å²	95	141.3 Å²	141.3	58%	0.576	74%	0.735	S	S	*	*			trans	-129.3	129	172.8	-177.7	0	0	0	0	108	L430	V426-L430 HydrophobicContact CG1-CB 4.21Å; V426-L430 HydrophobicContact CG1-CD1 3.58Å; V426-L430 HydrophobicContact CG1-CG 4.4Å
427	P	26.1	Very low	26.2	Very low	90 Å²	90	142 Å²	142	58%	0.584	73%	0.733	S	S	*	*			trans	-73.3	158.3	-178.7	29.8	-35.1	0	0	0	112.6	Q429 L430	P427-Q429 PolarHBondContact O-N 3.07Å; P427-L430 PolarHBondContact O-N 3.11Å
428	M	29.6	Very low	26.2	Very low	127 Å²	127	141.1 Å²	141.1	63%	0.626	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	15.6	-173.7	-157.2	116.9	114.9	0	0	114.5	L430 F431 E460	M428-L430 PolarHBondContact O-N 3.25Å; M428-F431 HydrophobicContact CG-CD2 4.47Å; M428-F431 PolarHBondContact O-N 3.23Å; M428-F431 VanDerWaalsContact O-N 3.1Å; M428-E460 WeakPolarHBondContact CE-O 3.34Å
429	Q	32.5	Very low	26.3	Very low	152.5 Å²	152.5	144.1 Å²	144.1	71%	0.713	72%	0.724	S	S	*	*	G	3₁₀ helix	trans	-91.4	-3.7	175.2	-66.9	174.5	-11.3	0	0	113.4	P427 R706	P427-Q429 PolarHBondContact O-N 3.07Å; Q429-R706 VanDerWaalsContact OE1-CZ 3.29Å
430	L	28.9	Very low	26.3	Very low	121.5 Å²	121.5	144.4 Å²	144.4	64%	0.636	72%	0.722	S	S	*	*			trans	-110.2	10.1	177.7	-82.6	161.8	0	0	0	114	V426 P427 M428 N432	V426-L430 HydrophobicContact CG1-CB 4.21Å; V426-L430 HydrophobicContact CG1-CD1 3.58Å; V426-L430 HydrophobicContact CG1-CG 4.4Å; P427-L430 PolarHBondContact O-N 3.11Å; M428-L430 PolarHBondContact O-N 3.25Å; L430-N432 VanDerWaalsContact C-N 3.27Å
431	F	30.2	Very low	26.4	Very low	160 Å²	160	142.5 Å²	142.5	70%	0.702	72%	0.716	S	S	*	*			trans	-89.5	4.4	174.9	-110.3	-77.5	0	0	0	114.5	M428 F433	M428-F431 HydrophobicContact CG-CD2 4.47Å; M428-F431 PolarHBondContact O-N 3.23Å; M428-F431 VanDerWaalsContact O-N 3.1Å; F431-F433 PolarHBondContact O-N 2.89Å
432	N	25	Very low	26.4	Very low	146 Å²	146	140.8 Å²	140.8	78%	0.781	71%	0.712	S	S	*	*			trans	-84.8	90.1	168.6	-80.8	-4.1	0	0	0	110.7	L430 N434	L430-N432 VanDerWaalsContact C-N 3.27Å; N432-N434 PolarHBondContact O-N 2.89Å
433	F	28	Very low	26.6	Very low	179 Å²	179	143.2 Å²	143.2	79%	0.785	71%	0.712	S	S	*	*			trans	-101.4	114.3	156.5	-87.9	-87.1	0	0	0	106.8	F431 H435	F431-F433 PolarHBondContact O-N 2.89Å; F433-H435 PolarHBondContact O-N 3.26Å
434	N	26.2	Very low	26.6	Very low	127 Å²	127	143.2 Å²	143.2	68%	0.679	71%	0.713	S	S	*	*	S	Bend		-92.8	143.2	-88.1	-78.3	-25.8	0	0	0	109.6	N432	N432-N434 PolarHBondContact O-N 2.89Å
435	H	28.9	Very low	26.8	Very low	176.5 Å²	176.5	146.5 Å²	146.5	82%	0.817	72%	0.718	S	S	*	*				-99.8	150.4	93.9	-91.1	-77.4	0	0	0	111.8	F433	F433-H435 PolarHBondContact O-N 3.26Å
436	N	24.5	Very low	26.7	Very low	123 Å²	123	146.6 Å²	146.6	66%	0.658	72%	0.718	S	S	*	*			trans	2.9	117.3	164.7	-52.6	-26.7	0	0	0	113.3
437	H	28.4	Very low	26.6	Very low	191 Å²	191	146.8 Å²	146.8	88%	0.884	72%	0.724	S	S	*	*				-158.4	147	117.5	-91.4	-71.6	0	0	0	109.7
438	H	24.6	Very low	26.5	Very low	142.5 Å²	142.5	147.7 Å²	147.7	66%	0.66	73%	0.733	S	S	*	*				-120.6	162.2	-114.1	-94.9	-98.7	0	0	0	109
439	F	25.4	Very low	26.3	Very low	165.5 Å²	165.5	146.5 Å²	146.5	73%	0.726	74%	0.737	S	S	*	*				131.7	149.2	112.9	-90.3	-83.8	0	0	0	113.8
440	E	25.7	Very low	25.9	Very low	153.5 Å²	153.5	144.3 Å²	144.3	72%	0.717	74%	0.738	S	S	*	*				-49.4	142	70.5	-85.8	170.2	159.7	0	0	116.3
441	Q	24.1	Very low	25.8	Very low	149.5 Å²	149.5	143.9 Å²	143.9	70%	0.699	75%	0.745	S	S	*	*			cis	125.1	126.6	48.5	-97.2	-174.6	14.8	0	0	114.2
442	T	25.9	Very low	25.7	Very low	122.5 Å²	122.5	141.6 Å²	141.6	75%	0.752	75%	0.749	S	S	*	*			trans	128	147.2	134.8	29.9	0	0	0	0	117.4
443	Q	25.7	Very low	25.8	Very low	167 Å²	167	142.1 Å²	142.1	78%	0.78	75%	0.751	S	S	*	*				104.1	146.9	59.3	-86.7	-179.1	-12.6	0	0	116.3
444	L	25	Very low	25.7	Very low	138 Å²	138	139.3 Å²	139.3	72%	0.723	75%	0.751	S	S	*	*				117	164.6	58.1	-97.7	162.3	0	0	0	114.4	F446	L444-F446 HydrophobicContact CD2-CE2 4.21Å
445	Q	25.6	Very low	25.7	Very low	164.5 Å²	164.5	138.6 Å²	138.6	77%	0.769	76%	0.756	S	S	*	*				153.8	139.1	90.6	-69.2	-173.8	-9.5	0	0	118
446	F	23.2	Very low	25.7	Very low	187 Å²	187	134.4 Å²	134.4	82%	0.82	75%	0.746	S	S	*	*			trans	6	161.4	154.3	-58.8	-78.3	0	0	0	119.7	L444	L444-F446 HydrophobicContact CD2-CE2 4.21Å
447	S	25.6	Very low	25.8	Very low	99.5 Å²	99.5	134.7 Å²	134.7	70%	0.696	75%	0.752	S	S	*	*			cis	-156.7	153.6	23.4	57.3	0	0	0	0	116.9
448	S	24.5	Very low	25.9	Very low	109 Å²	109	129.5 Å²	129.5	76%	0.762	73%	0.733	S	S	*	*			trans	29.5	151.1	150.8	58.4	0	0	0	0	120.9
449	S	24.6	Very low	26.1	Very low	101.5 Å²	101.5	126.7 Å²	126.7	71%	0.71	73%	0.728	S	S	*	*			cis	-161.8	163.6	12.8	52.6	0	0	0	0	114.6
450	S	24.1	Very low	26.3	Very low	107 Å²	107	125.7 Å²	125.7	75%	0.748	73%	0.726	S	S	*	*			trans	43.8	121.4	148.4	61.3	0	0	0	0	121.5
451	S	26.9	Very low	26.5	Very low	112 Å²	112	122.9 Å²	122.9	78%	0.783	71%	0.714	S	S	*	*				-173.7	158.2	70.4	53.9	0	0	0	0	113.6
452	S	27	Very low	26.8	Very low	112.5 Å²	112.5	118 Å²	118	79%	0.787	70%	0.703	S	S	*	*			trans	-3.2	95	166.6	57.1	0	0	0	0	116.2
453	L	27.5	Very low	27.1	Very low	157 Å²	157	116.1 Å²	116.1	82%	0.822	68%	0.684	S	S	*	*			trans	-22.3	144.5	153.7	-97.9	82	0	0	0	115.8	S455	L453-S455 PolarHBondContact O-N 3Å
454	P	27	Very low	27.3	Very low	119.5 Å²	119.5	114.5 Å²	114.5	78%	0.776	67%	0.672	S	S	*	*			trans	-83.7	145.8	-178.9	33.5	-33.9	0	0	0	112.4	S456	P454-S456 PolarHBondContact O-N 3.12Å
455	S	26	Very low	27.6	Very low	112 Å²	112	112 Å²	112	78%	0.783	66%	0.656	S	S	*	*			trans	-106.1	104.3	167	62.9	0	0	0	0	111.8	L453 V457	L453-S455 PolarHBondContact O-N 3Å; S455-V457 PolarHBondContact O-N 2.9Å; S455-V457 VanDerWaalsContact O-N 3.15Å
456	S	28.2	Very low	27.9	Very low	87.5 Å²	87.5	107.6 Å²	107.6	61%	0.612	64%	0.635	S	S	*	*			trans	-13.2	100.9	167.2	61.2	0	0	0	0	113.5	P454 V458	P454-S456 PolarHBondContact O-N 3.12Å; S456-V458 PolarHBondContact O-N 3.11Å; S456-V458 VanDerWaalsContact O-N 3.07Å
457	V	27.8	Very low	28.4	Very low	130.5 Å²	130.5	102.1 Å²	102.1	79%	0.791	61%	0.614	S	S	*	*			trans	-64.6	103.3	161.3	178.2	0	0	0	0	107.4	S455	S455-V457 PolarHBondContact O-N 2.9Å; S455-V457 VanDerWaalsContact O-N 3.15Å
458	V	30	Very low	28.6	Very low	80.5 Å²	80.5	101.9 Å²	101.9	49%	0.488	60%	0.604	S	S	.	*			trans	-84.3	125.5	174.2	178.5	0	0	0	0	107.2	M237 S456 E460	M237-V458 HydrophobicContact CB-CG1 4Å; M237-V458 HydrophobicContact CG-CG1 3.67Å; S456-V458 PolarHBondContact O-N 3.11Å; S456-V458 VanDerWaalsContact O-N 3.07Å; V458-E460 PolarHBondContact O-N 3.16Å; V458-E460 VanDerWaalsContact O-N 3.11Å
459	P	28.9	Very low	28.9	Very low	85.5 Å²	85.5	103 Å²	103	56%	0.555	59%	0.591	S	S	*	*			trans	-65.6	124.4	176.7	26.6	-33.4	0	0	0	110.1	M461 M487	P459-M461 PolarHBondContact O-N 2.79Å; P459-M487 HydrophobicContact CB-CE 3.64Å
460	E	29.1	Very low	29.2	Very low	143.5 Å²	143.5	104.9 Å²	104.9	67%	0.671	58%	0.584	S	S	*	*			trans	-73.1	114.4	179.2	-63.3	-169.1	150.3	0	0	110.6	M428 V458 G462	M428-E460 WeakPolarHBondContact CE-O 3.34Å; V458-E460 PolarHBondContact O-N 3.16Å; V458-E460 VanDerWaalsContact O-N 3.11Å; E460-G462 PolarHBondContact O-N 3.45Å; E460-G462 VanDerWaalsContact O-N 3.09Å
461	M	30	Very low	29.5	Very low	95.5 Å²	95.5	103 Å²	103	47%	0.47	57%	0.571	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.3	98.4	174.8	-112.3	-175	137.2	0	0	109.6	P459 F463 L485	P459-M461 PolarHBondContact O-N 2.79Å; M461-F463 HydrophobicContact CB-CD2 4.38Å; M461-F463 HydrophobicContact CB-CE2 3.62Å; M461-F463 HydrophobicContact CB-CZ 3.97Å; M461-F463 HydrophobicContact CE-CE2 4.18Å; M461-F463 HydrophobicContact CE-CZ 3.96Å; M461-F463 HydrophobicContact CG-CE2 4.05Å; M461-F463 HydrophobicContact CG-CZ 4.45Å; M461-F463 WeakPolarHBondContact O-CD2 3.43Å; M461-F463 WeakPolarHBondContact O-CE2 3.21Å; M461-F463 HydrophobicContact SD-CE2 4Å; M461-F463 HydrophobicContact SD-CZ 4.15Å; M461-L485 HydrophobicContact CE-CD1 3.63Å; M461-L485 HydrophobicContact CE-CD2 3.84Å; M461-L485 HydrophobicContact CE-CG 4.4Å; M461-L485 HydrophobicContact CG-CD1 3.89Å
462	G	30.7	Very low	29.7	Very low	45 Å²	45	105.4 Å²	105.4	46%	0.464	57%	0.567	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.7	139.1	172	0	0	0	0	0	111.9	E460	E460-G462 PolarHBondContact O-N 3.45Å; E460-G462 VanDerWaalsContact O-N 3.09Å
463	F	31.8	Very low	30.1	Very low	83 Å²	83	108.3 Å²	108.3	36%	0.364	57%	0.569	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-126.1	120.8	173.1	-66.1	-91.7	0	0	0	110.6	F233 M461 F465	F233-F463 PolarHBondContact N-O 3.02Å; F233-F463 PolarHBondContact O-N 3.41Å; M461-F463 HydrophobicContact CB-CD2 4.38Å; M461-F463 HydrophobicContact CB-CE2 3.62Å; M461-F463 HydrophobicContact CB-CZ 3.97Å; M461-F463 HydrophobicContact CE-CE2 4.18Å; M461-F463 HydrophobicContact CE-CZ 3.96Å; M461-F463 HydrophobicContact CG-CE2 4.05Å; M461-F463 HydrophobicContact CG-CZ 4.45Å; M461-F463 WeakPolarHBondContact O-CD2 3.43Å; M461-F463 WeakPolarHBondContact O-CE2 3.21Å; M461-F463 HydrophobicContact SD-CE2 4Å; M461-F463 HydrophobicContact SD-CZ 4.15Å; F463-F465 HydrophobicContact CB-CD2 4.25Å; F463-F465 HydrophobicContact CB-CE2 3.7Å; F463-F465 HydrophobicContact CB-CZ 4.09Å; F463-F465 HydrophobicContact CD1-CZ 4.28Å; F463-F465 HydrophobicContact CG-CE2 4.44Å
464	Y	30.7	Very low	30.6	Very low	133 Å²	133	108.4 Å²	108.4	52%	0.522	56%	0.558	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94	133.9	171.5	-175.3	-99.7	0	0	0	110.5	E466	Y464-E466 HydrophobicContact CE1-CB 3.87Å
465	F	31.3	Very low	31.3	Very low	86.5 Å²	86.5	105.1 Å²	105.1	38%	0.379	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	111.3	176	-70.4	-79.8	0	0	0	110.7	M231 F233 F463 F480	M231-F465 PolarHBondContact N-O 2.68Å; F233-F465 HydrophobicContact CD2-CD2 4.39Å; F233-F465 HydrophobicContact CD2-CE2 4.49Å; F463-F465 HydrophobicContact CB-CD2 4.25Å; F463-F465 HydrophobicContact CB-CE2 3.7Å; F463-F465 HydrophobicContact CB-CZ 4.09Å; F463-F465 HydrophobicContact CD1-CZ 4.28Å; F463-F465 HydrophobicContact CG-CE2 4.44Å; F465-F480 HydrophobicContact CD1-CD1 4.23Å; F465-F480 HydrophobicContact CD1-CE1 4.25Å
466	E	30.4	Very low	32.1	Very low	71.5 Å²	71.5	102.7 Å²	102.7	33%	0.334	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	126.2	167.6	-176.9	165.4	-153.3	0	0	109.8	K228 Y464 I468 Y865	K228-E466 VanDerWaalsContact CD-OE1 3.23Å; K228-E466 WeakPolarHBondContact CD-OE1 3.39Å; K228-E466 WeakPolarHBondContact CE-OE1 3.27Å; K228-E466 IonicContact NZ-OE1 3.76Å; K228-E466 PolarHBondContact NZ-OE1 2.92Å; K228-E466 IonicContact NZ-OE2 2.8Å; K228-E466 PolarHBondContact NZ-OE2 3.31Å; Y464-E466 HydrophobicContact CE1-CB 3.87Å; E466-I468 HydrophobicContact CG-CG1 4.15Å; E466-Y865 WeakPolarHBondContact OE1-CD1 3.43Å; E466-Y865 WeakPolarHBondContact OE1-CE1 3.23Å
467	I	33.6	Very low	32.9	Very low	71.5 Å²	71.5	101.9 Å²	101.9	37%	0.367	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	100	177.5	-62.4	172.2	0	0	0	108.1	L229 M231 R469 F478 F480	L229-I467 HydrophobicContact CB-CB 4.38Å; L229-I467 HydrophobicContact CD2-CD1 4.02Å; L229-I467 PolarHBondContact N-O 3.02Å; L229-I467 PolarHBondContact O-N 3.49Å; M231-I467 HydrophobicContact CE-CD1 4.1Å; I467-R469 HydrophobicContact CG2-CG 4.49Å; I467-F478 HydrophobicContact CD1-CE1 4.28Å; I467-F478 HydrophobicContact CG1-CD1 4.5Å; I467-F478 HydrophobicContact CG2-CD1 4.33Å; I467-F478 HydrophobicContact CG2-CE1 4.47Å; I467-F480 HydrophobicContact CG1-CE1 4.39Å
468	I	30.7	Very low	33.8	Very low	96 Å²	96	99 Å²	99	49%	0.492	48%	0.479	S	S	.	.			trans	-81.4	44.6	178.6	-60.6	175	0	0	0	110.1	E466 T481	E466-I468 HydrophobicContact CG-CG1 4.15Å; I468-T481 HydrophobicContact CD1-CG2 3.62Å
469	R	29.8	Very low	34.5	Very low	133 Å²	133	100.1 Å²	100.1	50%	0.502	48%	0.475	S	S	.	.			trans	-120.8	136.4	176	-134.3	178.2	178.3	171.4	-2.2	111.3	I467	I467-R469 HydrophobicContact CG2-CG 4.49Å
470	Y	31	Very low	35.6	Very low	139.5 Å²	139.5	97.8 Å²	97.8	55%	0.547	46%	0.457	S	S	.	.	B	Isolated β-bridge	trans	-124.6	134.1	158.8	-143.5	-95	0	0	0	108.3	F472 L476	Y470-F472 AromaticContact CE1-CD2 3.74Å; Y470-F472 HydrophobicContact CE1-CD2 3.74Å; Y470-F472 AromaticContact CE1-CE2 3.65Å; Y470-F472 HydrophobicContact CE1-CE2 3.65Å; Y470-F472 HydrophobicContact CE1-CZ 4.49Å; Y470-F472 AromaticContact CZ-CE2 3.88Å; Y470-F472 VanDerWaalsContact OH-CE2 3.23Å; Y470-F472 WeakPolarHBondContact OH-CE2 3.34Å; Y470-F472 WeakPolarHBondContact OH-CZ 3.48Å; Y470-L476 HydrophobicContact CE2-CD1 4.11Å; Y470-L476 HydrophobicContact CE2-CD2 4.49Å; Y470-L476 HydrophobicContact CE2-CG 4.26Å
471	S	31.1	Very low	36.4	Very low	68 Å²	68	94 Å²	94	48%	0.476	44%	0.444	S	S	.	.			trans	136.5	132.2	-173.1	63.2	0	0	0	0	113.4
472	F	31	Very low	37.4	Very low	162 Å²	162	91.2 Å²	91.2	71%	0.711	43%	0.433	S	S	*	.			trans	-3.9	118.5	176	-69.2	-74.3	0	0	0	113	Y470	Y470-F472 AromaticContact CE1-CD2 3.74Å; Y470-F472 HydrophobicContact CE1-CD2 3.74Å; Y470-F472 AromaticContact CE1-CE2 3.65Å; Y470-F472 HydrophobicContact CE1-CE2 3.65Å; Y470-F472 HydrophobicContact CE1-CZ 4.49Å; Y470-F472 AromaticContact CZ-CE2 3.88Å; Y470-F472 VanDerWaalsContact OH-CE2 3.23Å; Y470-F472 WeakPolarHBondContact OH-CE2 3.34Å; Y470-F472 WeakPolarHBondContact OH-CZ 3.48Å
473	E	35.8	Very low	38.4	Very low	174.5 Å²	174.5	90 Å²	90	82%	0.815	42%	0.417	S	S	*	.			trans	-124.1	-25.9	162.4	-85.4	-177.8	169.5	0	0	114.3
474	R	37.7	Very low	39.3	Very low	158 Å²	158	89.3 Å²	89.3	60%	0.596	42%	0.415	S	S	*	.			trans	-142	68.6	-178	-89	156.7	-166.3	-121	-5.1	115.1	E608	R474-E608 IonicContact CZ-OE1 2.83Å; R474-E608 IonicContact NH1-OE1 3.78Å; R474-E608 PolarHBondContact NH1-OE1 3.28Å; R474-E608 IonicContact NH2-OE1 3.86Å; R474-E608 PolarHBondContact NH2-OE1 2.9Å
475	S	42.4	Very low	40.4	Very low	50 Å²	50	84.6 Å²	84.6	35%	0.35	40%	0.399	S	S	.	.			trans	-155.7	145.3	170	63.4	0	0	0	0	110.8	G560	S475-G560 PolarHBondContact O-N 2.66Å
476	L	42.6	Very low	41.4	Very low	61.5 Å²	61.5	83.2 Å²	83.2	32%	0.322	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	113.2	177.5	-166.5	170.1	0	0	0	108.4	Y470 F478 L557 L558	Y470-L476 HydrophobicContact CE2-CD1 4.11Å; Y470-L476 HydrophobicContact CE2-CD2 4.49Å; Y470-L476 HydrophobicContact CE2-CG 4.26Å; L476-F478 HydrophobicContact CD1-CE2 4.41Å; L476-F478 HydrophobicContact CD1-CZ 4.39Å; L476-F478 HydrophobicContact CD2-CD1 4.07Å; L476-F478 HydrophobicContact CD2-CD2 3.61Å; L476-F478 HydrophobicContact CD2-CE1 3.86Å; L476-F478 HydrophobicContact CD2-CE2 3.37Å; L476-F478 VanDerWaalsContact CD2-CE2 3.48Å; L476-F478 HydrophobicContact CD2-CG 4.15Å; L476-F478 HydrophobicContact CD2-CZ 3.72Å; L476-L557 HydrophobicContact CD1-CD1 4.49Å; L476-L557 HydrophobicContact CD2-CD1 3.77Å; L476-L557 HydrophobicContact CG-CD1 4.38Å; L476-L558 WeakPolarHBondContact CA-O 3.13Å
477	Q	44.2	Very low	42.4	Very low	72 Å²	72	82 Å²	82	34%	0.336	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	113.3	-177.9	-115.5	179.8	42.5	0	0	111.1	Y479 L557 L558	Q477-Y479 HydrophobicContact CG-CD2 4.12Å; Q477-Y479 HydrophobicContact CG-CE2 3.81Å; Q477-L557 PolarHBondContact NE2-O 2.8Å; Q477-L558 HydrophobicContact CB-CB 4.5Å; Q477-L558 PolarHBondContact N-O 2.98Å; Q477-L558 PolarHBondContact O-N 3.35Å
478	F	46.2	Very low	43.2	Very low	69 Å²	69	84.1 Å²	84.1	30%	0.303	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	138.1	168.7	-70.5	-77.4	0	0	0	110.6	I467 L476 F480 L557	I467-F478 HydrophobicContact CD1-CE1 4.28Å; I467-F478 HydrophobicContact CG1-CD1 4.5Å; I467-F478 HydrophobicContact CG2-CD1 4.33Å; I467-F478 HydrophobicContact CG2-CE1 4.47Å; L476-F478 HydrophobicContact CD1-CE2 4.41Å; L476-F478 HydrophobicContact CD1-CZ 4.39Å; L476-F478 HydrophobicContact CD2-CD1 4.07Å; L476-F478 HydrophobicContact CD2-CD2 3.61Å; L476-F478 HydrophobicContact CD2-CE1 3.86Å; L476-F478 HydrophobicContact CD2-CE2 3.37Å; L476-F478 VanDerWaalsContact CD2-CE2 3.48Å; L476-F478 HydrophobicContact CD2-CG 4.15Å; L476-F478 HydrophobicContact CD2-CZ 3.72Å; F478-F480 HydrophobicContact CB-CD2 4.06Å; F478-F480 HydrophobicContact CB-CE2 3.42Å; F478-F480 VanDerWaalsContact CB-CE2 3.42Å; F478-F480 HydrophobicContact CB-CZ 3.91Å; F478-F480 HydrophobicContact CD1-CE2 4.35Å; F478-F480 AromaticContact CD1-CZ 3.96Å; F478-F480 HydrophobicContact CD1-CZ 3.96Å; F478-F480 HydrophobicContact CD2-CE2 4.46Å; F478-F480 AromaticContact CG-CE2 3.88Å; F478-F480 HydrophobicContact CG-CE2 3.88Å; F478-F480 AromaticContact CG-CZ 3.92Å; F478-F480 HydrophobicContact CG-CZ 3.92Å; F478-L557 HydrophobicContact CD1-CD1 3.73Å; F478-L557 HydrophobicContact CE1-CD1 3.31Å; F478-L557 HydrophobicContact CE2-CD1 4.34Å; F478-L557 HydrophobicContact CG-CD1 4.4Å; F478-L557 HydrophobicContact CZ-CD1 3.66Å
479	Y	45.9	Very low	44.1	Very low	104 Å²	104	82.9 Å²	82.9	41%	0.408	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	133.2	169	-141.6	-89.7	0	0	0	109.1	Q477 T481 D554 L555 R556	Q477-Y479 HydrophobicContact CG-CD2 4.12Å; Q477-Y479 HydrophobicContact CG-CE2 3.81Å; Y479-T481 HydrophobicContact CE1-CG2 4.19Å; Y479-T481 WeakPolarHBondContact OH-CG2 3.35Å; Y479-D554 WeakPolarHBondContact CD1-O 3.38Å; Y479-D554 HydrophobicContact CE1-CB 4.4Å; Y479-D554 WeakPolarHBondContact CE1-O 3.41Å; Y479-L555 WeakPolarHBondContact O-CA 3.25Å; Y479-R556 HydrophobicContact CD1-CB 3.88Å; Y479-R556 PolarHBondContact N-O 3.05Å; Y479-R556 PolarHBondContact O-N 3.11Å
480	F	51.1	Low	44.6	Very low	37.5 Å²	37.5	81.2 Å²	81.2	16%	0.164	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	136.5	166.1	2.6	-97.7	0	0	0	109.8	F465 I467 F478 L552 N553 L555	F465-F480 HydrophobicContact CD1-CD1 4.23Å; F465-F480 HydrophobicContact CD1-CE1 4.25Å; I467-F480 HydrophobicContact CG1-CE1 4.39Å; F478-F480 HydrophobicContact CB-CD2 4.06Å; F478-F480 HydrophobicContact CB-CE2 3.42Å; F478-F480 VanDerWaalsContact CB-CE2 3.42Å; F478-F480 HydrophobicContact CB-CZ 3.91Å; F478-F480 HydrophobicContact CD1-CE2 4.35Å; F478-F480 AromaticContact CD1-CZ 3.96Å; F478-F480 HydrophobicContact CD1-CZ 3.96Å; F478-F480 HydrophobicContact CD2-CE2 4.46Å; F478-F480 AromaticContact CG-CE2 3.88Å; F478-F480 HydrophobicContact CG-CE2 3.88Å; F478-F480 AromaticContact CG-CZ 3.92Å; F478-F480 HydrophobicContact CG-CZ 3.92Å; F480-L552 HydrophobicContact CB-CD2 3.89Å; F480-L552 HydrophobicContact CB-CG 4.28Å; F480-L552 HydrophobicContact CD1-CD1 3.99Å; F480-L552 HydrophobicContact CD1-CG 4.49Å; F480-L552 HydrophobicContact CE1-CD1 4.21Å; F480-L552 HydrophobicContact CG-CD1 4.26Å; F480-L552 HydrophobicContact CG-CD2 4.38Å; F480-L552 HydrophobicContact CG-CG 4.28Å; F480-N553 WeakPolarHBondContact CB-O 3.43Å; F480-L555 HydrophobicContact CB-CB 4.33Å; F480-L555 HydrophobicContact CB-CD1 4.49Å; F480-L555 HydrophobicContact CD2-CB 4.1Å; F480-L555 HydrophobicContact CD2-CD2 3.53Å; F480-L555 HydrophobicContact CD2-CG 4.42Å; F480-L555 HydrophobicContact CE2-CD2 3.7Å; F480-L555 PolarHBondContact O-N 2.83Å
481	T	46.9	Very low	45.1	Very low	64 Å²	64	77.8 Å²	77.8	39%	0.393	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	-29.2	-175.8	46	0	0	0	0	113.3	I468 Y479 N553 D554	I468-T481 HydrophobicContact CD1-CG2 3.62Å; Y479-T481 HydrophobicContact CE1-CG2 4.19Å; Y479-T481 WeakPolarHBondContact OH-CG2 3.35Å; T481-N553 CarbonylContact C-O 3.59Å; T481-N553 PolarHBondContact N-O 2.96Å; T481-N553 VanDerWaalsContact N-O 3.09Å; T481-N553 VanDerWaalsContact O-O 3.09Å; T481-N553 VanDerWaalsContact OG1-CB 3.3Å; T481-N553 WeakPolarHBondContact OG1-CB 3.22Å; T481-N553 PolarHBondContact OG1-O 3.03Å; T481-D554 HydrophobicContact CG2-CB 3.71Å; T481-D554 VanDerWaalsContact CG2-OD2 3.28Å; T481-D554 WeakPolarHBondContact CG2-OD2 3.29Å; T481-D554 PolarHBondContact OG1-OD2 2.79Å
482	S	51	Low	45.4	Very low	35.5 Å²	35.5	78 Å²	78	25%	0.248	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.6	152.5	171.1	58.5	0	0	0	0	111	L552 N553	S482-L552 CarbonylContact C-O 3.58Å; S482-L552 WeakPolarHBondContact CA-O 3.35Å; S482-N553 PolarHBondContact O-N 3.48Å
483	S	50.7	Low	45.4	Very low	19.5 Å²	19.5	77.1 Å²	77.1	14%	0.136	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	131.3	157	64.9	0	0	0	0	110.8	C551 L552	S483-C551 CarbonylContact C-O 3.5Å; S483-C551 WeakPolarHBondContact CA-O 3.12Å; S483-L552 PolarHBondContact N-O 3.04Å; S483-L552 PolarHBondContact O-N 3.27Å
484	H	52.1	Low	45.2	Very low	68.5 Å²	68.5	73.5 Å²	73.5	32%	0.317	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	135.9	177.7	-118.8	-72.6	0	0	0	109.5	F425 F550 C551	F425-H484 AromaticContact CE1-NE2 3.88Å; F425-H484 AromaticContact CZ-NE2 3.57Å; H484-F550 CarbonylContact O-C 3.6Å; H484-F550 VanDerWaalsContact O-CA 3.3Å; H484-F550 WeakPolarHBondContact O-CA 3.36Å; H484-C551 HydrophobicContact CB-CB 4.11Å; H484-C551 VanDerWaalsContact CE1-SG 3.52Å; H484-C551 PolarHBondContact N-O 3.38Å; H484-C551 PolarHBondContact O-N 2.91Å
485	L	53.4	Low	44.8	Very low	35 Å²	35	73.6 Å²	73.6	18%	0.183	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	111.2	169.5	176.2	64.6	0	0	0	108.6	M461 M487 F548 R549 F550	M461-L485 HydrophobicContact CE-CD1 3.63Å; M461-L485 HydrophobicContact CE-CD2 3.84Å; M461-L485 HydrophobicContact CE-CG 4.4Å; M461-L485 HydrophobicContact CG-CD1 3.89Å; L485-M487 HydrophobicContact CD1-CE 4.14Å; L485-M487 HydrophobicContact CD2-CE 4.3Å; L485-M487 HydrophobicContact CG-CE 4.43Å; L485-F548 HydrophobicContact CD1-CD2 3.94Å; L485-F548 HydrophobicContact CD1-CE1 4.49Å; L485-F548 HydrophobicContact CD1-CE2 3.37Å; L485-F548 HydrophobicContact CD1-CZ 3.68Å; L485-R549 CarbonylContact C-O 3.5Å; L485-R549 WeakPolarHBondContact CA-O 3.36Å; L485-F550 HydrophobicContact CB-CB 4.44Å; L485-F550 HydrophobicContact CB-CD2 4.3Å; L485-F550 HydrophobicContact CD1-CB 4.36Å; L485-F550 PolarHBondContact N-O 3.11Å
486	S	51.3	Low	44	Very low	57 Å²	57	80.8 Å²	80.8	40%	0.399	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	130.8	176.2	51.2	0	0	0	0	110.3	F548 R549	S486-F548 WeakPolarHBondContact O-CA 3.38Å; S486-R549 PolarHBondContact N-O 2.95Å; S486-R549 PolarHBondContact O-N 2.84Å; S486-R549 PolarHBondContact OG-O 2.76Å
487	M	52.4	Low	43.1	Very low	47 Å²	47	84 Å²	84	23%	0.232	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	119.8	179.8	-114.4	130.5	173.8	0	0	109.6	P459 L485 F489 L545 N547 F548	P459-M487 HydrophobicContact CB-CE 3.64Å; L485-M487 HydrophobicContact CD1-CE 4.14Å; L485-M487 HydrophobicContact CD2-CE 4.3Å; L485-M487 HydrophobicContact CG-CE 4.43Å; M487-F489 HydrophobicContact CB-CE2 3.92Å; M487-F489 HydrophobicContact CB-CZ 3.94Å; M487-F489 HydrophobicContact CE-CE1 4.04Å; M487-F489 HydrophobicContact CE-CE2 4.07Å; M487-F489 HydrophobicContact CE-CZ 3.47Å; M487-F489 VanDerWaalsContact CE-CZ 3.47Å; M487-F489 HydrophobicContact CG-CD2 4.09Å; M487-F489 HydrophobicContact CG-CE2 3.54Å; M487-F489 HydrophobicContact CG-CZ 3.96Å; M487-F489 HydrophobicContact SD-CZ 3.99Å; M487-L545 HydrophobicContact CB-CD1 4.26Å; M487-N547 WeakPolarHBondContact CA-O 3.27Å; M487-F548 HydrophobicContact CE-CD2 3.86Å; M487-F548 HydrophobicContact CE-CE2 3.84Å; M487-F548 HydrophobicContact CG-CD2 4.1Å
488	E	50.5	Low	42.2	Very low	114.5 Å²	114.5	85.4 Å²	85.4	54%	0.535	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	126.6	173.7	-67.2	-172.5	154.8	0	0	110.7	L546 N547	E488-L546 HydrophobicContact CB-CB 4.45Å; E488-L546 PolarHBondContact O-N 2.8Å; E488-N547 HydrophobicContact CB-CB 4.37Å; E488-N547 PolarHBondContact N-O 2.85Å; E488-N547 PolarHBondContact OE2-ND2 2.89Å
489	F	48.2	Very low	41.4	Very low	70.5 Å²	70.5	89.1 Å²	89.1	31%	0.309	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	116.6	178.4	-66.6	-78	0	0	0	111.4	M487 V491 F543 I544 L545	M487-F489 HydrophobicContact CB-CE2 3.92Å; M487-F489 HydrophobicContact CB-CZ 3.94Å; M487-F489 HydrophobicContact CE-CE1 4.04Å; M487-F489 HydrophobicContact CE-CE2 4.07Å; M487-F489 HydrophobicContact CE-CZ 3.47Å; M487-F489 VanDerWaalsContact CE-CZ 3.47Å; M487-F489 HydrophobicContact CG-CD2 4.09Å; M487-F489 HydrophobicContact CG-CE2 3.54Å; M487-F489 HydrophobicContact CG-CZ 3.96Å; M487-F489 HydrophobicContact SD-CZ 3.99Å; F489-V491 PolarHBondContact O-N 3.04Å; F489-F543 HydrophobicContact CB-CD1 4.26Å; F489-I544 WeakPolarHBondContact CA-O 3.36Å; F489-L545 HydrophobicContact CD1-CD1 4.27Å; F489-L545 HydrophobicContact CE1-CD1 3.91Å; F489-L545 HydrophobicContact CZ-CD1 4.43Å
490	N	41.5	Very low	40.6	Very low	98.5 Å²	98.5	90.9 Å²	90.9	53%	0.527	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	129.8	169.5	-112.6	-26.9	0	0	0	110.5	P492 I544 L546	N490-P492 WeakPolarHBondContact O-CD 3.14Å; N490-I544 PolarHBondContact N-O 3.4Å; N490-I544 PolarHBondContact O-N 2.99Å; N490-L546 HydrophobicContact CB-CD1 3.75Å; N490-L546 HydrophobicContact CB-CD2 4.49Å; N490-L546 HydrophobicContact CB-CG 3.92Å
491	V	40.5	Very low	39.5	Very low	66.5 Å²	66.5	95.6 Å²	95.6	40%	0.403	53%	0.527	S	S	.	.			trans	-100.9	118.5	176.6	-179.7	0	0	0	0	108.6	F489 N493 F543	F489-V491 PolarHBondContact O-N 3.04Å; V491-N493 PolarHBondContact O-N 2.77Å; V491-F543 HydrophobicContact CG2-CD1 4.46Å; V491-F543 HydrophobicContact CG2-CE1 4.21Å
492	P	38.6	Very low	38.6	Very low	72.5 Å²	72.5	100.8 Å²	100.8	47%	0.471	55%	0.546	S	S	.	.			trans	-75.7	122.5	178.2	29.6	-32.9	0	0	0	111.2	N490 S494	N490-P492 WeakPolarHBondContact O-CD 3.14Å; P492-S494 PolarHBondContact O-N 3.27Å; P492-S494 PolarHBondContact O-OG 2.99Å
493	N	30.9	Very low	37.4	Very low	143.5 Å²	143.5	105 Å²	105	77%	0.767	57%	0.57	S	S	*	*			trans	-70.6	102.8	172.2	-73.8	-10.9	0	0	0	110.1	V491 I495	V491-N493 PolarHBondContact O-N 2.77Å; N493-I495 PolarHBondContact O-N 2.87Å
494	S	31.1	Very low	36.2	Very low	98.5 Å²	98.5	111.4 Å²	111.4	69%	0.689	60%	0.603	S	S	*	*			trans	-103.7	93.2	-177.6	48.3	0	0	0	0	112.8	P492	P492-S494 PolarHBondContact O-N 3.27Å; P492-S494 PolarHBondContact O-OG 2.99Å
495	I	29.3	Very low	34.9	Very low	161 Å²	161	115.9 Å²	115.9	83%	0.826	62%	0.624	S	S	*	*			trans	-21.9	107.4	153.2	-56.6	173.2	0	0	0	113	N493	N493-I495 PolarHBondContact O-N 2.87Å
496	K	25	Very low	33.5	Very low	201 Å²	201	119.9 Å²	119.9	87%	0.874	65%	0.65	S	S	*	*			trans	-126.4	117.8	157	-87	177.8	179.7	-174.5	0	110.8
497	C	24.9	Very low	32.3	Very low	129.5 Å²	129.5	123.7 Å²	123.7	88%	0.875	67%	0.671	S	S	*	*			trans	-119.3	167.4	145.1	-86.2	0	0	0	0	108.3
498	S	25.3	Very low	30.9	Very low	100.5 Å²	100.5	126 Å²	126	70%	0.703	69%	0.692	S	S	*	*				-131.4	164	109.7	49.1	0	0	0	0	113.9
499	E	29	Very low	29.6	Very low	147.5 Å²	147.5	126.9 Å²	126.9	69%	0.689	70%	0.7	S	S	*	*			trans	-20.8	125.5	157.5	-66.5	155.1	161.2	0	0	115.6
500	N	28.1	Very low	28.6	Very low	141 Å²	141	131.7 Å²	131.7	75%	0.754	72%	0.721	S	S	*	*			trans	121.9	116.7	132.1	-93.5	44.9	0	0	0	117.1
501	D	28.2	Very low	27.9	Very low	136 Å²	136	137 Å²	137	73%	0.727	74%	0.735	S	S	*	*			trans	59.1	118.3	140.6	-48.8	-23.3	0	0	0	121.3
502	E	28.2	Very low	27.2	Very low	172.5 Å²	172.5	139.8 Å²	139.8	81%	0.806	75%	0.752	S	S	*	*				122.9	135.5	78.9	-54.7	-172.3	138.6	0	0	117.8
503	T	26.6	Very low	26.5	Very low	123.5 Å²	123.5	141.2 Å²	141.2	76%	0.758	76%	0.764	S	S	*	*				113.2	153.4	109.9	49.7	0	0	0	0	119.6
504	L	25.6	Very low	26.2	Very low	155 Å²	155	141.5 Å²	141.5	81%	0.812	77%	0.765	S	S	*	*			trans	60.1	107.6	152.2	-80.3	159.1	0	0	0	123.4
505	Q	24.6	Very low	25.8	Very low	163 Å²	163	144.4 Å²	144.4	76%	0.762	77%	0.767	S	S	*	*			trans	58.5	109	136.7	-71	-174.6	-13.4	0	0	122.4
506	T	23.9	Very low	25.5	Very low	119 Å²	119	141.4 Å²	141.4	73%	0.73	76%	0.761	S	S	*	*			trans	62.9	130.4	131.7	55.1	0	0	0	0	122.6
507	T	25.9	Very low	25.6	Very low	137.5 Å²	137.5	139.8 Å²	139.8	84%	0.844	76%	0.761	S	S	*	*				136.1	142.9	128.7	29	0	0	0	0	115.5
508	S	23.2	Very low	25.6	Very low	95 Å²	95	139.2 Å²	139.2	66%	0.664	76%	0.758	S	S	*	*			trans	153.6	150	167.8	59.1	0	0	0	0	119.8
509	D	23.9	Very low	25.5	Very low	133 Å²	133	141.5 Å²	141.5	71%	0.711	76%	0.762	S	S	*	*			trans	76.5	113.7	149.7	-54.9	-28	0	0	0	120.8
510	F	26	Very low	25.4	Very low	171 Å²	171	140.3 Å²	140.3	75%	0.75	77%	0.767	S	S	*	*				122.7	117.2	117.6	-90.4	-73.9	0	0	0	118
511	Y	26.9	Very low	25.1	Very low	209 Å²	209	139.3 Å²	139.3	82%	0.82	76%	0.76	S	S	*	*			trans	56.4	149.2	149.5	-72.4	-76.5	0	0	0	120.8
512	T	25	Very low	25	Very low	125.5 Å²	125.5	138 Å²	138	77%	0.77	76%	0.761	S	S	*	*				-120.9	141.9	95.8	12	0	0	0	0	113.1
513	S	25	Very low	24.8	Very low	103 Å²	103	138.2 Å²	138.2	72%	0.72	76%	0.763	S	S	*	*			trans	132.7	138.1	143.2	65.1	0	0	0	0	117
514	L	23.8	Very low	24.7	Very low	149.5 Å²	149.5	140 Å²	140	78%	0.783	77%	0.766	S	S	*	*				-46.9	175.8	75.5	-69.9	87.2	0	0	0	115.6
515	H	23.4	Very low	24.6	Very low	159 Å²	159	140.2 Å²	140.2	74%	0.736	77%	0.766	S	S	*	*				143.5	137.8	62.7	-118	-101.3	0	0	0	117.4
516	S	23.8	Very low	24.7	Very low	99 Å²	99	137.8 Å²	137.8	69%	0.692	76%	0.764	S	S	*	*			trans	67.7	111.5	147.2	65.4	0	0	0	0	119.6
517	L	25.2	Very low	24.7	Very low	166.5 Å²	166.5	136.6 Å²	136.6	87%	0.872	76%	0.761	S	S	*	*			trans	131.6	123.3	144.9	-86.6	164	0	0	0	114.1
518	S	25.1	Very low	24.7	Very low	118 Å²	118	136.9 Å²	136.9	83%	0.825	76%	0.757	S	S	*	*			trans	-113.5	108.2	170.1	51.9	0	0	0	0	112
519	L	23.5	Very low	24.8	Very low	149 Å²	149	139.6 Å²	139.6	78%	0.78	76%	0.764	S	S	*	*			trans	-86.4	144.1	159.5	-80.9	161.7	0	0	0	109.1	I521	L519-I521 HydrophobicContact CB-CD1 3.96Å; L519-I521 HydrophobicContact CB-CG1 4Å; L519-I521 HydrophobicContact CD1-CD1 4.02Å; L519-I521 HydrophobicContact CD1-CG1 4.22Å; L519-I521 HydrophobicContact CD2-CG1 4.46Å; L519-I521 HydrophobicContact CG-CG1 4.47Å
520	P	27.1	Very low	24.9	Very low	120.5 Å²	120.5	140.4 Å²	140.4	78%	0.782	77%	0.767	S	S	*	*				-121.5	143.9	125.4	36	-28.4	0	0	0	112.1
521	I	23	Very low	24.9	Very low	121.5 Å²	121.5	138.6 Å²	138.6	62%	0.623	77%	0.766	S	S	*	*				152.6	110.1	107.7	-66.2	171.5	0	0	0	111.7	L519	L519-I521 HydrophobicContact CB-CD1 3.96Å; L519-I521 HydrophobicContact CB-CG1 4Å; L519-I521 HydrophobicContact CD1-CD1 4.02Å; L519-I521 HydrophobicContact CD1-CG1 4.22Å; L519-I521 HydrophobicContact CD2-CG1 4.46Å; L519-I521 HydrophobicContact CG-CG1 4.47Å
522	S	25	Very low	24.8	Very low	107 Å²	107	134 Å²	134	75%	0.748	76%	0.755	S	S	*	*			trans	118	131.4	147.7	57.8	0	0	0	0	112.6
523	Q	23.5	Very low	24.9	Very low	178 Å²	178	135.6 Å²	135.6	83%	0.832	76%	0.759	S	S	*	*			cis	123.2	135.4	23.5	-87.9	-174.7	-1.2	0	0	110.9
524	I	25.6	Very low	25	Very low	161 Å²	161	137.1 Å²	137.1	83%	0.826	76%	0.764	S	S	*	*				167.6	123.5	129.5	-82.7	156.1	0	0	0	109.5
525	I	23.8	Very low	25.1	Very low	159 Å²	159	136.4 Å²	136.4	82%	0.815	76%	0.76	S	S	*	*			trans	-138.6	134.1	164	-59	173.8	0	0	0	106.7
526	P	26.7	Very low	25.2	Very low	112 Å²	112	134.1 Å²	134.1	73%	0.727	76%	0.762	S	S	*	*			trans	-119.6	141.4	145.5	34.9	-26	0	0	0	112.1
527	S	24	Very low	25.3	Very low	95.5 Å²	95.5	138.3 Å²	138.3	67%	0.668	77%	0.768	S	S	*	*			trans	-32.4	150.7	160.3	53.5	0	0	0	0	116.8
528	N	24.4	Very low	25.5	Very low	142.5 Å²	142.5	136.4 Å²	136.4	76%	0.762	76%	0.758	S	S	*	*				-179.9	131.1	61.9	-82.8	-14.6	0	0	0	109.9
529	L	26.2	Very low	25.7	Very low	152.5 Å²	152.5	138.1 Å²	138.1	80%	0.798	76%	0.757	S	S	*	*				136	127.6	79.2	-143.1	122.4	0	0	0	111.7
530	L	26.6	Very low	25.9	Very low	150 Å²	150	139.4 Å²	139.4	79%	0.785	76%	0.756	S	S	*	*			trans	-147.6	139.8	169.9	-77.2	136.4	0	0	0	109.9
531	N	26.1	Very low	25.9	Very low	133.5 Å²	133.5	137.7 Å²	137.7	71%	0.714	75%	0.747	S	S	*	*			cis	-159	165.4	43.8	-130.5	12	0	0	0	111.2
532	D	24.6	Very low	26.4	Very low	111 Å²	111	138.6 Å²	138.6	59%	0.594	75%	0.748	S	S	*	*			trans	-18.7	128.1	174.6	-66.9	-47.2	0	0	0	117.9
533	N	25.9	Very low	26.9	Very low	160.5 Å²	160.5	139.1 Å²	139.1	86%	0.858	74%	0.737	S	S	*	*			trans	147.4	132.1	140	-78.3	-70.8	0	0	0	114.7
534	V	27.5	Very low	27.9	Very low	134 Å²	134	134.6 Å²	134.6	81%	0.812	72%	0.718	S	S	*	*			trans	-123.5	141.3	155.5	162.3	0	0	0	0	113
535	D	25.3	Very low	28.7	Very low	133.5 Å²	133.5	129.6 Å²	129.6	71%	0.714	69%	0.693	S	S	*	*			trans	-17.8	132.2	173.2	-66.1	-42.5	0	0	0	119.9	K537	D535-K537 PolarHBondContact O-N 3.29Å
536	S	26.5	Very low	29.8	Very low	112 Å²	112	125.2 Å²	125.2	78%	0.783	67%	0.671	S	S	*	*			trans	-105.9	49.9	167.5	52.3	0	0	0	0	113.3
537	K	26.6	Very low	30.9	Very low	186 Å²	186	122.4 Å²	122.4	81%	0.809	65%	0.649	S	S	*	*	S	Bend	trans	-127.3	10.9	-174.7	-100.5	173.7	-174.2	166.1	0	117.6	D535	D535-K537 PolarHBondContact O-N 3.29Å
538	I	28.9	Very low	32.3	Very low	127 Å²	127	120.8 Å²	120.8	65%	0.651	63%	0.631	S	S	*	*	S	Bend	trans	-108.2	45.9	172.7	-66.6	133.5	0	0	0	110.9	F540 S541	I538-F540 VanDerWaalsContact C-N 3.31Å; I538-F540 PolarHBondContact O-N 2.86Å; I538-S541 PolarHBondContact O-OG 2.81Å
539	L	28.3	Very low	33.7	Very low	154.5 Å²	154.5	120.2 Å²	120.2	81%	0.809	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.7	15.6	176.7	-136.6	124.2	0	0	0	112.9
540	F	28.3	Very low	35.1	Very low	176.5 Å²	176.5	115.8 Å²	115.8	77%	0.774	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.5	44	-179.2	-89.4	-73.5	0	0	0	111.6	I538 F543	I538-F540 VanDerWaalsContact C-N 3.31Å; I538-F540 PolarHBondContact O-N 2.86Å; F540-F543 HydrophobicContact CD1-CE2 4.15Å; F540-F543 HydrophobicContact CE1-CE2 4.47Å
541	S	27.5	Very low	36.4	Very low	83.5 Å²	83.5	109.7 Å²	109.7	58%	0.584	56%	0.562	S	S	*	*	S	Bend	trans	-117.7	70.1	-177.3	55.7	0	0	0	0	112.6	I538	I538-S541 PolarHBondContact O-OG 2.81Å
542	H	33.9	Very low	37.7	Very low	140.5 Å²	140.5	104.5 Å²	104.5	65%	0.65	53%	0.534	S	S	*	.			trans	150.4	52.6	-167.4	-62	79.1	0	0	0	114.3
543	F	35	Very low	39	Very low	118 Å²	118	102 Å²	102	52%	0.518	52%	0.521	S	S	.	.			trans	-93	118.5	150.8	-76.9	-76.7	0	0	0	108.3	F489 V491 F540 E581	F489-F543 HydrophobicContact CB-CD1 4.26Å; V491-F543 HydrophobicContact CG2-CD1 4.46Å; V491-F543 HydrophobicContact CG2-CE1 4.21Å; F540-F543 HydrophobicContact CD1-CE2 4.15Å; F540-F543 HydrophobicContact CE1-CE2 4.47Å; F543-E581 VanDerWaalsContact CA-OE1 3.26Å; F543-E581 WeakPolarHBondContact CA-OE1 3.45Å; F543-E581 WeakPolarHBondContact CD1-OE2 3.27Å
544	I	43.4	Very low	40.2	Very low	83 Å²	83	96.5 Å²	96.5	43%	0.426	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	103.8	175	-58.8	179.2	0	0	0	107.1	F489 N490 L546 E581	F489-I544 WeakPolarHBondContact CA-O 3.36Å; N490-I544 PolarHBondContact N-O 3.4Å; N490-I544 PolarHBondContact O-N 2.99Å; I544-L546 HydrophobicContact CG2-CG 4.29Å; I544-L546 PolarHBondContact O-N 3.11Å; I544-E581 PolarHBondContact N-OE1 3.17Å
545	L	43.4	Very low	41.4	Very low	57.5 Å²	57.5	92 Å²	92	30%	0.301	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	102.4	176	-169.3	77.2	0	0	0	110	M487 F489 N547 F548 L583	M487-L545 HydrophobicContact CB-CD1 4.26Å; F489-L545 HydrophobicContact CD1-CD1 4.27Å; F489-L545 HydrophobicContact CE1-CD1 3.91Å; F489-L545 HydrophobicContact CZ-CD1 4.43Å; L545-N547 VanDerWaalsContact C-N 3.26Å; L545-N547 PolarHBondContact O-N 3.5Å; L545-F548 HydrophobicContact CD1-CB 4.4Å; L545-F548 HydrophobicContact CD2-CB 4.06Å; L545-F548 HydrophobicContact CD2-CD2 4.24Å; L545-L583 HydrophobicContact CB-CD1 4Å; L545-L583 HydrophobicContact CD2-CD1 4.2Å; L545-L583 HydrophobicContact CG-CD1 4.2Å; L545-L583 WeakPolarHBondContact O-CD1 3.45Å
546	L	47.1	Very low	42.6	Very low	66.5 Å²	66.5	90 Å²	90	35%	0.348	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	-42.3	-178.6	-85.9	159.9	0	0	0	112.8	E488 N490 I544 L583	E488-L546 HydrophobicContact CB-CB 4.45Å; E488-L546 PolarHBondContact O-N 2.8Å; N490-L546 HydrophobicContact CB-CD1 3.75Å; N490-L546 HydrophobicContact CB-CD2 4.49Å; N490-L546 HydrophobicContact CB-CG 3.92Å; I544-L546 HydrophobicContact CG2-CG 4.29Å; I544-L546 PolarHBondContact O-N 3.11Å; L546-L583 PolarHBondContact O-N 2.94Å; L546-L583 VanDerWaalsContact O-N 3.08Å
547	N	49.9	Very low	43.8	Very low	52.5 Å²	52.5	86.3 Å²	86.3	28%	0.281	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	124.9	-178.1	-77.6	-69.1	0	0	0	110.5	M487 E488 L545 T580 E581	M487-N547 WeakPolarHBondContact CA-O 3.27Å; E488-N547 HydrophobicContact CB-CB 4.37Å; E488-N547 PolarHBondContact N-O 2.85Å; E488-N547 PolarHBondContact OE2-ND2 2.89Å; L545-N547 VanDerWaalsContact C-N 3.26Å; L545-N547 PolarHBondContact O-N 3.5Å; N547-T580 VanDerWaalsContact CB-OG1 3.23Å; N547-T580 WeakPolarHBondContact CB-OG1 3.5Å; N547-T580 PolarHBondContact N-O 3.25Å; N547-T580 PolarHBondContact O-N 3.14Å; N547-T580 VanDerWaalsContact O-N 3.08Å; N547-E581 WeakPolarHBondContact CA-O 3.5Å
548	F	53.4	Low	45	Very low	62 Å²	62	80.4 Å²	80.4	27%	0.272	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	132.8	167.4	173.2	-85.8	0	0	0	109.3	L485 S486 M487 L545 F550 I577 A579 T580 E581	L485-F548 HydrophobicContact CD1-CD2 3.94Å; L485-F548 HydrophobicContact CD1-CE1 4.49Å; L485-F548 HydrophobicContact CD1-CE2 3.37Å; L485-F548 HydrophobicContact CD1-CZ 3.68Å; S486-F548 WeakPolarHBondContact O-CA 3.38Å; M487-F548 HydrophobicContact CE-CD2 3.86Å; M487-F548 HydrophobicContact CE-CE2 3.84Å; M487-F548 HydrophobicContact CG-CD2 4.1Å; L545-F548 HydrophobicContact CD1-CB 4.4Å; L545-F548 HydrophobicContact CD2-CB 4.06Å; L545-F548 HydrophobicContact CD2-CD2 4.24Å; F548-F550 HydrophobicContact CE1-CB 3.94Å; F548-F550 HydrophobicContact CZ-CB 3.97Å; F548-I577 HydrophobicContact CE2-CG2 4.08Å; F548-I577 HydrophobicContact CZ-CG2 4.16Å; F548-A579 HydrophobicContact CD2-CB 4.33Å; F548-T580 CarbonylContact O-C 3.54Å; F548-T580 WeakPolarHBondContact O-CA 3.38Å; F548-E581 HydrophobicContact CB-CB 4.22Å; F548-E581 HydrophobicContact CD1-CB 4.42Å; F548-E581 PolarHBondContact N-O 2.85Å; F548-E581 PolarHBondContact O-N 2.81Å
549	R	54.3	Low	45.9	Very low	129 Å²	129	77.2 Å²	77.2	49%	0.487	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	121.2	178.4	-128.8	175.5	-178.4	-172.7	2.7	111	L485 S486 E578 A579 T580	L485-R549 CarbonylContact C-O 3.5Å; L485-R549 WeakPolarHBondContact CA-O 3.36Å; S486-R549 PolarHBondContact N-O 2.95Å; S486-R549 PolarHBondContact O-N 2.84Å; S486-R549 PolarHBondContact OG-O 2.76Å; R549-E578 HydrophobicContact CB-CB 4.28Å; R549-E578 VanDerWaalsContact CD-OE2 3.31Å; R549-E578 WeakPolarHBondContact CD-OE2 3.47Å; R549-E578 IonicContact CZ-OE1 2.76Å; R549-E578 PolarHBondContact N-O 3.4Å; R549-E578 IonicContact NE-OE1 3.27Å; R549-E578 PolarHBondContact NE-OE1 3.32Å; R549-E578 IonicContact NH1-OE2 2.79Å; R549-E578 PolarHBondContact NH1-OE2 3.09Å; R549-E578 IonicContact NH2-OE1 2.89Å; R549-E578 PolarHBondContact NH2-OE1 2.72Å; R549-E578 PolarHBondContact O-N 3.28Å; R549-E578 VanDerWaalsContact O-N 3.12Å; R549-A579 CarbonylContact C-O 3.56Å; R549-A579 WeakPolarHBondContact CA-O 3.33Å; R549-T580 HydrophobicContact CB-CG2 3.89Å; R549-T580 HydrophobicContact CG-CG2 3.66Å
550	F	55.4	Low	46.9	Very low	60.5 Å²	60.5	70.9 Å²	70.9	27%	0.265	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	126.3	172.9	178.9	-95.8	0	0	0	109.5	H484 L485 F548 L552 I577 E578 A579	H484-F550 CarbonylContact O-C 3.6Å; H484-F550 VanDerWaalsContact O-CA 3.3Å; H484-F550 WeakPolarHBondContact O-CA 3.36Å; L485-F550 HydrophobicContact CB-CB 4.44Å; L485-F550 HydrophobicContact CB-CD2 4.3Å; L485-F550 HydrophobicContact CD1-CB 4.36Å; L485-F550 PolarHBondContact N-O 3.11Å; F548-F550 HydrophobicContact CE1-CB 3.94Å; F548-F550 HydrophobicContact CZ-CB 3.97Å; F550-L552 HydrophobicContact CE1-CB 3.94Å; F550-L552 HydrophobicContact CE1-CD1 4.38Å; F550-L552 HydrophobicContact CZ-CB 3.97Å; F550-L552 HydrophobicContact CZ-CD1 4.16Å; F550-I577 HydrophobicContact CD2-CG1 4.26Å; F550-I577 HydrophobicContact CE2-CG1 4.45Å; F550-E578 CarbonylContact O-C 3.57Å; F550-E578 WeakPolarHBondContact O-CA 3.31Å; F550-A579 PolarHBondContact N-O 2.84Å; F550-A579 PolarHBondContact O-N 2.78Å
551	C	53.6	Low	47.6	Very low	21.5 Å²	21.5	68.7 Å²	68.7	15%	0.145	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	126.2	178.9	-105	0	0	0	0	109.6	S483 H484 N553 L576 I577	S483-C551 CarbonylContact C-O 3.5Å; S483-C551 WeakPolarHBondContact CA-O 3.12Å; H484-C551 HydrophobicContact CB-CB 4.11Å; H484-C551 VanDerWaalsContact CE1-SG 3.52Å; H484-C551 PolarHBondContact N-O 3.38Å; H484-C551 PolarHBondContact O-N 2.91Å; C551-N553 PolarHBondContact SG-OD1 2.82Å; C551-L576 HydrophobicContact CB-CD1 4.41Å; C551-I577 CarbonylContact C-O 3.58Å; C551-I577 WeakPolarHBondContact CA-O 3.28Å
552	L	52.7	Low	48.5	Very low	24 Å²	24	68 Å²	68	13%	0.126	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	119.2	175.7	-171.6	153.8	0	0	0	109.1	F480 S482 S483 F550 L555 I574 L576 I577	F480-L552 HydrophobicContact CB-CD2 3.89Å; F480-L552 HydrophobicContact CB-CG 4.28Å; F480-L552 HydrophobicContact CD1-CD1 3.99Å; F480-L552 HydrophobicContact CD1-CG 4.49Å; F480-L552 HydrophobicContact CE1-CD1 4.21Å; F480-L552 HydrophobicContact CG-CD1 4.26Å; F480-L552 HydrophobicContact CG-CD2 4.38Å; F480-L552 HydrophobicContact CG-CG 4.28Å; S482-L552 CarbonylContact C-O 3.58Å; S482-L552 WeakPolarHBondContact CA-O 3.35Å; S483-L552 PolarHBondContact N-O 3.04Å; S483-L552 PolarHBondContact O-N 3.27Å; F550-L552 HydrophobicContact CE1-CB 3.94Å; F550-L552 HydrophobicContact CE1-CD1 4.38Å; F550-L552 HydrophobicContact CZ-CB 3.97Å; F550-L552 HydrophobicContact CZ-CD1 4.16Å; L552-L555 HydrophobicContact CD2-CB 3.9Å; L552-L555 HydrophobicContact CD2-CD1 4.21Å; L552-L555 HydrophobicContact CD2-CG 4.35Å; L552-I574 HydrophobicContact CD1-CG1 4.32Å; L552-L576 WeakPolarHBondContact O-CA 3.35Å; L552-I577 PolarHBondContact N-O 3.08Å; L552-I577 PolarHBondContact O-N 2.97Å
553	N	52.2	Low	48.9	Very low	60.5 Å²	60.5	65.8 Å²	65.8	32%	0.324	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	58.5	-167	-64.2	5.9	0	0	0	112.9	F480 T481 S482 C551 L555 Y575 L576	F480-N553 WeakPolarHBondContact CB-O 3.43Å; T481-N553 CarbonylContact C-O 3.59Å; T481-N553 PolarHBondContact N-O 2.96Å; T481-N553 VanDerWaalsContact N-O 3.09Å; T481-N553 VanDerWaalsContact O-O 3.09Å; T481-N553 VanDerWaalsContact OG1-CB 3.3Å; T481-N553 WeakPolarHBondContact OG1-CB 3.22Å; T481-N553 PolarHBondContact OG1-O 3.03Å; S482-N553 PolarHBondContact O-N 3.48Å; C551-N553 PolarHBondContact SG-OD1 2.82Å; N553-L555 PolarHBondContact O-N 3.24Å; N553-Y575 WeakPolarHBondContact CA-O 3.4Å; N553-Y575 HydrophobicContact CB-CD2 4.3Å; N553-L576 VanDerWaalsContact OD1-CD1 3.27Å; N553-L576 WeakPolarHBondContact OD1-CD1 3.47Å
554	D	50.9	Low	49.4	Very low	45 Å²	45	68.8 Å²	68.8	24%	0.241	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	127.3	85.8	-177.3	-94.2	-47.4	0	0	0	112.3	Y479 T481 R556 R573 I574 Y575	Y479-D554 WeakPolarHBondContact CD1-O 3.38Å; Y479-D554 HydrophobicContact CE1-CB 4.4Å; Y479-D554 WeakPolarHBondContact CE1-O 3.41Å; T481-D554 HydrophobicContact CG2-CB 3.71Å; T481-D554 VanDerWaalsContact CG2-OD2 3.28Å; T481-D554 WeakPolarHBondContact CG2-OD2 3.29Å; T481-D554 PolarHBondContact OG1-OD2 2.79Å; D554-R556 PolarHBondContact O-N 3.03Å; D554-R556 VanDerWaalsContact OD1-CG 3.24Å; D554-R556 WeakPolarHBondContact OD1-CG 2.95Å; D554-R556 IonicContact OD1-CZ 3.37Å; D554-R556 IonicContact OD1-NE 3.85Å; D554-R556 PolarHBondContact OD1-NE 2.78Å; D554-R556 IonicContact OD1-NH2 3.63Å; D554-R556 IonicContact OD2-CZ 3.59Å; D554-R556 VanDerWaalsContact OD2-CZ 3.27Å; D554-R556 IonicContact OD2-NE 3.47Å; D554-R556 PolarHBondContact OD2-NE 3.16Å; D554-R556 VanDerWaalsContact OD2-NE 3.12Å; D554-R556 IonicContact OD2-NH2 3.93Å; D554-R556 PolarHBondContact OD2-NH2 3.25Å; D554-R573 HydrophobicContact CB-CB 3.95Å; D554-R573 HydrophobicContact CB-CG 3.99Å; D554-R573 PolarHBondContact O-N 3.15Å; D554-I574 CarbonylContact C-O 3.56Å; D554-I574 WeakPolarHBondContact CA-O 3.29Å; D554-Y575 PolarHBondContact N-O 3.44Å
555	L	51.9	Low	49.5	Very low	39 Å²	39	66.7 Å²	66.7	20%	0.204	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	115.3	173	-171.1	103.5	0	0	0	109.2	Y479 F480 L552 N553 L570 A572 R573 I574 I577	Y479-L555 WeakPolarHBondContact O-CA 3.25Å; F480-L555 HydrophobicContact CB-CB 4.33Å; F480-L555 HydrophobicContact CB-CD1 4.49Å; F480-L555 HydrophobicContact CD2-CB 4.1Å; F480-L555 HydrophobicContact CD2-CD2 3.53Å; F480-L555 HydrophobicContact CD2-CG 4.42Å; F480-L555 HydrophobicContact CE2-CD2 3.7Å; F480-L555 PolarHBondContact O-N 2.83Å; L552-L555 HydrophobicContact CD2-CB 3.9Å; L552-L555 HydrophobicContact CD2-CD1 4.21Å; L552-L555 HydrophobicContact CD2-CG 4.35Å; N553-L555 PolarHBondContact O-N 3.24Å; L555-L570 HydrophobicContact CD2-CD1 3.83Å; L555-L570 HydrophobicContact CD2-CD2 4.43Å; L555-L570 HydrophobicContact CD2-CG 4.34Å; L555-A572 HydrophobicContact CD1-CB 3.67Å; L555-A572 HydrophobicContact CG-CB 4.06Å; L555-R573 WeakPolarHBondContact O-CA 3.43Å; L555-I574 HydrophobicContact CB-CB 4.34Å; L555-I574 HydrophobicContact CD2-CD1 4.46Å; L555-I574 PolarHBondContact N-O 2.8Å; L555-I574 PolarHBondContact O-N 3.38Å; L555-I577 HydrophobicContact CD2-CD1 3.98Å
556	R	51.6	Low	49.6	Very low	91.5 Å²	91.5	69.1 Å²	69.1	35%	0.345	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	125.4	-177.7	-112.9	177	-176.5	-165	1.8	111	Y479 D554 L558 D571 A572 R573	Y479-R556 HydrophobicContact CD1-CB 3.88Å; Y479-R556 PolarHBondContact N-O 3.05Å; Y479-R556 PolarHBondContact O-N 3.11Å; D554-R556 PolarHBondContact O-N 3.03Å; D554-R556 VanDerWaalsContact OD1-CG 3.24Å; D554-R556 WeakPolarHBondContact OD1-CG 2.95Å; D554-R556 IonicContact OD1-CZ 3.37Å; D554-R556 IonicContact OD1-NE 3.85Å; D554-R556 PolarHBondContact OD1-NE 2.78Å; D554-R556 IonicContact OD1-NH2 3.63Å; D554-R556 IonicContact OD2-CZ 3.59Å; D554-R556 VanDerWaalsContact OD2-CZ 3.27Å; D554-R556 IonicContact OD2-NE 3.47Å; D554-R556 PolarHBondContact OD2-NE 3.16Å; D554-R556 VanDerWaalsContact OD2-NE 3.12Å; D554-R556 IonicContact OD2-NH2 3.93Å; D554-R556 PolarHBondContact OD2-NH2 3.25Å; R556-L558 HydrophobicContact CB-CD2 4.23Å; R556-L558 HydrophobicContact CG-CG 4.33Å; R556-L558 PolarHBondContact O-N 2.85Å; R556-D571 IonicContact CZ-OD1 3.66Å; R556-D571 IonicContact CZ-OD2 2.66Å; R556-D571 PolarHBondContact N-O 2.94Å; R556-D571 IonicContact NE-OD1 2.81Å; R556-D571 PolarHBondContact NE-OD1 3.3Å; R556-D571 IonicContact NE-OD2 3.47Å; R556-D571 VanDerWaalsContact NH2-CG 3.33Å; R556-D571 IonicContact NH2-OD1 3.39Å; R556-D571 PolarHBondContact NH2-OD1 2.92Å; R556-D571 IonicContact NH2-OD2 3.41Å; R556-D571 PolarHBondContact NH2-OD2 3.46Å; R556-D571 PolarHBondContact O-N 2.63Å; R556-A572 WeakPolarHBondContact CA-O 3.18Å; R556-R573 HydrophobicContact CG-CG 4.19Å
557	L	52	Low	49.5	Very low	33 Å²	33	69.3 Å²	69.3	17%	0.173	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	114.2	171.7	-169.3	121.9	0	0	0	108.3	L476 Q477 F478 N559 L569 L570 A572	L476-L557 HydrophobicContact CD1-CD1 4.49Å; L476-L557 HydrophobicContact CD2-CD1 3.77Å; L476-L557 HydrophobicContact CG-CD1 4.38Å; Q477-L557 PolarHBondContact NE2-O 2.8Å; F478-L557 HydrophobicContact CD1-CD1 3.73Å; F478-L557 HydrophobicContact CE1-CD1 3.31Å; F478-L557 HydrophobicContact CE2-CD1 4.34Å; F478-L557 HydrophobicContact CG-CD1 4.4Å; F478-L557 HydrophobicContact CZ-CD1 3.66Å; L557-N559 WeakPolarHBondContact CD2-O 3.3Å; L557-L569 CarbonylContact C-O 3.51Å; L557-L570 HydrophobicContact CB-CD1 4.04Å; L557-L570 HydrophobicContact CD1-CD1 4.26Å; L557-L570 HydrophobicContact CD2-CD2 3.58Å; L557-L570 HydrophobicContact CD2-CG 4.24Å; L557-L570 HydrophobicContact CG-CD1 4.29Å; L557-A572 HydrophobicContact CB-CB 4.28Å; L557-A572 HydrophobicContact CD2-CB 4.44Å; L557-A572 PolarHBondContact N-O 3.21Å; L557-A572 PolarHBondContact O-N 2.81Å; L557-A572 VanDerWaalsContact O-N 3.09Å
558	L	50.7	Low	49.3	Very low	63.5 Å²	63.5	68.7 Å²	68.7	33%	0.332	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	46.5	-175.2	-71.2	175.2	0	0	0	111.8	L476 Q477 R556 L569 L570 D571	L476-L558 WeakPolarHBondContact CA-O 3.13Å; Q477-L558 HydrophobicContact CB-CB 4.5Å; Q477-L558 PolarHBondContact N-O 2.98Å; Q477-L558 PolarHBondContact O-N 3.35Å; R556-L558 HydrophobicContact CB-CD2 4.23Å; R556-L558 HydrophobicContact CG-CG 4.33Å; R556-L558 PolarHBondContact O-N 2.85Å; L558-L569 HydrophobicContact CB-CB 4.24Å; L558-L569 PolarHBondContact N-O 3.46Å; L558-L570 WeakPolarHBondContact CA-O 3.33Å; L558-D571 HydrophobicContact CD1-CB 3.6Å; L558-D571 HydrophobicContact CD2-CB 4.04Å; L558-D571 HydrophobicContact CG-CB 3.65Å
559	N	49.1	Very low	49	Very low	58.5 Å²	58.5	67 Å²	67	31%	0.313	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	129.4	175.2	-126	-5.3	0	0	0	110.3	L557 C568 L569 L570	L557-N559 WeakPolarHBondContact CD2-O 3.3Å; N559-C568 PolarHBondContact O-SG 3.41Å; N559-L569 WeakPolarHBondContact ND2-CD2 3.29Å; N559-L569 PolarHBondContact O-N 3.37Å; N559-L570 HydrophobicContact CB-CB 4.09Å; N559-L570 PolarHBondContact N-O 3.06Å; N559-L570 VanDerWaalsContact N-O 3.15Å
560	G	48.2	Very low	48.7	Very low	23 Å²	23	62 Å²	62	24%	0.237	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-5.5	140	162.2	0	0	0	0	0	114.7	S475 N562 L569	S475-G560 PolarHBondContact O-N 2.66Å; G560-N562 PolarHBondContact O-N 3.44Å; G560-L569 PolarHBondContact O-N 2.88Å
561	W	43.6	Very low	48.5	Very low	129.5 Å²	129.5	59.8 Å²	59.8	49%	0.491	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	110	173.7	178.1	-90.5	0	0	0	111.2	S563 Q566 C568	W561-S563 PolarHBondContact O-N 3.29Å; W561-Q566 HydrophobicContact CH2-CB 4.1Å; W561-Q566 HydrophobicContact CH2-CG 4.35Å; W561-Q566 HydrophobicContact CZ2-CB 4.5Å; W561-Q566 HydrophobicContact CZ2-CG 4.33Å; W561-C568 HydrophobicContact CE3-CB 4.31Å
562	N	46.6	Very low	48.4	Very low	69 Å²	69	59.3 Å²	59.3	37%	0.369	31%	0.31	S	S	.	.			trans	-84.5	109.5	172.7	-177.7	-13.1	0	0	0	109.4	G560 Q564 A565 Q566 H567	G560-N562 PolarHBondContact O-N 3.44Å; N562-Q564 VanDerWaalsContact C-N 3.29Å; N562-Q564 PolarHBondContact O-N 3.12Å; N562-Q564 VanDerWaalsContact O-N 3.16Å; N562-Q564 WeakPolarHBondContact OD1-CB 3.42Å; N562-Q564 PolarHBondContact OD1-N 3.12Å; N562-A565 HydrophobicContact CB-CB 4.06Å; N562-A565 PolarHBondContact O-N 3.32Å; N562-A565 PolarHBondContact OD1-N 3.2Å; N562-Q566 PolarHBondContact O-N 3.12Å; N562-H567 PolarHBondContact N-O 2.55Å
563	S	41.9	Very low	48.3	Very low	95.5 Å²	95.5	61.2 Å²	61.2	67%	0.668	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-24.1	-179	54.4	0	0	0	0	114.2	W561	W561-S563 PolarHBondContact O-N 3.29Å
564	Q	44.9	Very low	48.4	Very low	179.5 Å²	179.5	59.9 Å²	59.9	84%	0.839	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-29	176.2	-63.6	-179.9	-20	0	0	112.4	N562	N562-Q564 VanDerWaalsContact C-N 3.29Å; N562-Q564 PolarHBondContact O-N 3.12Å; N562-Q564 VanDerWaalsContact O-N 3.16Å; N562-Q564 WeakPolarHBondContact OD1-CB 3.42Å; N562-Q564 PolarHBondContact OD1-N 3.12Å
565	A	47.1	Very low	48.4	Very low	40 Å²	40	62.3 Å²	62.3	33%	0.331	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	-16.4	-172.5	0	0	0	0	0	114.7	N562 H567	N562-A565 HydrophobicContact CB-CB 4.06Å; N562-A565 PolarHBondContact O-N 3.32Å; N562-A565 PolarHBondContact OD1-N 3.2Å; A565-H567 PolarHBondContact O-CD2 3.33Å; A565-H567 PolarHBondContact O-N 3.36Å; A565-H567 VanDerWaalsContact O-N 3.14Å; A565-H567 PolarHBondContact O-ND1 3.08Å
566	Q	44.2	Very low	48.5	Very low	107 Å²	107	62.6 Å²	62.6	50%	0.5	32%	0.317	S	S	.	.			trans	58.4	20.9	-179.8	-54.3	-173.1	9.2	0	0	115.6	W561 N562 H603	W561-Q566 HydrophobicContact CH2-CB 4.1Å; W561-Q566 HydrophobicContact CH2-CG 4.35Å; W561-Q566 HydrophobicContact CZ2-CB 4.5Å; W561-Q566 HydrophobicContact CZ2-CG 4.33Å; N562-Q566 PolarHBondContact O-N 3.12Å; Q566-H603 PolarHBondContact O-CE1 2.85Å; Q566-H603 PolarHBondContact O-ND1 3.01Å
567	H	45.5	Very low	48.6	Very low	70.5 Å²	70.5	59.9 Å²	59.9	33%	0.326	31%	0.309	S	S	.	.			trans	-129.1	149.4	176.8	-2.5	-66	0	0	0	111.7	N562 A565 Y601	N562-H567 PolarHBondContact N-O 2.55Å; A565-H567 PolarHBondContact O-CD2 3.33Å; A565-H567 PolarHBondContact O-N 3.36Å; A565-H567 VanDerWaalsContact O-N 3.14Å; A565-H567 PolarHBondContact O-ND1 3.08Å; H567-Y601 HydrophobicContact CB-CD1 4.23Å; H567-Y601 AromaticContact CD2-CD1 3.51Å; H567-Y601 AromaticContact CD2-CE1 3.67Å; H567-Y601 AromaticContact CG-CD1 3.94Å; H567-Y601 AromaticContact NE2-CE1 3.8Å
568	C	45.8	Very low	48.7	Very low	40 Å²	40	59.9 Å²	59.9	27%	0.27	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	139.3	171.8	-118.7	0	0	0	0	109.4	N559 W561	N559-C568 PolarHBondContact O-SG 3.41Å; W561-C568 HydrophobicContact CE3-CB 4.31Å
569	L	47.7	Very low	48.8	Very low	26.5 Å²	26.5	57.7 Å²	57.7	14%	0.139	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	43.1	-176.9	-124.9	85.3	0	0	0	111.9	L557 L558 N559 G560 I599 Y601 E608	L557-L569 CarbonylContact C-O 3.51Å; L558-L569 HydrophobicContact CB-CB 4.24Å; L558-L569 PolarHBondContact N-O 3.46Å; N559-L569 WeakPolarHBondContact ND2-CD2 3.29Å; N559-L569 PolarHBondContact O-N 3.37Å; G560-L569 PolarHBondContact O-N 2.88Å; L569-I599 HydrophobicContact CB-CG2 4.25Å; L569-I599 HydrophobicContact CD2-CG2 3.86Å; L569-I599 HydrophobicContact CG-CG2 3.94Å; L569-Y601 HydrophobicContact CD1-CE1 4.1Å; L569-Y601 HydrophobicContact CD1-CE2 4.46Å; L569-Y601 HydrophobicContact CD2-CE2 3.81Å; L569-Y601 HydrophobicContact CG-CE1 4.16Å; L569-Y601 HydrophobicContact CG-CE2 3.67Å; L569-Y601 WeakPolarHBondContact O-CD2 3.43Å; L569-Y601 WeakPolarHBondContact O-CE2 3.34Å; L569-E608 WeakPolarHBondContact CD1-OE2 3.44Å; L569-E608 WeakPolarHBondContact CD2-OE2 3.31Å
570	L	47.1	Very low	48.8	Very low	24 Å²	24	56.3 Å²	56.3	13%	0.126	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	113.9	179.1	-176.4	68.9	0	0	0	110.5	L555 L557 L558 N559 A572 S598 I599 F600 Y601 I602	L555-L570 HydrophobicContact CD2-CD1 3.83Å; L555-L570 HydrophobicContact CD2-CD2 4.43Å; L555-L570 HydrophobicContact CD2-CG 4.34Å; L557-L570 HydrophobicContact CB-CD1 4.04Å; L557-L570 HydrophobicContact CD1-CD1 4.26Å; L557-L570 HydrophobicContact CD2-CD2 3.58Å; L557-L570 HydrophobicContact CD2-CG 4.24Å; L557-L570 HydrophobicContact CG-CD1 4.29Å; L558-L570 WeakPolarHBondContact CA-O 3.33Å; N559-L570 HydrophobicContact CB-CB 4.09Å; N559-L570 PolarHBondContact N-O 3.06Å; N559-L570 VanDerWaalsContact N-O 3.15Å; L570-A572 HydrophobicContact CD1-CB 4.44Å; L570-S598 VanDerWaalsContact O-O 3.14Å; L570-I599 HydrophobicContact CD1-CG2 3.87Å; L570-I599 CarbonylContact O-C 3.55Å; L570-I599 VanDerWaalsContact O-CA 3.31Å; L570-I599 WeakPolarHBondContact O-CA 3.34Å; L570-F600 HydrophobicContact CB-CB 4.34Å; L570-F600 HydrophobicContact CD2-CD2 4.33Å; L570-F600 PolarHBondContact N-O 3.46Å; L570-F600 PolarHBondContact O-N 2.98Å; L570-Y601 HydrophobicContact CB-CD2 4.17Å; L570-Y601 HydrophobicContact CD1-CD2 4.19Å; L570-I602 HydrophobicContact CD2-CD1 4.33Å
571	D	51.5	Low	49	Very low	14 Å²	14	56.3 Å²	56.3	8%	0.075	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	101.3	172.8	-173.4	36.7	0	0	0	108.9	R556 L558 R573 S597 I599	R556-D571 IonicContact CZ-OD1 3.66Å; R556-D571 IonicContact CZ-OD2 2.66Å; R556-D571 PolarHBondContact N-O 2.94Å; R556-D571 IonicContact NE-OD1 2.81Å; R556-D571 PolarHBondContact NE-OD1 3.3Å; R556-D571 IonicContact NE-OD2 3.47Å; R556-D571 VanDerWaalsContact NH2-CG 3.33Å; R556-D571 IonicContact NH2-OD1 3.39Å; R556-D571 PolarHBondContact NH2-OD1 2.92Å; R556-D571 IonicContact NH2-OD2 3.41Å; R556-D571 PolarHBondContact NH2-OD2 3.46Å; R556-D571 PolarHBondContact O-N 2.63Å; L558-D571 HydrophobicContact CD1-CB 3.6Å; L558-D571 HydrophobicContact CD2-CB 4.04Å; L558-D571 HydrophobicContact CG-CB 3.65Å; D571-R573 IonicContact OD1-NE 3.27Å; D571-R573 PolarHBondContact OD1-NE 3.35Å; D571-R573 IonicContact OD2-CZ 3.12Å; D571-R573 VanDerWaalsContact OD2-CZ 3.26Å; D571-R573 IonicContact OD2-NE 3.28Å; D571-R573 PolarHBondContact OD2-NE 3.15Å; D571-R573 IonicContact OD2-NH2 3.44Å; D571-R573 PolarHBondContact OD2-NH2 3.14Å; D571-S597 WeakPolarHBondContact OD1-CB 3.44Å; D571-S597 PolarHBondContact OD1-OG 3.3Å; D571-I599 HydrophobicContact CB-CG1 4.28Å; D571-I599 WeakPolarHBondContact OD1-CG1 3.43Å
572	A	51.2	Low	49.3	Very low	11 Å²	11	53.5 Å²	53.5	9%	0.091	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	126.9	177.1	0	0	0	0	0	110.1	L555 R556 L557 L570 S597 S598 I599 F600	L555-A572 HydrophobicContact CD1-CB 3.67Å; L555-A572 HydrophobicContact CG-CB 4.06Å; R556-A572 WeakPolarHBondContact CA-O 3.18Å; L557-A572 HydrophobicContact CB-CB 4.28Å; L557-A572 HydrophobicContact CD2-CB 4.44Å; L557-A572 PolarHBondContact N-O 3.21Å; L557-A572 PolarHBondContact O-N 2.81Å; L557-A572 VanDerWaalsContact O-N 3.09Å; L570-A572 HydrophobicContact CD1-CB 4.44Å; A572-S597 CarbonylContact O-C 3.55Å; A572-S597 WeakPolarHBondContact O-CA 3.46Å; A572-S598 WeakPolarHBondContact CA-O 3.46Å; A572-S598 PolarHBondContact N-O 2.87Å; A572-S598 PolarHBondContact O-N 2.9Å; A572-S598 PolarHBondContact O-OG 3.48Å; A572-I599 HydrophobicContact CB-CG1 4.13Å; A572-I599 HydrophobicContact CB-CG2 4.28Å; A572-F600 HydrophobicContact CB-CE2 3.99Å
573	R	50.9	Low	49.3	Very low	64.5 Å²	64.5	52.6 Å²	52.6	24%	0.243	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	114.7	-176.3	-48.3	-165.3	178.1	-171.9	0.6	110.6	D554 L555 R556 D571 Y575 S597 S598	D554-R573 HydrophobicContact CB-CB 3.95Å; D554-R573 HydrophobicContact CB-CG 3.99Å; D554-R573 PolarHBondContact O-N 3.15Å; L555-R573 WeakPolarHBondContact O-CA 3.43Å; R556-R573 HydrophobicContact CG-CG 4.19Å; D571-R573 IonicContact OD1-NE 3.27Å; D571-R573 PolarHBondContact OD1-NE 3.35Å; D571-R573 IonicContact OD2-CZ 3.12Å; D571-R573 VanDerWaalsContact OD2-CZ 3.26Å; D571-R573 IonicContact OD2-NE 3.28Å; D571-R573 PolarHBondContact OD2-NE 3.15Å; D571-R573 IonicContact OD2-NH2 3.44Å; D571-R573 PolarHBondContact OD2-NH2 3.14Å; R573-Y575 HydrophobicContact CB-CD2 3.89Å; R573-Y575 HydrophobicContact CB-CE2 3.45Å; R573-Y575 VanDerWaalsContact CB-CE2 3.45Å; R573-Y575 WeakPolarHBondContact CD-OH 3.07Å; R573-Y575 HydrophobicContact CG-CE2 4.27Å; R573-Y575 PolarHBondContact NH1-OH 3.13Å; R573-S597 CarbonylContact O-C 3.53Å; R573-S597 VanDerWaalsContact O-CA 3.28Å; R573-S597 WeakPolarHBondContact O-CA 3.05Å; R573-S598 PolarHBondContact N-O 3.48Å; R573-S598 PolarHBondContact O-N 2.8Å
574	I	53.1	Low	49.5	Very low	34 Å²	34	55.8 Å²	55.8	17%	0.174	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	129.7	166.8	-54.1	176.9	0	0	0	107.4	L552 D554 L555 I577 I594	L552-I574 HydrophobicContact CD1-CG1 4.32Å; D554-I574 CarbonylContact C-O 3.56Å; D554-I574 WeakPolarHBondContact CA-O 3.29Å; L555-I574 HydrophobicContact CB-CB 4.34Å; L555-I574 HydrophobicContact CD2-CD1 4.46Å; L555-I574 PolarHBondContact N-O 2.8Å; L555-I574 PolarHBondContact O-N 3.38Å; I574-I577 HydrophobicContact CD1-CD1 4.38Å; I574-I577 HydrophobicContact CG2-CD1 4.27Å; I574-I577 HydrophobicContact CG2-CG1 3.71Å; I574-I594 CarbonylContact C-O 3.56Å; I574-I594 HydrophobicContact CG2-CB 4.28Å; I574-I594 HydrophobicContact CG2-CD1 4.4Å; I574-I594 HydrophobicContact CG2-CG2 3.93Å
575	Y	52.2	Low	49.6	Very low	94.5 Å²	94.5	51.9 Å²	51.9	37%	0.371	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	-36	-175.2	-77	-84.2	0	0	0	113.2	N553 D554 R573 N593 I594 L595 H596	N553-Y575 WeakPolarHBondContact CA-O 3.4Å; N553-Y575 HydrophobicContact CB-CD2 4.3Å; D554-Y575 PolarHBondContact N-O 3.44Å; R573-Y575 HydrophobicContact CB-CD2 3.89Å; R573-Y575 HydrophobicContact CB-CE2 3.45Å; R573-Y575 VanDerWaalsContact CB-CE2 3.45Å; R573-Y575 WeakPolarHBondContact CD-OH 3.07Å; R573-Y575 HydrophobicContact CG-CE2 4.27Å; R573-Y575 PolarHBondContact NH1-OH 3.13Å; Y575-N593 PolarHBondContact O-OD1 2.89Å; Y575-I594 WeakPolarHBondContact CA-O 3.41Å; Y575-L595 HydrophobicContact CD1-CD2 4.08Å; Y575-L595 HydrophobicContact CE1-CD2 4.4Å; Y575-L595 PolarHBondContact N-O 2.79Å; Y575-L595 VanDerWaalsContact N-O 3.17Å; Y575-H596 HydrophobicContact CD2-CB 3.38Å; Y575-H596 VanDerWaalsContact CD2-O 3.24Å; Y575-H596 WeakPolarHBondContact CD2-O 3.43Å; Y575-H596 HydrophobicContact CE2-CB 3.88Å; Y575-H596 WeakPolarHBondContact CE2-O 3.35Å; Y575-H596 HydrophobicContact CG-CB 4.14Å
576	L	52.9	Low	49.5	Very low	46 Å²	46	51.6 Å²	51.6	24%	0.241	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	134.5	178.3	176.8	65.8	0	0	0	110.5	C551 L552 N553 E578 Y591 N593 I594 L595	C551-L576 HydrophobicContact CB-CD1 4.41Å; L552-L576 WeakPolarHBondContact O-CA 3.35Å; N553-L576 VanDerWaalsContact OD1-CD1 3.27Å; N553-L576 WeakPolarHBondContact OD1-CD1 3.47Å; L576-E578 HydrophobicContact CD1-CB 4.39Å; L576-E578 HydrophobicContact CD2-CB 4.37Å; L576-E578 HydrophobicContact CG-CB 4.39Å; L576-Y591 HydrophobicContact CD1-CD1 4.28Å; L576-N593 VanDerWaalsContact CD1-OD1 3.26Å; L576-N593 WeakPolarHBondContact CD1-OD1 3.42Å; L576-I594 WeakPolarHBondContact O-CA 3.29Å; L576-L595 HydrophobicContact CB-CB 4.06Å; L576-L595 HydrophobicContact CB-CD1 3.98Å; L576-L595 HydrophobicContact CB-CG 4.04Å; L576-L595 HydrophobicContact CD2-CD1 3.68Å; L576-L595 HydrophobicContact CD2-CG 4.24Å; L576-L595 HydrophobicContact CG-CD1 4.42Å; L576-L595 PolarHBondContact O-N 2.86Å
577	I	53.5	Low	49.7	Very low	34 Å²	34	48.5 Å²	48.5	17%	0.174	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	120.4	158.7	-56.1	175.8	0	0	0	106.5	F548 F550 C551 L552 L555 I574 L592 N593 I594	F548-I577 HydrophobicContact CE2-CG2 4.08Å; F548-I577 HydrophobicContact CZ-CG2 4.16Å; F550-I577 HydrophobicContact CD2-CG1 4.26Å; F550-I577 HydrophobicContact CE2-CG1 4.45Å; C551-I577 CarbonylContact C-O 3.58Å; C551-I577 WeakPolarHBondContact CA-O 3.28Å; L552-I577 PolarHBondContact N-O 3.08Å; L552-I577 PolarHBondContact O-N 2.97Å; L555-I577 HydrophobicContact CD2-CD1 3.98Å; I574-I577 HydrophobicContact CD1-CD1 4.38Å; I574-I577 HydrophobicContact CG2-CD1 4.27Å; I574-I577 HydrophobicContact CG2-CG1 3.71Å; I577-L592 HydrophobicContact CB-CB 3.97Å; I577-L592 PolarHBondContact N-O 2.88Å; I577-L592 PolarHBondContact O-N 3.2Å; I577-N593 WeakPolarHBondContact CA-O 3.19Å; I577-I594 HydrophobicContact CD1-CD1 3.82Å
578	E	54.1	Low	49.9	Very low	33.5 Å²	33.5	45.5 Å²	45.5	16%	0.157	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	123.7	176.3	173.8	177.1	-126.7	0	0	109.4	R549 F550 L576 T580 Y591 L592 N593	R549-E578 HydrophobicContact CB-CB 4.28Å; R549-E578 VanDerWaalsContact CD-OE2 3.31Å; R549-E578 WeakPolarHBondContact CD-OE2 3.47Å; R549-E578 IonicContact CZ-OE1 2.76Å; R549-E578 PolarHBondContact N-O 3.4Å; R549-E578 IonicContact NE-OE1 3.27Å; R549-E578 PolarHBondContact NE-OE1 3.32Å; R549-E578 IonicContact NH1-OE2 2.79Å; R549-E578 PolarHBondContact NH1-OE2 3.09Å; R549-E578 IonicContact NH2-OE1 2.89Å; R549-E578 PolarHBondContact NH2-OE1 2.72Å; R549-E578 PolarHBondContact O-N 3.28Å; R549-E578 VanDerWaalsContact O-N 3.12Å; F550-E578 CarbonylContact O-C 3.57Å; F550-E578 WeakPolarHBondContact O-CA 3.31Å; L576-E578 HydrophobicContact CD1-CB 4.39Å; L576-E578 HydrophobicContact CD2-CB 4.37Å; L576-E578 HydrophobicContact CG-CB 4.39Å; E578-T580 HydrophobicContact CG-CG2 4.09Å; E578-Y591 HydrophobicContact CG-CD1 4.4Å; E578-Y591 HydrophobicContact CG-CE1 4.08Å; E578-Y591 VanDerWaalsContact OE1-CE1 3.29Å; E578-Y591 WeakPolarHBondContact OE1-CE1 3.46Å; E578-L592 CarbonylContact O-C 3.49Å; E578-L592 VanDerWaalsContact O-CA 3.28Å; E578-L592 WeakPolarHBondContact O-CA 3.41Å; E578-N593 HydrophobicContact CB-CB 4.28Å; E578-N593 PolarHBondContact N-O 2.85Å; E578-N593 PolarHBondContact O-N 3.49Å; E578-N593 PolarHBondContact OE2-ND2 2.87Å; E578-N593 VanDerWaalsContact OE2-ND2 3.15Å
579	A	53.2	Low	50.1	Low	18 Å²	18	44.7 Å²	44.7	15%	0.149	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	122.2	171.8	0	0	0	0	0	109.3	F548 R549 F550 I590 Y591 L592	F548-A579 HydrophobicContact CD2-CB 4.33Å; R549-A579 CarbonylContact C-O 3.56Å; R549-A579 WeakPolarHBondContact CA-O 3.33Å; F550-A579 PolarHBondContact N-O 2.84Å; F550-A579 PolarHBondContact O-N 2.78Å; A579-I590 HydrophobicContact CB-CB 4.43Å; A579-I590 PolarHBondContact N-O 3.48Å; A579-I590 VanDerWaalsContact N-O 3.08Å; A579-I590 PolarHBondContact O-N 3.42Å; A579-Y591 CarbonylContact C-O 3.54Å; A579-Y591 VanDerWaalsContact CA-O 3.23Å; A579-Y591 WeakPolarHBondContact CA-O 3.4Å; A579-L592 HydrophobicContact CB-CD1 4.49Å
580	T	49.9	Very low	50.4	Low	28.5 Å²	28.5	46 Å²	46	18%	0.175	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	128.9	178.2	55.7	0	0	0	0	110.3	N547 F548 R549 E578 N589 I590 Y591	N547-T580 VanDerWaalsContact CB-OG1 3.23Å; N547-T580 WeakPolarHBondContact CB-OG1 3.5Å; N547-T580 PolarHBondContact N-O 3.25Å; N547-T580 PolarHBondContact O-N 3.14Å; N547-T580 VanDerWaalsContact O-N 3.08Å; F548-T580 CarbonylContact O-C 3.54Å; F548-T580 WeakPolarHBondContact O-CA 3.38Å; R549-T580 HydrophobicContact CB-CG2 3.89Å; R549-T580 HydrophobicContact CG-CG2 3.66Å; E578-T580 HydrophobicContact CG-CG2 4.09Å; T580-N589 WeakPolarHBondContact CB-OD1 3.42Å; T580-N589 VanDerWaalsContact CG2-OD1 3.25Å; T580-N589 WeakPolarHBondContact CG2-OD1 3.46Å; T580-I590 CarbonylContact O-C 3.57Å; T580-I590 VanDerWaalsContact O-CA 3.3Å; T580-I590 WeakPolarHBondContact O-CA 3.32Å; T580-Y591 PolarHBondContact N-O 3.09Å; T580-Y591 PolarHBondContact O-N 3.21Å; T580-Y591 WeakPolarHBondContact OG1-CB 3.32Å; T580-Y591 WeakPolarHBondContact OG1-CD2 3.36Å
581	E	52.4	Low	50.4	Low	22.5 Å²	22.5	47.7 Å²	47.7	11%	0.105	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	126.4	174.6	-174.8	174.6	-176.4	0	0	109	F543 I544 N547 F548 L583 C588 N589 I590	F543-E581 VanDerWaalsContact CA-OE1 3.26Å; F543-E581 WeakPolarHBondContact CA-OE1 3.45Å; F543-E581 WeakPolarHBondContact CD1-OE2 3.27Å; I544-E581 PolarHBondContact N-OE1 3.17Å; N547-E581 WeakPolarHBondContact CA-O 3.5Å; F548-E581 HydrophobicContact CB-CB 4.22Å; F548-E581 HydrophobicContact CD1-CB 4.42Å; F548-E581 PolarHBondContact N-O 2.85Å; F548-E581 PolarHBondContact O-N 2.81Å; E581-L583 HydrophobicContact CG-CG 4.3Å; E581-C588 HydrophobicContact CB-CB 4.47Å; E581-C588 PolarHBondContact N-O 3.1Å; E581-C588 PolarHBondContact O-N 2.91Å; E581-N589 WeakPolarHBondContact CA-O 3.35Å; E581-I590 HydrophobicContact CG-CG1 4.27Å
582	Q	49.6	Very low	50.3	Low	71.5 Å²	71.5	49.5 Å²	49.5	33%	0.334	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	114.2	177.9	-113.1	-167.9	-77.6	0	0	109.1	I587 N589	Q582-I587 HydrophobicContact CG-CG1 4.31Å; Q582-N589 PolarHBondContact N-O 3.29Å; Q582-N589 PolarHBondContact O-N 2.84Å
583	L	45.9	Very low	50.1	Low	50.5 Å²	50.5	51.3 Å²	51.3	26%	0.264	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	126.8	175.7	-70.7	156.4	0	0	0	109.9	L545 L546 E581 S585 S586 C588	L545-L583 HydrophobicContact CB-CD1 4Å; L545-L583 HydrophobicContact CD2-CD1 4.2Å; L545-L583 HydrophobicContact CG-CD1 4.2Å; L545-L583 WeakPolarHBondContact O-CD1 3.45Å; L546-L583 PolarHBondContact O-N 2.94Å; L546-L583 VanDerWaalsContact O-N 3.08Å; E581-L583 HydrophobicContact CG-CG 4.3Å; L583-S585 PolarHBondContact O-N 2.68Å; L583-S586 WeakPolarHBondContact CB-O 3.31Å; L583-S586 PolarHBondContact N-O 3.1Å; L583-S586 PolarHBondContact O-N 2.89Å; L583-C588 HydrophobicContact CD2-CB 3.76Å
584	E	47.7	Very low	50	Low	162 Å²	162	49.3 Å²	49.3	76%	0.757	26%	0.256	S	S	*	.			trans	-71.8	-104.7	-177.9	-62.8	-176.2	146.7	0	0	112.7	S586 I587	E584-S586 PolarHBondContact O-N 2.84Å; E584-I587 PolarHBondContact N-O 2.87Å
585	S	45.7	Very low	49.6	Very low	96.5 Å²	96.5	51.1 Å²	51.1	68%	0.675	27%	0.265	S	S	*	.	S	Bend	trans	-94.6	-12.6	-176.8	54.7	0	0	0	0	114.9	L583	L583-S585 PolarHBondContact O-N 2.68Å
586	S	46.4	Very low	49.5	Very low	35 Å²	35	50.7 Å²	50.7	25%	0.245	27%	0.266	C	S	.	.	S	Bend	trans	-139.5	64.5	-178	58.8	0	0	0	0	113.9	L583 E584 R687 Q688	L583-S586 WeakPolarHBondContact CB-O 3.31Å; L583-S586 PolarHBondContact N-O 3.1Å; L583-S586 PolarHBondContact O-N 2.89Å; E584-S586 PolarHBondContact O-N 2.84Å; S586-R687 WeakPolarHBondContact O-CA 3.5Å; S586-Q688 PolarHBondContact O-N 2.82Å
587	I	48.1	Very low	49.3	Very low	42 Å²	42	48.7 Å²	48.7	22%	0.215	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	129.7	-179.1	-59.6	178.4	0	0	0	110	Q582 E584 N589 Q688 N690 G696 V698	Q582-I587 HydrophobicContact CG-CG1 4.31Å; E584-I587 PolarHBondContact N-O 2.87Å; I587-N589 WeakPolarHBondContact CG2-OD1 3.27Å; I587-Q688 WeakPolarHBondContact CA-O 3.47Å; I587-N690 WeakPolarHBondContact CG2-ND2 3.39Å; I587-G696 PolarHBondContact N-O 2.8Å; I587-G696 PolarHBondContact O-N 2.95Å; I587-V698 HydrophobicContact CD1-CG2 3.57Å; I587-V698 HydrophobicContact CG1-CG2 3.94Å
588	C	49.8	Very low	49	Very low	7 Å²	7	48.4 Å²	48.4	5%	0.047	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	112.1	166.4	177.2	0	0	0	0	108.8	E581 L583 L684 Q688 L689 N690 F695	E581-C588 HydrophobicContact CB-CB 4.47Å; E581-C588 PolarHBondContact N-O 3.1Å; E581-C588 PolarHBondContact O-N 2.91Å; L583-C588 HydrophobicContact CD2-CB 3.76Å; C588-L684 HydrophobicContact CB-CD2 3.85Å; C588-Q688 PolarHBondContact N-O 2.91Å; C588-L689 HydrophobicContact CB-CB 4.49Å; C588-L689 WeakPolarHBondContact O-CA 3.44Å; C588-N690 PolarHBondContact O-N 3.18Å; C588-F695 HydrophobicContact CB-CD1 4.19Å; C588-F695 HydrophobicContact CB-CE1 4.2Å; C588-F695 VanDerWaalsContact SG-CE1 3.56Å
589	N	49.8	Very low	48.5	Very low	22.5 Å²	22.5	49.6 Å²	49.6	12%	0.12	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	119.7	175.2	-69.7	-30.7	0	0	0	110.2	T580 E581 Q582 I587 Y591 N690 I693 Y694	T580-N589 WeakPolarHBondContact CB-OD1 3.42Å; T580-N589 VanDerWaalsContact CG2-OD1 3.25Å; T580-N589 WeakPolarHBondContact CG2-OD1 3.46Å; E581-N589 WeakPolarHBondContact CA-O 3.35Å; Q582-N589 PolarHBondContact N-O 3.29Å; Q582-N589 PolarHBondContact O-N 2.84Å; I587-N589 WeakPolarHBondContact CG2-OD1 3.27Å; N589-Y591 HydrophobicContact CB-CD2 4.37Å; N589-Y591 HydrophobicContact CB-CE2 3.59Å; N589-Y591 VanDerWaalsContact CB-CE2 3.5Å; N589-Y591 PolarHBondContact ND2-OH 3.34Å; N589-N690 WeakPolarHBondContact OD1-CB 3.46Å; N589-N690 PolarHBondContact OD1-ND2 2.94Å; N589-I693 WeakPolarHBondContact O-CA 3.21Å; N589-Y694 PolarHBondContact N-O 3.14Å; N589-Y694 PolarHBondContact O-N 2.95Å
590	I	52.8	Low	48.2	Very low	54.5 Å²	54.5	51.9 Å²	51.9	28%	0.279	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	112.4	174.2	-58.4	175	0	0	0	108.3	A579 T580 E581 L689 N690 V691 R692 I693	A579-I590 HydrophobicContact CB-CB 4.43Å; A579-I590 PolarHBondContact N-O 3.48Å; A579-I590 VanDerWaalsContact N-O 3.08Å; A579-I590 PolarHBondContact O-N 3.42Å; T580-I590 CarbonylContact O-C 3.57Å; T580-I590 VanDerWaalsContact O-CA 3.3Å; T580-I590 WeakPolarHBondContact O-CA 3.32Å; E581-I590 HydrophobicContact CG-CG1 4.27Å; I590-L689 HydrophobicContact CD1-CD1 3.99Å; I590-L689 HydrophobicContact CD1-CG 4.44Å; I590-N690 PolarHBondContact N-O 2.75Å; I590-V691 HydrophobicContact CB-CG2 4.46Å; I590-V691 HydrophobicContact CG2-CG1 4.39Å; I590-V691 CarbonylContact O-C 3.53Å; I590-V691 VanDerWaalsContact O-CA 3.3Å; I590-V691 WeakPolarHBondContact O-CA 3.44Å; I590-R692 PolarHBondContact O-N 3.21Å; I590-I693 HydrophobicContact CG1-CG2 4.4Å
591	Y	48.5	Very low	48	Very low	59.5 Å²	59.5	54.1 Å²	54.1	23%	0.233	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	127.8	173.1	-56.9	-86.9	0	0	0	109.7	L576 E578 A579 T580 N589 R692 Y694	L576-Y591 HydrophobicContact CD1-CD1 4.28Å; E578-Y591 HydrophobicContact CG-CD1 4.4Å; E578-Y591 HydrophobicContact CG-CE1 4.08Å; E578-Y591 VanDerWaalsContact OE1-CE1 3.29Å; E578-Y591 WeakPolarHBondContact OE1-CE1 3.46Å; A579-Y591 CarbonylContact C-O 3.54Å; A579-Y591 VanDerWaalsContact CA-O 3.23Å; A579-Y591 WeakPolarHBondContact CA-O 3.4Å; T580-Y591 PolarHBondContact N-O 3.09Å; T580-Y591 PolarHBondContact O-N 3.21Å; T580-Y591 WeakPolarHBondContact OG1-CB 3.32Å; T580-Y591 WeakPolarHBondContact OG1-CD2 3.36Å; N589-Y591 HydrophobicContact CB-CD2 4.37Å; N589-Y591 HydrophobicContact CB-CE2 3.59Å; N589-Y591 VanDerWaalsContact CB-CE2 3.5Å; N589-Y591 PolarHBondContact ND2-OH 3.34Å; Y591-R692 CarbonylContact C-O 3.55Å; Y591-R692 WeakPolarHBondContact CA-O 3.34Å; Y591-R692 HydrophobicContact CD1-CB 4.05Å; Y591-R692 PolarHBondContact N-O 3.49Å; Y591-R692 PolarHBondContact O-N 3.37Å; Y591-Y694 HydrophobicContact CD1-CE2 4.41Å
592	L	48.4	Very low	47.7	Very low	51.5 Å²	51.5	55 Å²	55	27%	0.27	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	99	176.2	-138.8	154.4	0	0	0	109.8	I577 E578 A579 I594 L689 V691 R692 I693 Y694	I577-L592 HydrophobicContact CB-CB 3.97Å; I577-L592 PolarHBondContact N-O 2.88Å; I577-L592 PolarHBondContact O-N 3.2Å; E578-L592 CarbonylContact O-C 3.49Å; E578-L592 VanDerWaalsContact O-CA 3.28Å; E578-L592 WeakPolarHBondContact O-CA 3.41Å; A579-L592 HydrophobicContact CB-CD1 4.49Å; L592-I594 HydrophobicContact CD2-CD1 3.59Å; L592-I594 HydrophobicContact CD2-CG1 3.72Å; L592-I594 PolarHBondContact O-N 3.03Å; L592-L689 HydrophobicContact CD2-CD1 3.84Å; L592-L689 HydrophobicContact CD2-CD2 4.29Å; L592-L689 HydrophobicContact CD2-CG 4.24Å; L592-V691 HydrophobicContact CD2-CG2 3.78Å; L592-V691 HydrophobicContact CG-CG2 4.25Å; L592-R692 PolarHBondContact N-O 3.37Å; L592-I693 HydrophobicContact CB-CG1 4.47Å; L592-I693 HydrophobicContact CB-CG2 4.46Å; L592-I693 HydrophobicContact CD2-CG2 3.89Å; L592-I693 CarbonylContact O-C 3.46Å; L592-I693 VanDerWaalsContact O-CA 3.29Å; L592-I693 WeakPolarHBondContact O-CA 3.36Å; L592-Y694 PolarHBondContact O-N 3.05Å
593	N	46.5	Very low	47.4	Very low	49 Å²	49	54.6 Å²	54.6	26%	0.262	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	112.9	178.5	-72	-22	0	0	0	109.9	Y575 L576 I577 E578 L595 N690 Y694	Y575-N593 PolarHBondContact O-OD1 2.89Å; L576-N593 VanDerWaalsContact CD1-OD1 3.26Å; L576-N593 WeakPolarHBondContact CD1-OD1 3.42Å; I577-N593 WeakPolarHBondContact CA-O 3.19Å; E578-N593 HydrophobicContact CB-CB 4.28Å; E578-N593 PolarHBondContact N-O 2.85Å; E578-N593 PolarHBondContact O-N 3.49Å; E578-N593 PolarHBondContact OE2-ND2 2.87Å; E578-N593 VanDerWaalsContact OE2-ND2 3.15Å; N593-L595 HydrophobicContact CB-CD1 4.21Å; N593-L595 HydrophobicContact CB-CG 4.36Å; N593-N690 PolarHBondContact N-O 3.38Å; N593-N690 VanDerWaalsContact N-O 3.1Å; N593-N690 PolarHBondContact O-N 3.03Å; N593-Y694 WeakPolarHBondContact OD1-CD2 3.22Å
594	I	50.4	Low	47.1	Very low	23.5 Å²	23.5	57 Å²	57	12%	0.121	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	111	171	-64.6	172.2	0	0	0	107.7	I574 Y575 L576 I577 L592 L684 L689 Y694 F695	I574-I594 CarbonylContact C-O 3.56Å; I574-I594 HydrophobicContact CG2-CB 4.28Å; I574-I594 HydrophobicContact CG2-CD1 4.4Å; I574-I594 HydrophobicContact CG2-CG2 3.93Å; Y575-I594 WeakPolarHBondContact CA-O 3.41Å; L576-I594 WeakPolarHBondContact O-CA 3.29Å; I577-I594 HydrophobicContact CD1-CD1 3.82Å; L592-I594 HydrophobicContact CD2-CD1 3.59Å; L592-I594 HydrophobicContact CD2-CG1 3.72Å; L592-I594 PolarHBondContact O-N 3.03Å; I594-L684 HydrophobicContact CG2-CD2 4.27Å; I594-L689 HydrophobicContact CG1-CD1 4.01Å; I594-Y694 PolarHBondContact N-O 3.44Å; I594-F695 HydrophobicContact CB-CD1 3.94Å; I594-F695 HydrophobicContact CB-CE1 4.33Å; I594-F695 HydrophobicContact CD1-CD1 4.07Å; I594-F695 HydrophobicContact CD1-CE1 3.55Å; I594-F695 HydrophobicContact CD1-CZ 4.24Å; I594-F695 HydrophobicContact CG2-CD1 4.01Å; I594-F695 HydrophobicContact CG2-CE1 4.46Å
595	L	43.9	Very low	46.8	Very low	71.5 Å²	71.5	53.5 Å²	53.5	37%	0.374	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	88	-171.4	-74.8	176.4	0	0	0	114	Y575 L576 N593 S597 G696	Y575-L595 HydrophobicContact CD1-CD2 4.08Å; Y575-L595 HydrophobicContact CE1-CD2 4.4Å; Y575-L595 PolarHBondContact N-O 2.79Å; Y575-L595 VanDerWaalsContact N-O 3.17Å; L576-L595 HydrophobicContact CB-CB 4.06Å; L576-L595 HydrophobicContact CB-CD1 3.98Å; L576-L595 HydrophobicContact CB-CG 4.04Å; L576-L595 HydrophobicContact CD2-CD1 3.68Å; L576-L595 HydrophobicContact CD2-CG 4.24Å; L576-L595 HydrophobicContact CG-CD1 4.42Å; L576-L595 PolarHBondContact O-N 2.86Å; N593-L595 HydrophobicContact CB-CD1 4.21Å; N593-L595 HydrophobicContact CB-CG 4.36Å; L595-S597 PolarHBondContact O-N 3.41Å; L595-S597 VanDerWaalsContact O-N 3.16Å; L595-G696 WeakPolarHBondContact CD2-O 3.43Å
596	H	49.5	Very low	46.7	Very low	85 Å²	85	55.1 Å²	55.1	39%	0.394	28%	0.279	S	S	.	.	S	Bend	trans	127.8	97.6	163.9	-107.8	-87	0	0	0	115.4	Y575 S598 R687 N697 Q779	Y575-H596 HydrophobicContact CD2-CB 3.38Å; Y575-H596 VanDerWaalsContact CD2-O 3.24Å; Y575-H596 WeakPolarHBondContact CD2-O 3.43Å; Y575-H596 HydrophobicContact CE2-CB 3.88Å; Y575-H596 WeakPolarHBondContact CE2-O 3.35Å; Y575-H596 HydrophobicContact CG-CB 4.14Å; H596-S598 PolarHBondContact O-N 3.15Å; H596-R687 PolarHBondContact ND1-NH1 2.95Å; H596-N697 PolarHBondContact NE2-ND2 2.9Å; H596-Q779 PolarHBondContact CD2-NE2 3.41Å; H596-Q779 VanDerWaalsContact N-NE2 3.19Å; H596-Q779 PolarHBondContact ND1-NE2 3.01Å
597	S	48.7	Very low	46.5	Very low	5.5 Å²	5.5	57.7 Å²	57.7	4%	0.038	29%	0.289	C	S	.	.			trans	-66.8	139.8	172.3	64.8	0	0	0	0	113.2	D571 A572 R573 L595 R687 L781	D571-S597 WeakPolarHBondContact OD1-CB 3.44Å; D571-S597 PolarHBondContact OD1-OG 3.3Å; A572-S597 CarbonylContact O-C 3.55Å; A572-S597 WeakPolarHBondContact O-CA 3.46Å; R573-S597 CarbonylContact O-C 3.53Å; R573-S597 VanDerWaalsContact O-CA 3.28Å; R573-S597 WeakPolarHBondContact O-CA 3.05Å; L595-S597 PolarHBondContact O-N 3.41Å; L595-S597 VanDerWaalsContact O-N 3.16Å; S597-R687 PolarHBondContact O-NH1 3.31Å; S597-L781 WeakPolarHBondContact OG-CD1 3.22Å
598	S	46.8	Very low	46	Very low	27.5 Å²	27.5	57.7 Å²	57.7	19%	0.192	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	128	171.6	52.8	0	0	0	0	110.3	L570 A572 R573 H596 F600 I780	L570-S598 VanDerWaalsContact O-O 3.14Å; A572-S598 WeakPolarHBondContact CA-O 3.46Å; A572-S598 PolarHBondContact N-O 2.87Å; A572-S598 PolarHBondContact O-N 2.9Å; A572-S598 PolarHBondContact O-OG 3.48Å; R573-S598 PolarHBondContact N-O 3.48Å; R573-S598 PolarHBondContact O-N 2.8Å; H596-S598 PolarHBondContact O-N 3.15Å; S598-F600 WeakPolarHBondContact OG-CE2 3.45Å; S598-F600 WeakPolarHBondContact OG-CZ 3.47Å; S598-I780 WeakPolarHBondContact CA-O 3.37Å
599	I	45.5	Very low	45.6	Very low	58 Å²	58	62 Å²	62	30%	0.297	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	118.8	179.4	-56.3	175.9	0	0	0	109.1	L569 L570 D571 A572 Y601 L781 F782 V783	L569-I599 HydrophobicContact CB-CG2 4.25Å; L569-I599 HydrophobicContact CD2-CG2 3.86Å; L569-I599 HydrophobicContact CG-CG2 3.94Å; L570-I599 HydrophobicContact CD1-CG2 3.87Å; L570-I599 CarbonylContact O-C 3.55Å; L570-I599 VanDerWaalsContact O-CA 3.31Å; L570-I599 WeakPolarHBondContact O-CA 3.34Å; D571-I599 HydrophobicContact CB-CG1 4.28Å; D571-I599 WeakPolarHBondContact OD1-CG1 3.43Å; A572-I599 HydrophobicContact CB-CG1 4.13Å; A572-I599 HydrophobicContact CB-CG2 4.28Å; I599-Y601 HydrophobicContact CG2-CE2 4.33Å; I599-L781 WeakPolarHBondContact CB-O 3.48Å; I599-F782 HydrophobicContact CB-CD1 4.25Å; I599-F782 HydrophobicContact CD1-CD1 4.19Å; I599-F782 HydrophobicContact CD1-CE1 3.66Å; I599-F782 HydrophobicContact CD1-CZ 4.23Å; I599-F782 HydrophobicContact CG2-CD1 4.25Å; I599-F782 HydrophobicContact CG2-CE1 4.48Å; I599-V783 PolarHBondContact O-N 2.88Å
600	F	45.5	Very low	45.2	Very low	66.5 Å²	66.5	64.3 Å²	64.3	29%	0.292	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	139	172.7	-59.2	-82.3	0	0	0	110.5	L570 A572 S598 V783 I875 Y876 I879	L570-F600 HydrophobicContact CB-CB 4.34Å; L570-F600 HydrophobicContact CD2-CD2 4.33Å; L570-F600 PolarHBondContact N-O 3.46Å; L570-F600 PolarHBondContact O-N 2.98Å; A572-F600 HydrophobicContact CB-CE2 3.99Å; S598-F600 WeakPolarHBondContact OG-CE2 3.45Å; S598-F600 WeakPolarHBondContact OG-CZ 3.47Å; F600-V783 HydrophobicContact CD1-CB 4.09Å; F600-V783 HydrophobicContact CD1-CG2 4.12Å; F600-V783 HydrophobicContact CE1-CG2 4.04Å; F600-I875 HydrophobicContact CD1-CG2 4.06Å; F600-I875 HydrophobicContact CE1-CG2 3.68Å; F600-I875 HydrophobicContact CZ-CG2 4.31Å; F600-Y876 HydrophobicContact CE2-CE1 4.49Å; F600-Y876 HydrophobicContact CZ-CE1 4.07Å; F600-I879 HydrophobicContact CE1-CD1 3.97Å; F600-I879 HydrophobicContact CZ-CD1 4.19Å
601	Y	47	Very low	44.7	Very low	74.6667 Å²	74.6667	65.9 Å²	65.9	29%	0.293	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	131.6	172.1	-91.1	-90.4	0	0	0	110.3	H567 L569 L570 I599 H603 V783 I785	H567-Y601 HydrophobicContact CB-CD1 4.23Å; H567-Y601 AromaticContact CD2-CD1 3.51Å; H567-Y601 AromaticContact CD2-CE1 3.67Å; H567-Y601 AromaticContact CG-CD1 3.94Å; H567-Y601 AromaticContact NE2-CE1 3.8Å; L569-Y601 HydrophobicContact CD1-CE1 4.1Å; L569-Y601 HydrophobicContact CD1-CE2 4.46Å; L569-Y601 HydrophobicContact CD2-CE2 3.81Å; L569-Y601 HydrophobicContact CG-CE1 4.16Å; L569-Y601 HydrophobicContact CG-CE2 3.67Å; L569-Y601 WeakPolarHBondContact O-CD2 3.43Å; L569-Y601 WeakPolarHBondContact O-CE2 3.34Å; L570-Y601 HydrophobicContact CB-CD2 4.17Å; L570-Y601 HydrophobicContact CD1-CD2 4.19Å; I599-Y601 HydrophobicContact CG2-CE2 4.33Å; Y601-H603 VanDerWaalsContact CB-CE1 3.46Å; Y601-H603 WeakPolarHBondContact CB-CE1 3.36Å; Y601-H603 WeakPolarHBondContact CB-NE2 3.46Å; Y601-H603 HydrophobicContact CE1-CB 4.15Å; Y601-H603 AromaticContact CG-CE1 3.93Å; Y601-H603 AromaticContact CG-NE2 3.99Å; Y601-V783 PolarHBondContact N-O 3.08Å; Y601-I785 PolarHBondContact O-N 2.77Å
602	I	45.1	Very low	44.5	Very low	41 Å²	41	68 Å²	68	21%	0.21	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	131.5	177.5	-54.4	-177.1	0	0	0	108.4	L570 E608 F611 L784 I785	L570-I602 HydrophobicContact CD2-CD1 4.33Å; I602-E608 HydrophobicContact CG2-CB 4.34Å; I602-E608 HydrophobicContact CG2-CG 4.29Å; I602-F611 HydrophobicContact CD1-CD1 4.44Å; I602-F611 HydrophobicContact CD1-CE1 4.47Å; I602-L784 HydrophobicContact CB-CD2 4.03Å; I602-L784 HydrophobicContact CD1-CD2 3.52Å; I602-L784 HydrophobicContact CG1-CD2 3.91Å; I602-I785 HydrophobicContact CD1-CD1 4.2Å; I602-I785 HydrophobicContact CG1-CB 4.31Å; I602-I785 HydrophobicContact CG1-CD1 4.23Å; I602-I785 HydrophobicContact CG2-CB 4.28Å; I602-I785 HydrophobicContact CG2-CG2 4.36Å
603	H	43.3	Very low	44.2	Very low	63 Å²	63	69.9 Å²	69.9	29%	0.292	34%	0.34	S	S	.	.			trans	-120.7	110.6	-171.9	-96.2	-75.9	0	0	0	112.9	Q566 Y601 I607 I785 P786	Q566-H603 PolarHBondContact O-CE1 2.85Å; Q566-H603 PolarHBondContact O-ND1 3.01Å; Y601-H603 VanDerWaalsContact CB-CE1 3.46Å; Y601-H603 WeakPolarHBondContact CB-CE1 3.36Å; Y601-H603 WeakPolarHBondContact CB-NE2 3.46Å; Y601-H603 HydrophobicContact CE1-CB 4.15Å; Y601-H603 AromaticContact CG-CE1 3.93Å; Y601-H603 AromaticContact CG-NE2 3.99Å; H603-I607 VanDerWaalsContact O-CB 3.3Å; H603-I607 WeakPolarHBondContact O-CB 3.04Å; H603-I607 WeakPolarHBondContact O-CD1 3.38Å; H603-I607 WeakPolarHBondContact O-CG1 3.36Å; H603-I785 PolarHBondContact N-O 2.76Å; H603-P786 PolarHBondContact ND1-O 3.05Å
604	D	40.3	Very low	44	Very low	100.667 Å²	100.667	74.2 Å²	74.2	54%	0.538	36%	0.357	S	S	.	.			trans	-163.8	121.8	160.1	-135.8	-3.8	0	0	0	115.9	I606 I607 E608	D604-I606 VanDerWaalsContact C-N 3.32Å; D604-I606 PolarHBondContact O-N 3.12Å; D604-I606 PolarHBondContact OD1-N 3.03Å; D604-I607 HydrophobicContact CB-CB 4.24Å; D604-I607 CarbonylContact O-C 3.59Å; D604-I607 WeakPolarHBondContact O-CB 3.25Å; D604-I607 PolarHBondContact O-N 3.39Å; D604-I607 VanDerWaalsContact O-N 3.14Å; D604-I607 WeakPolarHBondContact OD2-CD1 3.4Å; D604-E608 WeakPolarHBondContact O-CA 3.13Å; D604-E608 WeakPolarHBondContact O-CB 3.5Å; D604-E608 PolarHBondContact O-N 3.29Å
605	N	41	Very low	43.6	Very low	89.6667 Å²	89.6667	76.6 Å²	76.6	48%	0.48	37%	0.37	S	S	.	.	H	α-helix	trans	-85.7	-18.8	173.3	-111.7	-30.4	0	0	0	113.6	I607 E608 M609 P786	N605-I607 PolarHBondContact O-N 2.98Å; N605-E608 PolarHBondContact O-N 3.28Å; N605-M609 WeakPolarHBondContact O-CB 3.41Å; N605-M609 PolarHBondContact O-N 2.79Å; N605-P786 PolarHBondContact ND2-O 2.74Å; N605-P786 PolarHBondContact OD1-O 3.46Å; N605-P786 VanDerWaalsContact OD1-O 3.11Å
606	I	44.3	Very low	43.6	Very low	128.667 Å²	128.667	76.9 Å²	76.9	66%	0.66	38%	0.378	S	S	*	.	H	α-helix	trans	-66.3	-31.6	178.3	-65.1	171.3	0	0	0	111.5	D604 E608 M609 N610	D604-I606 VanDerWaalsContact C-N 3.32Å; D604-I606 PolarHBondContact O-N 3.12Å; D604-I606 PolarHBondContact OD1-N 3.03Å; I606-E608 VanDerWaalsContact C-N 3.27Å; I606-E608 PolarHBondContact O-N 2.96Å; I606-M609 PolarHBondContact O-N 3.48Å; I606-N610 VanDerWaalsContact O-CG 3.23Å; I606-N610 PolarHBondContact O-N 3.19Å; I606-N610 PolarHBondContact O-ND2 3.44Å
607	I	40.3	Very low	43.3	Very low	91 Å²	91	75.2 Å²	75.2	47%	0.467	38%	0.375	S	S	.	.	H	α-helix	trans	-76.8	-26.9	179	-55.7	179.7	0	0	0	111.6	H603 D604 N605 N610 F611	H603-I607 VanDerWaalsContact O-CB 3.3Å; H603-I607 WeakPolarHBondContact O-CB 3.04Å; H603-I607 WeakPolarHBondContact O-CD1 3.38Å; H603-I607 WeakPolarHBondContact O-CG1 3.36Å; D604-I607 HydrophobicContact CB-CB 4.24Å; D604-I607 CarbonylContact O-C 3.59Å; D604-I607 WeakPolarHBondContact O-CB 3.25Å; D604-I607 PolarHBondContact O-N 3.39Å; D604-I607 VanDerWaalsContact O-N 3.14Å; D604-I607 WeakPolarHBondContact OD2-CD1 3.4Å; N605-I607 PolarHBondContact O-N 2.98Å; I607-N610 HydrophobicContact CG2-CB 4.42Å; I607-N610 CarbonylContact O-C 3.57Å; I607-N610 WeakPolarHBondContact O-CA 3.41Å; I607-N610 WeakPolarHBondContact O-CB 3.46Å; I607-N610 PolarHBondContact O-N 3.15Å; I607-F611 WeakPolarHBondContact O-CA 3.45Å; I607-F611 WeakPolarHBondContact O-CB 3.34Å; I607-F611 PolarHBondContact O-N 3.03Å
608	E	39.5	Very low	43	Very low	40.6667 Å²	40.6667	78.7 Å²	78.7	19%	0.19	39%	0.393	C	S	.	.	H	α-helix	trans	-73.3	-40.3	174.3	-96.3	-171.1	176.8	0	0	111.3	R474 L569 I602 D604 N605 I606 N610 F611 Y612 L784 I785 P786	R474-E608 IonicContact CZ-OE1 2.83Å; R474-E608 IonicContact NH1-OE1 3.78Å; R474-E608 PolarHBondContact NH1-OE1 3.28Å; R474-E608 IonicContact NH2-OE1 3.86Å; R474-E608 PolarHBondContact NH2-OE1 2.9Å; L569-E608 WeakPolarHBondContact CD1-OE2 3.44Å; L569-E608 WeakPolarHBondContact CD2-OE2 3.31Å; I602-E608 HydrophobicContact CG2-CB 4.34Å; I602-E608 HydrophobicContact CG2-CG 4.29Å; D604-E608 WeakPolarHBondContact O-CA 3.13Å; D604-E608 WeakPolarHBondContact O-CB 3.5Å; D604-E608 PolarHBondContact O-N 3.29Å; N605-E608 PolarHBondContact O-N 3.28Å; I606-E608 VanDerWaalsContact C-N 3.27Å; I606-E608 PolarHBondContact O-N 2.96Å; E608-N610 PolarHBondContact O-N 3.06Å; E608-F611 CarbonylContact O-C 3.56Å; E608-F611 WeakPolarHBondContact O-CA 3.42Å; E608-F611 WeakPolarHBondContact O-CB 3.42Å; E608-F611 PolarHBondContact O-N 3.26Å; E608-Y612 HydrophobicContact CG-CD2 3.85Å; E608-Y612 HydrophobicContact CG-CE2 3.69Å; E608-Y612 WeakPolarHBondContact O-CB 3.44Å; E608-Y612 VanDerWaalsContact O-CD2 3.31Å; E608-Y612 WeakPolarHBondContact O-CD2 3.35Å; E608-Y612 PolarHBondContact O-N 3.2Å; E608-L784 WeakPolarHBondContact OE1-CB 3.3Å; E608-I785 PolarHBondContact OE1-N 2.86Å; E608-P786 WeakPolarHBondContact OE2-CA 3.47Å
609	M	40.9	Very low	42.8	Very low	97.3333 Å²	97.3333	80.5 Å²	80.5	48%	0.479	40%	0.404	S	S	.	.	H	α-helix	trans	-62.5	-30.9	168.9	-163.8	175.8	151.6	0	0	111.3	N605 I606 K613 Y935 V940	N605-M609 WeakPolarHBondContact O-CB 3.41Å; N605-M609 PolarHBondContact O-N 2.79Å; I606-M609 PolarHBondContact O-N 3.48Å; M609-K613 WeakPolarHBondContact O-CA 3.1Å; M609-K613 VanDerWaalsContact O-CB 3.26Å; M609-K613 WeakPolarHBondContact O-CB 3.4Å; M609-K613 VanDerWaalsContact O-CG 3.26Å; M609-K613 WeakPolarHBondContact O-CG 3.34Å; M609-K613 PolarHBondContact O-N 2.96Å; M609-Y935 HydrophobicContact CE-CE2 4.08Å; M609-V940 HydrophobicContact CE-CG1 4.33Å
610	N	41.6	Very low	42.7	Very low	71.6667 Å²	71.6667	85.1 Å²	85.1	38%	0.383	42%	0.419	S	S	.	.	H	α-helix	trans	-75.5	-24.3	168.8	-73.8	-46.9	0	0	0	113.7	I606 I607 E608 K613 K614	I606-N610 VanDerWaalsContact O-CG 3.23Å; I606-N610 PolarHBondContact O-N 3.19Å; I606-N610 PolarHBondContact O-ND2 3.44Å; I607-N610 HydrophobicContact CG2-CB 4.42Å; I607-N610 CarbonylContact O-C 3.57Å; I607-N610 WeakPolarHBondContact O-CA 3.41Å; I607-N610 WeakPolarHBondContact O-CB 3.46Å; I607-N610 PolarHBondContact O-N 3.15Å; E608-N610 PolarHBondContact O-N 3.06Å; N610-K613 CarbonylContact O-C 3.39Å; N610-K614 WeakPolarHBondContact O-CA 3.17Å; N610-K614 VanDerWaalsContact O-CB 3.29Å; N610-K614 WeakPolarHBondContact O-CB 3.29Å; N610-K614 VanDerWaalsContact O-CG 3.24Å; N610-K614 WeakPolarHBondContact O-CG 3.35Å; N610-K614 PolarHBondContact O-N 3.32Å
611	F	41.7	Very low	42.5	Very low	89 Å²	89	87 Å²	87	39%	0.39	43%	0.432	S	S	.	.	H	α-helix	trans	-74.7	-47.9	173.2	173.7	-94.9	0	0	0	109.8	I602 I607 E608 K613 K614 L615	I602-F611 HydrophobicContact CD1-CD1 4.44Å; I602-F611 HydrophobicContact CD1-CE1 4.47Å; I607-F611 WeakPolarHBondContact O-CA 3.45Å; I607-F611 WeakPolarHBondContact O-CB 3.34Å; I607-F611 PolarHBondContact O-N 3.03Å; E608-F611 CarbonylContact O-C 3.56Å; E608-F611 WeakPolarHBondContact O-CA 3.42Å; E608-F611 WeakPolarHBondContact O-CB 3.42Å; E608-F611 PolarHBondContact O-N 3.26Å; F611-K613 VanDerWaalsContact C-N 3.31Å; F611-K613 PolarHBondContact O-N 3.23Å; F611-K614 CarbonylContact O-C 3.56Å; F611-K614 WeakPolarHBondContact O-CA 3.37Å; F611-K614 WeakPolarHBondContact O-CB 3.12Å; F611-K614 PolarHBondContact O-N 3.16Å; F611-K614 VanDerWaalsContact O-N 3.12Å; F611-L615 HydrophobicContact CE1-CB 4.39Å; F611-L615 HydrophobicContact CE1-CD2 4.26Å; F611-L615 HydrophobicContact CZ-CD2 4.49Å; F611-L615 VanDerWaalsContact O-CA 3.3Å; F611-L615 WeakPolarHBondContact O-CA 3.46Å; F611-L615 WeakPolarHBondContact O-CB 3.39Å; F611-L615 PolarHBondContact O-N 2.89Å
612	Y	44.4	Very low	42.3	Very low	102 Å²	102	87.2 Å²	87.2	40%	0.4	44%	0.437	S	S	.	.	H	α-helix	trans	-63	-37	170.5	-71.8	-68.9	0	0	0	111.8	E608 L615 S616	E608-Y612 HydrophobicContact CG-CD2 3.85Å; E608-Y612 HydrophobicContact CG-CE2 3.69Å; E608-Y612 WeakPolarHBondContact O-CB 3.44Å; E608-Y612 VanDerWaalsContact O-CD2 3.31Å; E608-Y612 WeakPolarHBondContact O-CD2 3.35Å; E608-Y612 PolarHBondContact O-N 3.2Å; Y612-L615 HydrophobicContact CD1-CD2 4.46Å; Y612-L615 PolarHBondContact O-N 3.03Å; Y612-S616 VanDerWaalsContact O-CA 3.23Å; Y612-S616 WeakPolarHBondContact O-CA 3.43Å; Y612-S616 VanDerWaalsContact O-CB 3.23Å; Y612-S616 WeakPolarHBondContact O-CB 3.43Å; Y612-S616 PolarHBondContact O-N 2.97Å
613	K	42.1	Very low	42	Very low	91.3333 Å²	91.3333	87.1 Å²	87.1	40%	0.397	45%	0.446	S	S	.	.	H	α-helix	trans	-66.1	-37.8	169.4	-106.9	172.7	179.8	172.5	0	112	M609 N610 F611 S617	M609-K613 WeakPolarHBondContact O-CA 3.1Å; M609-K613 VanDerWaalsContact O-CB 3.26Å; M609-K613 WeakPolarHBondContact O-CB 3.4Å; M609-K613 VanDerWaalsContact O-CG 3.26Å; M609-K613 WeakPolarHBondContact O-CG 3.34Å; M609-K613 PolarHBondContact O-N 2.96Å; N610-K613 CarbonylContact O-C 3.39Å; F611-K613 VanDerWaalsContact C-N 3.31Å; F611-K613 PolarHBondContact O-N 3.23Å; K613-S617 WeakPolarHBondContact O-CA 3.41Å; K613-S617 VanDerWaalsContact O-CB 3.27Å; K613-S617 WeakPolarHBondContact O-CB 3.47Å; K613-S617 PolarHBondContact O-N 3.11Å; K613-S617 PolarHBondContact O-OG 3Å
614	K	42	Very low	42	Very low	140.333 Å²	140.333	86.6 Å²	86.6	61%	0.61	45%	0.445	S	S	*	.	H	α-helix	trans	-70.1	-39.3	174.7	-84.2	174.3	178.2	179.6	0	111.6	N610 F611 S617 I618	N610-K614 WeakPolarHBondContact O-CA 3.17Å; N610-K614 VanDerWaalsContact O-CB 3.29Å; N610-K614 WeakPolarHBondContact O-CB 3.29Å; N610-K614 VanDerWaalsContact O-CG 3.24Å; N610-K614 WeakPolarHBondContact O-CG 3.35Å; N610-K614 PolarHBondContact O-N 3.32Å; F611-K614 CarbonylContact O-C 3.56Å; F611-K614 WeakPolarHBondContact O-CA 3.37Å; F611-K614 WeakPolarHBondContact O-CB 3.12Å; F611-K614 PolarHBondContact O-N 3.16Å; F611-K614 VanDerWaalsContact O-N 3.12Å; K614-S617 CarbonylContact O-C 3.56Å; K614-S617 WeakPolarHBondContact O-CA 3.37Å; K614-S617 WeakPolarHBondContact O-CB 3.39Å; K614-S617 PolarHBondContact O-N 3.13Å; K614-S617 VanDerWaalsContact O-N 3.17Å; K614-I618 VanDerWaalsContact O-CA 3.28Å; K614-I618 WeakPolarHBondContact O-CA 3.27Å; K614-I618 WeakPolarHBondContact O-CB 3.37Å; K614-I618 WeakPolarHBondContact O-CD1 3.3Å; K614-I618 VanDerWaalsContact O-CG1 3.28Å; K614-I618 WeakPolarHBondContact O-CG1 3.35Å; K614-I618 PolarHBondContact O-N 2.98Å
615	L	43	Very low	42	Very low	73.3333 Å²	73.3333	89.1 Å²	89.1	38%	0.384	45%	0.447	S	S	.	.	H	α-helix	trans	-70.7	-46.1	178.3	-173.6	71.3	0	0	0	109.8	F611 Y612 S617 I618 C619	F611-L615 HydrophobicContact CE1-CB 4.39Å; F611-L615 HydrophobicContact CE1-CD2 4.26Å; F611-L615 HydrophobicContact CZ-CD2 4.49Å; F611-L615 VanDerWaalsContact O-CA 3.3Å; F611-L615 WeakPolarHBondContact O-CA 3.46Å; F611-L615 WeakPolarHBondContact O-CB 3.39Å; F611-L615 PolarHBondContact O-N 2.89Å; Y612-L615 HydrophobicContact CD1-CD2 4.46Å; Y612-L615 PolarHBondContact O-N 3.03Å; L615-S617 VanDerWaalsContact C-N 3.31Å; L615-S617 PolarHBondContact O-N 3.08Å; L615-I618 CarbonylContact O-C 3.57Å; L615-I618 PolarHBondContact O-N 3.07Å; L615-I618 VanDerWaalsContact O-N 3.13Å; L615-C619 WeakPolarHBondContact O-CA 3.22Å; L615-C619 WeakPolarHBondContact O-CB 3.49Å; L615-C619 PolarHBondContact O-N 3.2Å; L615-C619 PolarHBondContact O-SG 3.06Å; L615-C619 VanDerWaalsContact O-SG 3.39Å
616	S	43.9	Very low	42	Very low	77.6667 Å²	77.6667	87.7 Å²	87.7	54%	0.543	44%	0.444	S	S	.	.	H	α-helix	trans	-59.7	-41.5	169.1	-179	0	0	0	0	111	Y612 I618 C619 Y620	Y612-S616 VanDerWaalsContact O-CA 3.23Å; Y612-S616 WeakPolarHBondContact O-CA 3.43Å; Y612-S616 VanDerWaalsContact O-CB 3.23Å; Y612-S616 WeakPolarHBondContact O-CB 3.43Å; Y612-S616 PolarHBondContact O-N 2.97Å; S616-I618 VanDerWaalsContact C-N 3.34Å; S616-I618 PolarHBondContact O-N 3.18Å; S616-C619 CarbonylContact O-C 3.52Å; S616-C619 PolarHBondContact O-N 3.19Å; S616-Y620 VanDerWaalsContact O-CA 3.23Å; S616-Y620 WeakPolarHBondContact O-CA 3.31Å; S616-Y620 VanDerWaalsContact O-CB 3.24Å; S616-Y620 WeakPolarHBondContact O-CB 3.4Å; S616-Y620 PolarHBondContact O-N 3.08Å
617	S	42.3	Very low	41.6	Very low	49.6667 Å²	49.6667	87.5 Å²	87.5	35%	0.347	44%	0.438	S	S	.	.	H	α-helix	trans	-68.7	-29.2	173.9	-61.3	0	0	0	0	112.3	K613 K614 L615 Y620 L621	K613-S617 WeakPolarHBondContact O-CA 3.41Å; K613-S617 VanDerWaalsContact O-CB 3.27Å; K613-S617 WeakPolarHBondContact O-CB 3.47Å; K613-S617 PolarHBondContact O-N 3.11Å; K613-S617 PolarHBondContact O-OG 3Å; K614-S617 CarbonylContact O-C 3.56Å; K614-S617 WeakPolarHBondContact O-CA 3.37Å; K614-S617 WeakPolarHBondContact O-CB 3.39Å; K614-S617 PolarHBondContact O-N 3.13Å; K614-S617 VanDerWaalsContact O-N 3.17Å; L615-S617 VanDerWaalsContact C-N 3.31Å; L615-S617 PolarHBondContact O-N 3.08Å; S617-Y620 CarbonylContact O-C 3.55Å; S617-Y620 PolarHBondContact O-N 3.06Å; S617-L621 WeakPolarHBondContact O-CA 3.37Å; S617-L621 WeakPolarHBondContact O-CB 3.37Å; S617-L621 VanDerWaalsContact O-CD1 3.24Å; S617-L621 WeakPolarHBondContact O-CD1 3.37Å; S617-L621 WeakPolarHBondContact O-CG 3.36Å; S617-L621 PolarHBondContact O-N 3.09Å
618	I	43.5	Very low	41.5	Very low	79 Å²	79	85.7 Å²	85.7	41%	0.405	43%	0.431	S	S	.	.	H	α-helix	trans	-74.7	-43.9	174.6	-75.6	160.7	0	0	0	109	K614 L615 S616 Y620 L621 I622	K614-I618 VanDerWaalsContact O-CA 3.28Å; K614-I618 WeakPolarHBondContact O-CA 3.27Å; K614-I618 WeakPolarHBondContact O-CB 3.37Å; K614-I618 WeakPolarHBondContact O-CD1 3.3Å; K614-I618 VanDerWaalsContact O-CG1 3.28Å; K614-I618 WeakPolarHBondContact O-CG1 3.35Å; K614-I618 PolarHBondContact O-N 2.98Å; L615-I618 CarbonylContact O-C 3.57Å; L615-I618 PolarHBondContact O-N 3.07Å; L615-I618 VanDerWaalsContact O-N 3.13Å; S616-I618 VanDerWaalsContact C-N 3.34Å; S616-I618 PolarHBondContact O-N 3.18Å; I618-Y620 VanDerWaalsContact C-N 3.3Å; I618-Y620 PolarHBondContact O-N 2.89Å; I618-L621 CarbonylContact O-C 3.56Å; I618-L621 PolarHBondContact O-N 3.15Å; I618-L621 VanDerWaalsContact O-N 3.16Å; I618-I622 HydrophobicContact CG2-CD1 3.72Å; I618-I622 VanDerWaalsContact CG2-CD1 3.48Å; I618-I622 HydrophobicContact CG2-CG1 4.33Å; I618-I622 VanDerWaalsContact O-CA 3.26Å; I618-I622 WeakPolarHBondContact O-CA 2.97Å; I618-I622 WeakPolarHBondContact O-CB 3.37Å; I618-I622 VanDerWaalsContact O-CD1 3.27Å; I618-I622 WeakPolarHBondContact O-CD1 3.31Å; I618-I622 WeakPolarHBondContact O-CG1 3.39Å; I618-I622 PolarHBondContact O-N 3.08Å
619	C	41.9	Very low	41.4	Very low	64.3333 Å²	64.3333	87.3 Å²	87.3	44%	0.435	44%	0.441	S	S	.	.	H	α-helix	trans	-65.9	-35.4	173.9	-65.6	0	0	0	0	111.6	L615 S616 I622 G623	L615-C619 WeakPolarHBondContact O-CA 3.22Å; L615-C619 WeakPolarHBondContact O-CB 3.49Å; L615-C619 PolarHBondContact O-N 3.2Å; L615-C619 PolarHBondContact O-SG 3.06Å; L615-C619 VanDerWaalsContact O-SG 3.39Å; S616-C619 CarbonylContact O-C 3.52Å; S616-C619 PolarHBondContact O-N 3.19Å; C619-I622 PolarHBondContact O-N 3.18Å; C619-G623 WeakPolarHBondContact O-CA 3.35Å; C619-G623 PolarHBondContact O-N 3.08Å
620	Y	42.8	Very low	41.1	Very low	156.333 Å²	156.333	88.8 Å²	88.8	61%	0.613	44%	0.442	S	S	*	.	H	α-helix	trans	-76.8	-31.9	173.7	-179.6	-110.9	0	0	0	112	S616 S617 I618 G623 I624	S616-Y620 VanDerWaalsContact O-CA 3.23Å; S616-Y620 WeakPolarHBondContact O-CA 3.31Å; S616-Y620 VanDerWaalsContact O-CB 3.24Å; S616-Y620 WeakPolarHBondContact O-CB 3.4Å; S616-Y620 PolarHBondContact O-N 3.08Å; S617-Y620 CarbonylContact O-C 3.55Å; S617-Y620 PolarHBondContact O-N 3.06Å; I618-Y620 VanDerWaalsContact C-N 3.3Å; I618-Y620 PolarHBondContact O-N 2.89Å; Y620-G623 CarbonylContact O-C 3.54Å; Y620-G623 PolarHBondContact O-N 3.41Å; Y620-I624 HydrophobicContact CD1-CD1 3.72Å; Y620-I624 VanDerWaalsContact CD1-CD1 3.44Å; Y620-I624 HydrophobicContact CD1-CG1 3.99Å; Y620-I624 HydrophobicContact CD2-CD1 4.42Å; Y620-I624 HydrophobicContact CD2-CG1 4.05Å; Y620-I624 HydrophobicContact CE1-CD1 3.22Å; Y620-I624 HydrophobicContact CE1-CG1 4.15Å; Y620-I624 HydrophobicContact CE2-CD1 4.13Å; Y620-I624 HydrophobicContact CE2-CG1 4.03Å; Y620-I624 HydrophobicContact CG-CD1 4.25Å; Y620-I624 HydrophobicContact CG-CG1 4.16Å; Y620-I624 WeakPolarHBondContact O-CA 3.36Å; Y620-I624 VanDerWaalsContact O-CB 3.31Å; Y620-I624 WeakPolarHBondContact O-CB 3.43Å; Y620-I624 WeakPolarHBondContact O-CD1 3.2Å; Y620-I624 VanDerWaalsContact O-CG1 3.31Å; Y620-I624 WeakPolarHBondContact O-CG1 3.34Å; Y620-I624 PolarHBondContact O-N 3.32Å; Y620-I624 WeakPolarHBondContact OH-CD1 3.36Å
621	L	41.6	Very low	40.7	Very low	104.667 Å²	104.667	88 Å²	88	55%	0.548	44%	0.438	S	S	.	.	H	α-helix	trans	-76.9	-26.7	170.5	-77.2	166.6	0	0	0	111.5	S617 I618 I624 W625	S617-L621 WeakPolarHBondContact O-CA 3.37Å; S617-L621 WeakPolarHBondContact O-CB 3.37Å; S617-L621 VanDerWaalsContact O-CD1 3.24Å; S617-L621 WeakPolarHBondContact O-CD1 3.37Å; S617-L621 WeakPolarHBondContact O-CG 3.36Å; S617-L621 PolarHBondContact O-N 3.09Å; I618-L621 CarbonylContact O-C 3.56Å; I618-L621 PolarHBondContact O-N 3.15Å; I618-L621 VanDerWaalsContact O-N 3.16Å; L621-I624 PolarHBondContact O-N 2.91Å; L621-W625 VanDerWaalsContact C-N 3.26Å; L621-W625 WeakPolarHBondContact O-CA 3.47Å; L621-W625 VanDerWaalsContact O-CB 3.29Å; L621-W625 WeakPolarHBondContact O-CB 3.43Å; L621-W625 PolarHBondContact O-N 3.07Å
622	I	42.1	Very low	40.5	Very low	79.3333 Å²	79.3333	89.4 Å²	89.4	41%	0.407	45%	0.449	S	S	.	.	H	α-helix	trans	-74.8	-40.8	168.4	-71.6	163.7	0	0	0	108.5	I618 C619 I624 W625 C626	I618-I622 HydrophobicContact CG2-CD1 3.72Å; I618-I622 VanDerWaalsContact CG2-CD1 3.48Å; I618-I622 HydrophobicContact CG2-CG1 4.33Å; I618-I622 VanDerWaalsContact O-CA 3.26Å; I618-I622 WeakPolarHBondContact O-CA 2.97Å; I618-I622 WeakPolarHBondContact O-CB 3.37Å; I618-I622 VanDerWaalsContact O-CD1 3.27Å; I618-I622 WeakPolarHBondContact O-CD1 3.31Å; I618-I622 WeakPolarHBondContact O-CG1 3.39Å; I618-I622 PolarHBondContact O-N 3.08Å; C619-I622 PolarHBondContact O-N 3.18Å; I622-I624 PolarHBondContact O-N 2.7Å; I622-W625 PolarHBondContact O-N 3.11Å; I622-W625 VanDerWaalsContact O-N 3.08Å; I622-C626 WeakPolarHBondContact O-CA 3.47Å; I622-C626 WeakPolarHBondContact O-CB 3.35Å; I622-C626 PolarHBondContact O-N 3.21Å; I622-C626 PolarHBondContact O-SG 3.26Å; I622-C626 VanDerWaalsContact O-SG 3.36Å
623	G	40.5	Very low	39.9	Very low	38.6667 Å²	38.6667	87.2 Å²	87.2	40%	0.399	45%	0.449	S	S	.	.	H	α-helix	trans	-64.5	-44.9	173.4	0	0	0	0	0	112.1	C619 Y620 C626 K627	C619-G623 WeakPolarHBondContact O-CA 3.35Å; C619-G623 PolarHBondContact O-N 3.08Å; Y620-G623 CarbonylContact O-C 3.54Å; Y620-G623 PolarHBondContact O-N 3.41Å; G623-C626 CarbonylContact O-C 3.51Å; G623-K627 WeakPolarHBondContact O-CA 3.46Å; G623-K627 VanDerWaalsContact O-CB 3.27Å; G623-K627 WeakPolarHBondContact O-CB 3.39Å; G623-K627 PolarHBondContact O-N 3.16Å
624	I	42.1	Very low	39.2	Very low	53.3333 Å²	53.3333	87.3 Å²	87.3	27%	0.274	45%	0.454	S	S	.	.	H	α-helix	trans	-63.9	-46.5	168.7	-75.1	173.6	0	0	0	109.9	Y620 L621 I622 C626 K627 T628	Y620-I624 HydrophobicContact CD1-CD1 3.72Å; Y620-I624 VanDerWaalsContact CD1-CD1 3.44Å; Y620-I624 HydrophobicContact CD1-CG1 3.99Å; Y620-I624 HydrophobicContact CD2-CD1 4.42Å; Y620-I624 HydrophobicContact CD2-CG1 4.05Å; Y620-I624 HydrophobicContact CE1-CD1 3.22Å; Y620-I624 HydrophobicContact CE1-CG1 4.15Å; Y620-I624 HydrophobicContact CE2-CD1 4.13Å; Y620-I624 HydrophobicContact CE2-CG1 4.03Å; Y620-I624 HydrophobicContact CG-CD1 4.25Å; Y620-I624 HydrophobicContact CG-CG1 4.16Å; Y620-I624 WeakPolarHBondContact O-CA 3.36Å; Y620-I624 VanDerWaalsContact O-CB 3.31Å; Y620-I624 WeakPolarHBondContact O-CB 3.43Å; Y620-I624 WeakPolarHBondContact O-CD1 3.2Å; Y620-I624 VanDerWaalsContact O-CG1 3.31Å; Y620-I624 WeakPolarHBondContact O-CG1 3.34Å; Y620-I624 PolarHBondContact O-N 3.32Å; Y620-I624 WeakPolarHBondContact OH-CD1 3.36Å; L621-I624 PolarHBondContact O-N 2.91Å; I622-I624 PolarHBondContact O-N 2.7Å; I624-C626 CarbonylContact O-C 3.5Å; I624-C626 PolarHBondContact O-N 2.95Å; I624-K627 CarbonylContact O-C 3.51Å; I624-K627 WeakPolarHBondContact O-CA 3.43Å; I624-K627 PolarHBondContact O-N 3.21Å; I624-T628 HydrophobicContact CG2-CG2 3.97Å; I624-T628 WeakPolarHBondContact CG2-OG1 3.31Å; I624-T628 WeakPolarHBondContact O-CA 3.45Å; I624-T628 WeakPolarHBondContact O-CB 3.37Å; I624-T628 WeakPolarHBondContact O-CG2 3.29Å; I624-T628 PolarHBondContact O-N 3.16Å; I624-T628 PolarHBondContact O-OG1 3.23Å; I624-T628 VanDerWaalsContact O-OG1 3.09Å
625	W	40.9	Very low	38.6	Very low	152.667 Å²	152.667	85.2 Å²	85.2	58%	0.578	46%	0.456	S	S	*	.	H	α-helix	trans	-62.8	-41.9	-179.8	-177.9	68.5	0	0	0	111.5	L621 I622 K627 T628 L629	L621-W625 VanDerWaalsContact C-N 3.26Å; L621-W625 WeakPolarHBondContact O-CA 3.47Å; L621-W625 VanDerWaalsContact O-CB 3.29Å; L621-W625 WeakPolarHBondContact O-CB 3.43Å; L621-W625 PolarHBondContact O-N 3.07Å; I622-W625 PolarHBondContact O-N 3.11Å; I622-W625 VanDerWaalsContact O-N 3.08Å; W625-K627 VanDerWaalsContact C-N 3.32Å; W625-K627 PolarHBondContact O-N 2.97Å; W625-T628 WeakPolarHBondContact CA-OG1 3.32Å; W625-T628 CarbonylContact O-C 3.59Å; W625-T628 PolarHBondContact O-N 3.13Å; W625-T628 VanDerWaalsContact O-N 3.15Å; W625-T628 PolarHBondContact O-OG1 3.01Å; W625-L629 HydrophobicContact CD2-CD1 3.84Å; W625-L629 HydrophobicContact CD2-CG 4.31Å; W625-L629 HydrophobicContact CE3-CD1 3.79Å; W625-L629 HydrophobicContact CG-CD1 4.22Å; W625-L629 HydrophobicContact CG-CG 4.25Å; W625-L629 HydrophobicContact CH2-CD1 4.13Å; W625-L629 HydrophobicContact CZ2-CD1 3.91Å; W625-L629 HydrophobicContact CZ3-CD1 3.96Å; W625-L629 WeakPolarHBondContact O-CA 3.5Å; W625-L629 VanDerWaalsContact O-CB 3.29Å; W625-L629 WeakPolarHBondContact O-CB 3.41Å; W625-L629 WeakPolarHBondContact O-CD1 3.12Å; W625-L629 WeakPolarHBondContact O-CG 3.45Å; W625-L629 PolarHBondContact O-N 2.91Å
626	C	39.9	Very low	37.9	Very low	60 Å²	60	89 Å²	89	41%	0.405	48%	0.475	S	S	.	.	H	α-helix	trans	-62.4	-39.5	169.8	-68.5	0	0	0	0	112	I622 G623 I624 T628 L629 Y630	I622-C626 WeakPolarHBondContact O-CA 3.47Å; I622-C626 WeakPolarHBondContact O-CB 3.35Å; I622-C626 PolarHBondContact O-N 3.21Å; I622-C626 PolarHBondContact O-SG 3.26Å; I622-C626 VanDerWaalsContact O-SG 3.36Å; G623-C626 CarbonylContact O-C 3.51Å; I624-C626 CarbonylContact O-C 3.5Å; I624-C626 PolarHBondContact O-N 2.95Å; C626-T628 PolarHBondContact O-N 3.05Å; C626-L629 WeakPolarHBondContact O-CB 3.42Å; C626-L629 PolarHBondContact O-N 2.86Å; C626-Y630 VanDerWaalsContact O-CB 3.28Å; C626-Y630 WeakPolarHBondContact O-CB 3.4Å; C626-Y630 PolarHBondContact O-N 3.3Å; C626-Y630 VanDerWaalsContact O-N 3.1Å
627	K	37.2	Very low	37.1	Very low	126 Å²	126	91.7 Å²	91.7	55%	0.548	48%	0.483	S	S	.	.	H	α-helix	trans	-72.6	-46.4	175.4	-176.1	174.7	177	178.9	0	113.6	G623 I624 W625 L629 Y630 D631	G623-K627 WeakPolarHBondContact O-CA 3.46Å; G623-K627 VanDerWaalsContact O-CB 3.27Å; G623-K627 WeakPolarHBondContact O-CB 3.39Å; G623-K627 PolarHBondContact O-N 3.16Å; I624-K627 CarbonylContact O-C 3.51Å; I624-K627 WeakPolarHBondContact O-CA 3.43Å; I624-K627 PolarHBondContact O-N 3.21Å; W625-K627 VanDerWaalsContact C-N 3.32Å; W625-K627 PolarHBondContact O-N 2.97Å; K627-L629 VanDerWaalsContact C-N 3.29Å; K627-L629 PolarHBondContact O-N 3.16Å; K627-Y630 VanDerWaalsContact CA-CB 3.49Å; K627-Y630 CarbonylContact O-C 3.49Å; K627-Y630 WeakPolarHBondContact O-CA 3.38Å; K627-Y630 VanDerWaalsContact O-CB 3.31Å; K627-Y630 WeakPolarHBondContact O-CB 3.33Å; K627-Y630 PolarHBondContact O-N 3.33Å; K627-Y630 VanDerWaalsContact O-N 3.12Å; K627-D631 VanDerWaalsContact CE-CG 3.46Å; K627-D631 VanDerWaalsContact CE-OD1 3.29Å; K627-D631 WeakPolarHBondContact CE-OD1 2.84Å; K627-D631 VanDerWaalsContact CE-OD2 3.28Å; K627-D631 WeakPolarHBondContact CE-OD2 3.43Å; K627-D631 VanDerWaalsContact CG-OD2 3.29Å; K627-D631 WeakPolarHBondContact CG-OD2 3.26Å; K627-D631 IonicContact NZ-OD2 2.74Å; K627-D631 WeakPolarHBondContact O-CA 3.41Å; K627-D631 WeakPolarHBondContact O-CB 3.32Å; K627-D631 PolarHBondContact O-N 3.12Å
628	T	38	Very low	36.3	Very low	52.3333 Å²	52.3333	95.5 Å²	95.5	32%	0.321	50%	0.499	S	S	.	.	H	α-helix	trans	-47.1	-44.8	159.3	65.6	0	0	0	0	115	I624 W625 C626 Y630 D631 N632	I624-T628 HydrophobicContact CG2-CG2 3.97Å; I624-T628 WeakPolarHBondContact CG2-OG1 3.31Å; I624-T628 WeakPolarHBondContact O-CA 3.45Å; I624-T628 WeakPolarHBondContact O-CB 3.37Å; I624-T628 WeakPolarHBondContact O-CG2 3.29Å; I624-T628 PolarHBondContact O-N 3.16Å; I624-T628 PolarHBondContact O-OG1 3.23Å; I624-T628 VanDerWaalsContact O-OG1 3.09Å; W625-T628 WeakPolarHBondContact CA-OG1 3.32Å; W625-T628 CarbonylContact O-C 3.59Å; W625-T628 PolarHBondContact O-N 3.13Å; W625-T628 VanDerWaalsContact O-N 3.15Å; W625-T628 PolarHBondContact O-OG1 3.01Å; C626-T628 PolarHBondContact O-N 3.05Å; T628-Y630 VanDerWaalsContact C-N 3.29Å; T628-Y630 PolarHBondContact O-N 3.43Å; T628-D631 PolarHBondContact O-N 3.36Å; T628-N632 HydrophobicContact CG2-CB 3.95Å; T628-N632 WeakPolarHBondContact CG2-ND2 3.4Å; T628-N632 VanDerWaalsContact O-CA 3.3Å; T628-N632 WeakPolarHBondContact O-CA 3.33Å; T628-N632 WeakPolarHBondContact O-CB 3.33Å; T628-N632 PolarHBondContact O-N 3.08Å; T628-N632 PolarHBondContact O-ND2 3.24Å
629	L	37.1	Very low	35.5	Very low	74.6667 Å²	74.6667	100.9 Å²	100.9	39%	0.391	52%	0.523	S	S	.	.	H	α-helix	trans	-67	-32.1	169	-72.5	168.3	0	0	0	111.1	W625 C626 K627 S633	W625-L629 HydrophobicContact CD2-CD1 3.84Å; W625-L629 HydrophobicContact CD2-CG 4.31Å; W625-L629 HydrophobicContact CE3-CD1 3.79Å; W625-L629 HydrophobicContact CG-CD1 4.22Å; W625-L629 HydrophobicContact CG-CG 4.25Å; W625-L629 HydrophobicContact CH2-CD1 4.13Å; W625-L629 HydrophobicContact CZ2-CD1 3.91Å; W625-L629 HydrophobicContact CZ3-CD1 3.96Å; W625-L629 WeakPolarHBondContact O-CA 3.5Å; W625-L629 VanDerWaalsContact O-CB 3.29Å; W625-L629 WeakPolarHBondContact O-CB 3.41Å; W625-L629 WeakPolarHBondContact O-CD1 3.12Å; W625-L629 WeakPolarHBondContact O-CG 3.45Å; W625-L629 PolarHBondContact O-N 2.91Å; C626-L629 WeakPolarHBondContact O-CB 3.42Å; C626-L629 PolarHBondContact O-N 2.86Å; K627-L629 VanDerWaalsContact C-N 3.29Å; K627-L629 PolarHBondContact O-N 3.16Å; L629-S633 WeakPolarHBondContact O-CB 3.21Å; L629-S633 PolarHBondContact O-N 2.94Å; L629-S633 PolarHBondContact O-OG 3.36Å
630	Y	35.1	Very low	34.6	Very low	127.667 Å²	127.667	102.7 Å²	102.7	50%	0.501	54%	0.536	S	S	.	.	H	α-helix	trans	-74.3	-43.5	174.1	-168.6	-92.2	0	0	0	112.7	C626 K627 T628 N632 S633 N634 L813 K814 P1012	C626-Y630 VanDerWaalsContact O-CB 3.28Å; C626-Y630 WeakPolarHBondContact O-CB 3.4Å; C626-Y630 PolarHBondContact O-N 3.3Å; C626-Y630 VanDerWaalsContact O-N 3.1Å; K627-Y630 VanDerWaalsContact CA-CB 3.49Å; K627-Y630 CarbonylContact O-C 3.49Å; K627-Y630 WeakPolarHBondContact O-CA 3.38Å; K627-Y630 VanDerWaalsContact O-CB 3.31Å; K627-Y630 WeakPolarHBondContact O-CB 3.33Å; K627-Y630 PolarHBondContact O-N 3.33Å; K627-Y630 VanDerWaalsContact O-N 3.12Å; T628-Y630 VanDerWaalsContact C-N 3.29Å; T628-Y630 PolarHBondContact O-N 3.43Å; Y630-N632 VanDerWaalsContact C-N 3.34Å; Y630-N632 PolarHBondContact O-N 3.22Å; Y630-S633 WeakPolarHBondContact O-CB 3.34Å; Y630-S633 PolarHBondContact O-N 3.07Å; Y630-S633 PolarHBondContact O-OG 3.19Å; Y630-N634 VanDerWaalsContact CE1-ND2 3.31Å; Y630-N634 WeakPolarHBondContact CE1-ND2 3.35Å; Y630-N634 VanDerWaalsContact CZ-ND2 3.34Å; Y630-N634 PolarHBondContact O-N 3.48Å; Y630-N634 PolarHBondContact O-ND2 3.48Å; Y630-L813 PolarHBondContact OH-O 3.32Å; Y630-L813 VanDerWaalsContact OH-O 3.13Å; Y630-K814 PolarHBondContact OH-O 2.91Å; Y630-P1012 HydrophobicContact CD2-CG 4.34Å
631	D	33.7	Very low	33.7	Very low	55.6667 Å²	55.6667	102.7 Å²	102.7	30%	0.298	55%	0.546	S	S	.	.	H	α-helix	trans	-82.6	-44	-172.8	-69.9	-18.3	0	0	0	111.2	K627 T628 S633 N634 C635	K627-D631 VanDerWaalsContact CE-CG 3.46Å; K627-D631 VanDerWaalsContact CE-OD1 3.29Å; K627-D631 WeakPolarHBondContact CE-OD1 2.84Å; K627-D631 VanDerWaalsContact CE-OD2 3.28Å; K627-D631 WeakPolarHBondContact CE-OD2 3.43Å; K627-D631 VanDerWaalsContact CG-OD2 3.29Å; K627-D631 WeakPolarHBondContact CG-OD2 3.26Å; K627-D631 IonicContact NZ-OD2 2.74Å; K627-D631 WeakPolarHBondContact O-CA 3.41Å; K627-D631 WeakPolarHBondContact O-CB 3.32Å; K627-D631 PolarHBondContact O-N 3.12Å; T628-D631 PolarHBondContact O-N 3.36Å; D631-S633 PolarHBondContact O-N 3.07Å; D631-S633 VanDerWaalsContact O-N 3.16Å; D631-N634 VanDerWaalsContact O-CB 3.3Å; D631-N634 WeakPolarHBondContact O-CB 3.3Å; D631-N634 PolarHBondContact O-N 2.96Å; D631-N634 VanDerWaalsContact O-N 3.11Å; D631-N634 PolarHBondContact O-ND2 3.42Å; D631-C635 WeakPolarHBondContact O-CB 3.44Å; D631-C635 PolarHBondContact O-N 3.24Å; D631-C635 PolarHBondContact O-SG 3.4Å; D631-C635 VanDerWaalsContact O-SG 3.37Å
632	N	35.9	Very low	32.8	Very low	118.667 Å²	118.667	105.5 Å²	105.5	64%	0.635	56%	0.558	S	S	*	*	H	α-helix	trans	-71.7	-12.2	177	-74.1	-8.8	0	0	0	113.6	T628 Y630 N634 C635	T628-N632 HydrophobicContact CG2-CB 3.95Å; T628-N632 WeakPolarHBondContact CG2-ND2 3.4Å; T628-N632 VanDerWaalsContact O-CA 3.3Å; T628-N632 WeakPolarHBondContact O-CA 3.33Å; T628-N632 WeakPolarHBondContact O-CB 3.33Å; T628-N632 PolarHBondContact O-N 3.08Å; T628-N632 PolarHBondContact O-ND2 3.24Å; Y630-N632 VanDerWaalsContact C-N 3.34Å; Y630-N632 PolarHBondContact O-N 3.22Å; N632-N634 VanDerWaalsContact C-N 3.35Å; N632-N634 PolarHBondContact O-N 3.48Å; N632-C635 PolarHBondContact O-N 3.32Å
633	S	32.4	Very low	32	Very low	55.6667 Å²	55.6667	106.6 Å²	106.6	39%	0.389	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.2	-5.3	167.7	70.9	0	0	0	0	113.3	L629 Y630 D631 R672 Y1010	L629-S633 WeakPolarHBondContact O-CB 3.21Å; L629-S633 PolarHBondContact O-N 2.94Å; L629-S633 PolarHBondContact O-OG 3.36Å; Y630-S633 WeakPolarHBondContact O-CB 3.34Å; Y630-S633 PolarHBondContact O-N 3.07Å; Y630-S633 PolarHBondContact O-OG 3.19Å; D631-S633 PolarHBondContact O-N 3.07Å; D631-S633 VanDerWaalsContact O-N 3.16Å; S633-R672 PolarHBondContact O-NH1 3.13Å; S633-R672 PolarHBondContact OG-NE 3.05Å; S633-R672 PolarHBondContact OG-NH1 2.86Å; S633-R672 VanDerWaalsContact OG-NH1 3.13Å; S633-R672 PolarHBondContact OG-NH2 3.34Å; S633-R672 VanDerWaalsContact OG-NH2 3.13Å; S633-Y1010 WeakPolarHBondContact CB-O 3.17Å; S633-Y1010 PolarHBondContact OG-O 3.25Å
634	N	28.1	Very low	31.2	Very low	92.6667 Å²	92.6667	112.1 Å²	112.1	50%	0.496	59%	0.588	S	S	.	*	H	α-helix	trans	-100.5	12.7	170.3	-68.4	-46.4	0	0	0	111.8	Y630 D631 N632 I636 N637 R672	Y630-N634 VanDerWaalsContact CE1-ND2 3.31Å; Y630-N634 WeakPolarHBondContact CE1-ND2 3.35Å; Y630-N634 VanDerWaalsContact CZ-ND2 3.34Å; Y630-N634 PolarHBondContact O-N 3.48Å; Y630-N634 PolarHBondContact O-ND2 3.48Å; D631-N634 VanDerWaalsContact O-CB 3.3Å; D631-N634 WeakPolarHBondContact O-CB 3.3Å; D631-N634 PolarHBondContact O-N 2.96Å; D631-N634 VanDerWaalsContact O-N 3.11Å; D631-N634 PolarHBondContact O-ND2 3.42Å; N632-N634 VanDerWaalsContact C-N 3.35Å; N632-N634 PolarHBondContact O-N 3.48Å; N634-I636 PolarHBondContact O-N 3.06Å; N634-N637 PolarHBondContact O-N 2.87Å; N634-R672 PolarHBondContact OD1-NH2 3.02Å
635	C	28.4	Very low	30.3	Very low	96.3333 Å²	96.3333	114.6 Å²	114.6	65%	0.651	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	31.6	-176.7	-68.2	0	0	0	0	115.3	D631 N632	D631-C635 WeakPolarHBondContact O-CB 3.44Å; D631-C635 PolarHBondContact O-N 3.24Å; D631-C635 PolarHBondContact O-SG 3.4Å; D631-C635 VanDerWaalsContact O-SG 3.37Å; N632-C635 PolarHBondContact O-N 3.32Å
636	I	29.3	Very low	29.4	Very low	153 Å²	153	114.2 Å²	114.2	79%	0.785	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.7	66.2	154.7	-67.8	163.5	0	0	0	108.9	N634	N634-I636 PolarHBondContact O-N 3.06Å
637	N	26.4	Very low	28.6	Very low	135 Å²	135	118.5 Å²	118.5	72%	0.722	63%	0.633	S	S	*	*			trans	-137.5	86	169.1	-105.3	-1	0	0	0	111.4	N634	N634-N637 PolarHBondContact O-N 2.87Å
638	N	25.1	Very low	27.9	Very low	128.667 Å²	128.667	120.3 Å²	120.3	69%	0.688	64%	0.643	S	S	*	*			trans	171.5	100.5	164	-80	-32.9	0	0	0	114.1
639	Q	26.2	Very low	27.1	Very low	193.333 Å²	193.333	124.8 Å²	124.8	90%	0.903	67%	0.665	S	S	*	*			trans	177.4	128	144.6	-96.5	166.6	18.4	0	0	113.5
640	S	23.3	Very low	26.4	Very low	102.333 Å²	102.333	130.1 Å²	130.1	72%	0.716	69%	0.685	S	S	*	*			trans	-109.6	158.8	-157.1	48	0	0	0	0	111.2
641	I	24.6	Very low	25.8	Very low	156.667 Å²	156.667	130.9 Å²	130.9	80%	0.803	70%	0.698	S	S	*	*			trans	75.9	126.4	165.9	-60.9	160.7	0	0	0	115.4	P643	I641-P643 HydrophobicContact CG2-CB 4.26Å; I641-P643 HydrophobicContact CG2-CG 4.22Å
642	M	22	Very low	25.3	Very low	163.667 Å²	163.667	133.6 Å²	133.6	81%	0.806	72%	0.72	S	S	*	*			trans	-138.7	140.7	152.4	-112.2	-118.7	144.2	0	0	113.4	I644	M642-I644 HydrophobicContact CE-CD1 4.35Å
643	P	25.5	Very low	24.8	Very low	100.667 Å²	100.667	133.5 Å²	133.5	65%	0.654	73%	0.725	S	S	*	*			trans	-119.3	145	160	38.7	-25.5	0	0	0	114.6	I641	I641-P643 HydrophobicContact CG2-CB 4.26Å; I641-P643 HydrophobicContact CG2-CG 4.22Å
644	I	24.9	Very low	24.4	Very low	155 Å²	155	140 Å²	140	80%	0.795	75%	0.747	S	S	*	*			trans	-123.9	134.6	160.1	-69.5	173.5	0	0	0	112.3	M642	M642-I644 HydrophobicContact CE-CD1 4.35Å
645	T	21.8	Very low	24.2	Very low	106 Å²	106	145.2 Å²	145.2	65%	0.65	77%	0.765	S	S	*	*			trans	-117.6	162	-152.4	43.3	0	0	0	0	112.6
646	N	22.2	Very low	24	Very low	143.333 Å²	143.333	147.3 Å²	147.3	77%	0.766	77%	0.77	S	S	*	*			trans	73.3	146.5	151.9	-61.2	-5.7	0	0	0	119.1
647	I	24.3	Very low	23.9	Very low	151.667 Å²	151.667	147.3 Å²	147.3	78%	0.778	77%	0.77	S	S	*	*			trans	-145	139.2	152.1	-93	156.2	0	0	0	108.1
648	E	20.8	Very low	23.8	Very low	163 Å²	163	148.2 Å²	148.2	76%	0.762	77%	0.774	S	S	*	*			trans	41.2	140.2	147.2	-86.6	174.4	-168.2	0	0	116
649	L	22.2	Very low	23.8	Very low	147 Å²	147	146.9 Å²	146.9	77%	0.77	78%	0.776	S	S	*	*				-107.3	171.4	93.3	-94.7	102.8	0	0	0	112.3
650	F	22.2	Very low	23.7	Very low	186.333 Å²	186.333	147.7 Å²	147.7	82%	0.817	78%	0.776	S	S	*	*			trans	-139.1	149.2	153.3	-112.2	-62.5	0	0	0	110.8
651	N	23.7	Very low	23.7	Very low	144 Å²	144	150.7 Å²	150.7	77%	0.77	78%	0.779	S	S	*	*			trans	-136	154.7	143.6	-107.3	-34	0	0	0	112
652	C	22.4	Very low	23.5	Very low	113 Å²	113	151.6 Å²	151.6	76%	0.764	78%	0.777	S	S	*	*			trans	-146.1	148.4	165.3	-97.2	0	0	0	0	112.3
653	P	25.9	Very low	23.6	Very low	115.333 Å²	115.333	150.7 Å²	150.7	75%	0.749	78%	0.776	S	S	*	*			trans	-128.1	150.4	148.2	36.4	-25	0	0	0	115.7
654	K	23	Very low	23.6	Very low	192.667 Å²	192.667	153.2 Å²	153.2	84%	0.838	78%	0.783	S	S	*	*			trans	77.4	116.5	141.4	-80.6	175	-179	176.1	0	115.7
655	K	24.9	Very low	23.5	Very low	201.667 Å²	201.667	153.8 Å²	153.8	88%	0.877	78%	0.784	S	S	*	*				-174.1	126	124.2	-101.8	165.2	-176.1	179.3	0	111.2
656	N	24.1	Very low	23.7	Very low	142 Å²	142	154.1 Å²	154.1	76%	0.759	79%	0.786	S	S	*	*			trans	31.9	126.7	139.4	-66.2	0.1	0	0	0	114.4
657	I	27	Very low	23.9	Very low	153 Å²	153	155.2 Å²	155.2	79%	0.785	79%	0.787	S	S	*	*				174.8	123.3	101.4	-72.3	164.8	0	0	0	111	S659	I657-S659 PolarHBondContact O-N 3.36Å
658	N	24.6	Very low	24.1	Very low	152 Å²	152	156.4 Å²	156.4	81%	0.813	79%	0.789	S	S	*	*			trans	-96.6	129.9	140.1	-80.5	-9.2	0	0	0	114.2
659	S	24.2	Very low	24.4	Very low	103 Å²	103	151.9 Å²	151.9	72%	0.72	78%	0.776	S	S	*	*			trans	-153.1	117.1	158.3	59.6	0	0	0	0	114.5	I657 Q661	I657-S659 PolarHBondContact O-N 3.36Å; S659-Q661 VanDerWaalsContact C-N 3.26Å; S659-Q661 PolarHBondContact O-N 3.06Å
660	K	24.4	Very low	24.8	Very low	210 Å²	210	149.9 Å²	149.9	91%	0.913	77%	0.765	S	S	*	*			trans	-90.1	140.3	150.2	-85.5	178.8	177.4	179.1	0	109.4
661	Q	22.3	Very low	25.6	Very low	163.667 Å²	163.667	144.8 Å²	144.8	77%	0.765	75%	0.753	S	S	*	*			trans	-104.5	129.7	173.8	-124.6	176.5	-8.3	0	0	113	S659 N663	S659-Q661 VanDerWaalsContact C-N 3.26Å; S659-Q661 PolarHBondContact O-N 3.06Å; Q661-N663 PolarHBondContact O-N 3.02Å
662	F	22	Very low	26.1	Very low	175.667 Å²	175.667	145.3 Å²	145.3	77%	0.77	74%	0.744	S	S	*	*			trans	-25.6	131.6	147.2	-91.1	-84.1	0	0	0	115.3	L664	F662-L664 PolarHBondContact O-N 3.31Å; F662-L664 VanDerWaalsContact O-N 3.1Å
663	N	24.4	Very low	26.8	Very low	146.333 Å²	146.333	148.7 Å²	148.7	78%	0.783	74%	0.741	S	S	*	*			trans	-107.8	107.1	146.9	-91.5	-27.2	0	0	0	113.5	Q661 M665 T666	Q661-N663 PolarHBondContact O-N 3.02Å; N663-M665 HydrophobicContact CB-CB 4.44Å; N663-M665 PolarHBondContact O-N 3.02Å; N663-T666 PolarHBondContact O-OG1 2.68Å
664	L	24	Very low	27.5	Very low	153.333 Å²	153.333	149.9 Å²	149.9	80%	0.803	73%	0.734	S	S	*	*			trans	-101.4	42.3	171.6	-162.9	96.6	0	0	0	111.3	F662 T666	F662-L664 PolarHBondContact O-N 3.31Å; F662-L664 VanDerWaalsContact O-N 3.1Å; L664-T666 PolarHBondContact O-N 3.2Å
665	M	22.4	Very low	28.4	Very low	167 Å²	167	146.9 Å²	146.9	82%	0.823	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.3	78	170.1	-86.4	-88.2	178.7	0	0	110.3	N663	N663-M665 HydrophobicContact CB-CB 4.44Å; N663-M665 PolarHBondContact O-N 3.02Å
666	T	26.3	Very low	29.2	Very low	113 Å²	113	142.2 Å²	142.2	69%	0.693	70%	0.701	S	S	*	*	H	α-helix	trans	-177.3	16.9	170.4	41.7	0	0	0	0	114	N663 L664 S669 L670	N663-T666 PolarHBondContact O-OG1 2.68Å; L664-T666 PolarHBondContact O-N 3.2Å; T666-S669 PolarHBondContact O-N 2.95Å; T666-S669 PolarHBondContact O-OG 2.62Å; T666-L670 PolarHBondContact O-N 3.42Å
667	Q	27.4	Very low	30.1	Very low	164.667 Å²	164.667	142.9 Å²	142.9	77%	0.769	69%	0.693	S	S	*	*	H	α-helix	trans	-96.4	-20	179.7	-110.3	179.8	-4.4	0	0	115.2	S669 L670 S671	Q667-S669 VanDerWaalsContact C-N 3.3Å; Q667-S669 PolarHBondContact O-N 3.33Å; Q667-L670 VanDerWaalsContact O-CB 3.31Å; Q667-L670 WeakPolarHBondContact O-CB 3.19Å; Q667-L670 PolarHBondContact O-N 3.23Å; Q667-S671 PolarHBondContact O-N 3.25Å
668	E	27.2	Very low	31	Very low	177.667 Å²	177.667	141.4 Å²	141.4	83%	0.83	68%	0.681	S	S	*	*	H	α-helix	trans	-83.3	-8.9	-176.3	-65.7	-168.9	142.6	0	0	114.2	L670 S671 R672	E668-L670 PolarHBondContact O-N 3.41Å; E668-S671 PolarHBondContact O-OG 3.13Å; E668-R672 PolarHBondContact O-N 2.71Å
669	S	28.9	Very low	32	Very low	69 Å²	69	135.4 Å²	135.4	48%	0.483	65%	0.649	S	S	.	*			trans	-85.5	-9.1	176.4	71.4	0	0	0	0	113.6	T666 Q667 R673	T666-S669 PolarHBondContact O-N 2.95Å; T666-S669 PolarHBondContact O-OG 2.62Å; Q667-S669 VanDerWaalsContact C-N 3.3Å; Q667-S669 PolarHBondContact O-N 3.33Å; S669-R673 WeakPolarHBondContact O-CB 3.43Å; S669-R673 WeakPolarHBondContact O-CG 3.4Å; S669-R673 PolarHBondContact O-N 2.83Å
670	L	30.3	Very low	33	Very low	104 Å²	104	136.2 Å²	136.2	55%	0.545	64%	0.641	S	S	.	*	H	α-helix	trans	-91.8	-24.2	-170.3	-119.1	137.8	0	0	0	114	T666 Q667 E668 K674	T666-L670 PolarHBondContact O-N 3.42Å; Q667-L670 VanDerWaalsContact O-CB 3.31Å; Q667-L670 WeakPolarHBondContact O-CB 3.19Å; Q667-L670 PolarHBondContact O-N 3.23Å; E668-L670 PolarHBondContact O-N 3.41Å; L670-K674 WeakPolarHBondContact O-CB 3.42Å; L670-K674 VanDerWaalsContact O-CG 3.28Å; L670-K674 WeakPolarHBondContact O-CG 3.41Å; L670-K674 PolarHBondContact O-N 3.09Å; L670-K674 VanDerWaalsContact O-N 3.09Å
671	S	37.9	Very low	34	Very low	79.6667 Å²	79.6667	133.8 Å²	133.8	56%	0.557	63%	0.627	S	S	*	*	H	α-helix	trans	-76.1	-47.1	177.1	58.9	0	0	0	0	112	Q667 E668 R673 K674 F675	Q667-S671 PolarHBondContact O-N 3.25Å; E668-S671 PolarHBondContact O-OG 3.13Å; S671-R673 PolarHBondContact O-N 3.17Å; S671-K674 WeakPolarHBondContact O-CB 3.29Å; S671-K674 PolarHBondContact O-N 2.92Å; S671-K674 VanDerWaalsContact O-N 3.15Å; S671-F675 PolarHBondContact O-N 3.14Å
672	R	34.6	Very low	35	Very low	154.667 Å²	154.667	128.5 Å²	128.5	58%	0.584	60%	0.604	S	S	*	*	H	α-helix	trans	-57.2	-41.7	177.9	-111.2	-179.3	177.2	-172.1	0.6	112.6	S633 N634 E668 K674 F675 F676	S633-R672 PolarHBondContact O-NH1 3.13Å; S633-R672 PolarHBondContact OG-NE 3.05Å; S633-R672 PolarHBondContact OG-NH1 2.86Å; S633-R672 VanDerWaalsContact OG-NH1 3.13Å; S633-R672 PolarHBondContact OG-NH2 3.34Å; S633-R672 VanDerWaalsContact OG-NH2 3.13Å; N634-R672 PolarHBondContact OD1-NH2 3.02Å; E668-R672 PolarHBondContact O-N 2.71Å; R672-K674 VanDerWaalsContact C-N 3.31Å; R672-K674 PolarHBondContact O-N 2.97Å; R672-F675 PolarHBondContact O-N 3.49Å; R672-F676 HydrophobicContact CG-CE2 4.41Å; R672-F676 WeakPolarHBondContact O-CD2 3.42Å; R672-F676 PolarHBondContact O-N 2.76Å
673	R	37.6	Very low	36.3	Very low	184.333 Å²	184.333	121.6 Å²	121.6	70%	0.696	58%	0.583	S	S	*	*	H	α-helix	trans	-68.3	-25.5	176.4	-79.5	-178.3	172.5	174.5	-1.4	113.8	S669 S671 R677	S669-R673 WeakPolarHBondContact O-CB 3.43Å; S669-R673 WeakPolarHBondContact O-CG 3.4Å; S669-R673 PolarHBondContact O-N 2.83Å; S671-R673 PolarHBondContact O-N 3.17Å; R673-R677 VanDerWaalsContact O-CB 3.31Å; R673-R677 WeakPolarHBondContact O-CB 3.33Å; R673-R677 WeakPolarHBondContact O-CD 3.41Å; R673-R677 VanDerWaalsContact O-CG 3.24Å; R673-R677 WeakPolarHBondContact O-CG 3.23Å; R673-R677 PolarHBondContact O-N 3.04Å; R673-R677 VanDerWaalsContact O-N 3.15Å
674	K	39.9	Very low	37.6	Very low	140.333 Å²	140.333	115.5 Å²	115.5	61%	0.61	55%	0.55	S	S	*	.	H	α-helix	trans	-72.9	-42.2	177.5	-75.6	-179.8	179.1	-174.2	0	112.4	L670 S671 R672 R677 F678	L670-K674 WeakPolarHBondContact O-CB 3.42Å; L670-K674 VanDerWaalsContact O-CG 3.28Å; L670-K674 WeakPolarHBondContact O-CG 3.41Å; L670-K674 PolarHBondContact O-N 3.09Å; L670-K674 VanDerWaalsContact O-N 3.09Å; S671-K674 WeakPolarHBondContact O-CB 3.29Å; S671-K674 PolarHBondContact O-N 2.92Å; S671-K674 VanDerWaalsContact O-N 3.15Å; R672-K674 VanDerWaalsContact C-N 3.31Å; R672-K674 PolarHBondContact O-N 2.97Å; K674-R677 PolarHBondContact O-N 3.36Å; K674-F678 WeakPolarHBondContact O-CB 3.39Å; K674-F678 PolarHBondContact O-N 3.16Å
675	F	41.6	Very low	39	Very low	129.667 Å²	129.667	111.7 Å²	111.7	57%	0.569	53%	0.53	S	S	*	.	H	α-helix	trans	-65.2	-46.3	178.2	-175.2	-102.5	0	0	0	111.9	S671 R672 R677 F678 I679	S671-F675 PolarHBondContact O-N 3.14Å; R672-F675 PolarHBondContact O-N 3.49Å; F675-R677 PolarHBondContact O-N 2.75Å; F675-F678 WeakPolarHBondContact O-CB 3.3Å; F675-F678 PolarHBondContact O-N 3.08Å; F675-F678 VanDerWaalsContact O-N 3.14Å; F675-I679 HydrophobicContact CD1-CD1 3.96Å; F675-I679 HydrophobicContact CE1-CD1 3.45Å; F675-I679 VanDerWaalsContact CE1-CD1 3.45Å; F675-I679 HydrophobicContact CE1-CG1 4.43Å; F675-I679 HydrophobicContact CZ-CD1 3.86Å; F675-I679 WeakPolarHBondContact O-CG1 3.37Å; F675-I679 PolarHBondContact O-N 3.1Å; F675-I679 VanDerWaalsContact O-N 3.16Å
676	F	43	Very low	40.2	Very low	103.333 Å²	103.333	107.8 Å²	107.8	45%	0.453	52%	0.516	S	S	.	.	H	α-helix	trans	-64.9	-41	175	-80.7	-73.7	0	0	0	112.6	R672 F678 I679 E680 L811 L813	R672-F676 HydrophobicContact CG-CE2 4.41Å; R672-F676 WeakPolarHBondContact O-CD2 3.42Å; R672-F676 PolarHBondContact O-N 2.76Å; F676-F678 PolarHBondContact O-N 3.09Å; F676-I679 PolarHBondContact O-N 3.4Å; F676-E680 VanDerWaalsContact O-CB 3.27Å; F676-E680 WeakPolarHBondContact O-CB 3.41Å; F676-E680 VanDerWaalsContact O-CG 3.3Å; F676-E680 WeakPolarHBondContact O-CG 3.33Å; F676-E680 PolarHBondContact O-N 2.84Å; F676-L811 VanDerWaalsContact CZ-O 3.31Å; F676-L811 WeakPolarHBondContact CZ-O 3.49Å; F676-L813 HydrophobicContact CE2-CB 4.3Å; F676-L813 HydrophobicContact CE2-CD1 3.69Å; F676-L813 HydrophobicContact CE2-CG 4.49Å; F676-L813 HydrophobicContact CZ-CB 4.48Å; F676-L813 HydrophobicContact CZ-CD1 4.02Å
677	R	42.7	Very low	41.5	Very low	156 Å²	156	105.9 Å²	105.9	59%	0.589	50%	0.496	S	S	*	.	H	α-helix	trans	-61.2	-31.6	171.8	-81.8	-176.7	144.5	-172.7	-0.2	112.7	R673 K674 F675 E680 Y681	R673-R677 VanDerWaalsContact O-CB 3.31Å; R673-R677 WeakPolarHBondContact O-CB 3.33Å; R673-R677 WeakPolarHBondContact O-CD 3.41Å; R673-R677 VanDerWaalsContact O-CG 3.24Å; R673-R677 WeakPolarHBondContact O-CG 3.23Å; R673-R677 PolarHBondContact O-N 3.04Å; R673-R677 VanDerWaalsContact O-N 3.15Å; K674-R677 PolarHBondContact O-N 3.36Å; F675-R677 PolarHBondContact O-N 2.75Å; R677-E680 WeakPolarHBondContact CA-OE2 3.45Å; R677-E680 WeakPolarHBondContact CG-OE2 3.28Å; R677-E680 PolarHBondContact O-N 3.33Å; R677-Y681 VanDerWaalsContact C-CD2 3.45Å; R677-Y681 HydrophobicContact CB-CD2 4.05Å; R677-Y681 HydrophobicContact CB-CE2 3.88Å; R677-Y681 HydrophobicContact CG-CE2 4.39Å; R677-Y681 VanDerWaalsContact O-CB 3.26Å; R677-Y681 WeakPolarHBondContact O-CB 3.37Å; R677-Y681 WeakPolarHBondContact O-CD2 3.29Å; R677-Y681 VanDerWaalsContact O-CG 3.25Å; R677-Y681 PolarHBondContact O-N 3.21Å
678	F	44.6	Very low	42.9	Very low	122.333 Å²	122.333	101.4 Å²	101.4	54%	0.537	48%	0.475	S	S	.	.	H	α-helix	trans	-68.9	-42	176.1	-170.7	-100.2	0	0	0	111.7	K674 F675 F676 E680 Y681 L682	K674-F678 WeakPolarHBondContact O-CB 3.39Å; K674-F678 PolarHBondContact O-N 3.16Å; F675-F678 WeakPolarHBondContact O-CB 3.3Å; F675-F678 PolarHBondContact O-N 3.08Å; F675-F678 VanDerWaalsContact O-N 3.14Å; F676-F678 PolarHBondContact O-N 3.09Å; F678-E680 VanDerWaalsContact C-N 3.33Å; F678-E680 PolarHBondContact O-N 2.93Å; F678-Y681 PolarHBondContact O-N 3.32Å; F678-L682 HydrophobicContact CD1-CD1 3.88Å; F678-L682 HydrophobicContact CE1-CD1 3.54Å; F678-L682 VanDerWaalsContact CE1-CD1 3.43Å; F678-L682 HydrophobicContact CE1-CG 4.4Å; F678-L682 HydrophobicContact CZ-CD1 4.07Å; F678-L682 WeakPolarHBondContact O-CG 3.46Å; F678-L682 PolarHBondContact O-N 3.05Å; F678-L682 VanDerWaalsContact O-N 3.12Å
679	I	45.8	Very low	44.4	Very low	26 Å²	26	93.7 Å²	93.7	13%	0.133	44%	0.44	C	S	.	.	H	α-helix	trans	-65.1	-42	173.5	-66	177	0	0	0	111.3	F675 F676 L682 G683 L684 N685 F808	F675-I679 HydrophobicContact CD1-CD1 3.96Å; F675-I679 HydrophobicContact CE1-CD1 3.45Å; F675-I679 VanDerWaalsContact CE1-CD1 3.45Å; F675-I679 HydrophobicContact CE1-CG1 4.43Å; F675-I679 HydrophobicContact CZ-CD1 3.86Å; F675-I679 WeakPolarHBondContact O-CG1 3.37Å; F675-I679 PolarHBondContact O-N 3.1Å; F675-I679 VanDerWaalsContact O-N 3.16Å; F676-I679 PolarHBondContact O-N 3.4Å; I679-L682 PolarHBondContact O-N 3.11Å; I679-G683 PolarHBondContact O-N 2.98Å; I679-G683 VanDerWaalsContact O-N 3.16Å; I679-L684 HydrophobicContact CB-CD1 4.46Å; I679-L684 HydrophobicContact CG1-CD1 4.44Å; I679-L684 HydrophobicContact CG2-CB 3.92Å; I679-L684 HydrophobicContact CG2-CD1 4.05Å; I679-L684 PolarHBondContact O-N 3.17Å; I679-L684 VanDerWaalsContact O-N 3.07Å; I679-N685 WeakPolarHBondContact CG2-OD1 3.25Å; I679-F808 HydrophobicContact CD1-CD1 4.42Å; I679-F808 HydrophobicContact CD1-CE1 3.92Å; I679-F808 HydrophobicContact CG2-CD1 4.05Å; I679-F808 HydrophobicContact CG2-CE1 4.05Å
680	E	45.3	Very low	45.8	Very low	118.667 Å²	118.667	91.4 Å²	91.4	56%	0.555	42%	0.422	S	S	*	.	H	α-helix	trans	-63.8	-41.9	174.3	-116.2	173.3	-175.5	0	0	111.8	F676 R677 F678 L682 G683 N685	F676-E680 VanDerWaalsContact O-CB 3.27Å; F676-E680 WeakPolarHBondContact O-CB 3.41Å; F676-E680 VanDerWaalsContact O-CG 3.3Å; F676-E680 WeakPolarHBondContact O-CG 3.33Å; F676-E680 PolarHBondContact O-N 2.84Å; R677-E680 WeakPolarHBondContact CA-OE2 3.45Å; R677-E680 WeakPolarHBondContact CG-OE2 3.28Å; R677-E680 PolarHBondContact O-N 3.33Å; F678-E680 VanDerWaalsContact C-N 3.33Å; F678-E680 PolarHBondContact O-N 2.93Å; E680-L682 VanDerWaalsContact C-N 3.28Å; E680-L682 PolarHBondContact O-N 3.27Å; E680-G683 PolarHBondContact O-N 2.9Å; E680-G683 VanDerWaalsContact O-N 3.15Å; E680-N685 HydrophobicContact CG-CB 4.48Å; E680-N685 WeakPolarHBondContact CG-ND2 3.5Å
681	Y	46.1	Very low	47.2	Very low	159.667 Å²	159.667	87.6 Å²	87.6	63%	0.626	40%	0.403	S	S	*	.	H	α-helix	trans	-65.3	-28.9	177	-119.8	-85.2	0	0	0	113	R677 F678 G683	R677-Y681 VanDerWaalsContact C-CD2 3.45Å; R677-Y681 HydrophobicContact CB-CD2 4.05Å; R677-Y681 HydrophobicContact CB-CE2 3.88Å; R677-Y681 HydrophobicContact CG-CE2 4.39Å; R677-Y681 VanDerWaalsContact O-CB 3.26Å; R677-Y681 WeakPolarHBondContact O-CB 3.37Å; R677-Y681 WeakPolarHBondContact O-CD2 3.29Å; R677-Y681 VanDerWaalsContact O-CG 3.25Å; R677-Y681 PolarHBondContact O-N 3.21Å; F678-Y681 PolarHBondContact O-N 3.32Å; Y681-G683 VanDerWaalsContact C-N 3.29Å
682	L	43.9	Very low	48.1	Very low	53 Å²	53	88.2 Å²	88.2	28%	0.277	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-2.8	173.4	-69	171	0	0	0	113.2	F678 I679 E680 L684	F678-L682 HydrophobicContact CD1-CD1 3.88Å; F678-L682 HydrophobicContact CE1-CD1 3.54Å; F678-L682 VanDerWaalsContact CE1-CD1 3.43Å; F678-L682 HydrophobicContact CE1-CG 4.4Å; F678-L682 HydrophobicContact CZ-CD1 4.07Å; F678-L682 WeakPolarHBondContact O-CG 3.46Å; F678-L682 PolarHBondContact O-N 3.05Å; F678-L682 VanDerWaalsContact O-N 3.12Å; I679-L682 PolarHBondContact O-N 3.11Å; E680-L682 VanDerWaalsContact C-N 3.28Å; E680-L682 PolarHBondContact O-N 3.27Å; L682-L684 HydrophobicContact CB-CD1 4.01Å; L682-L684 HydrophobicContact CB-CG 3.91Å; L682-L684 HydrophobicContact CD1-CD1 4.16Å; L682-L684 PolarHBondContact O-N 3.25Å
683	G	48.9	Very low	49.4	Very low	31 Å²	31	82.7 Å²	82.7	32%	0.32	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.5	17.2	179.8	0	0	0	0	0	114.7	I679 E680 Y681 N685 T686	I679-G683 PolarHBondContact O-N 2.98Å; I679-G683 VanDerWaalsContact O-N 3.16Å; E680-G683 PolarHBondContact O-N 2.9Å; E680-G683 VanDerWaalsContact O-N 3.15Å; Y681-G683 VanDerWaalsContact C-N 3.29Å; G683-N685 VanDerWaalsContact C-N 3.29Å; G683-N685 PolarHBondContact O-N 2.98Å; G683-N685 VanDerWaalsContact O-N 3.11Å; G683-T686 PolarHBondContact O-N 3.35Å; G683-T686 PolarHBondContact O-OG1 3.46Å; G683-T686 VanDerWaalsContact O-OG1 3.07Å
684	L	52.2	Low	50.3	Low	18.6667 Å²	18.6667	77.6 Å²	77.6	10%	0.098	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-71.5	-17.8	-173.7	-69.1	172.7	0	0	0	113.4	C588 I594 I679 L682 T686 R687 L689 F808	C588-L684 HydrophobicContact CB-CD2 3.85Å; I594-L684 HydrophobicContact CG2-CD2 4.27Å; I679-L684 HydrophobicContact CB-CD1 4.46Å; I679-L684 HydrophobicContact CG1-CD1 4.44Å; I679-L684 HydrophobicContact CG2-CB 3.92Å; I679-L684 HydrophobicContact CG2-CD1 4.05Å; I679-L684 PolarHBondContact O-N 3.17Å; I679-L684 VanDerWaalsContact O-N 3.07Å; L682-L684 HydrophobicContact CB-CD1 4.01Å; L682-L684 HydrophobicContact CB-CG 3.91Å; L682-L684 HydrophobicContact CD1-CD1 4.16Å; L682-L684 PolarHBondContact O-N 3.25Å; L684-T686 PolarHBondContact O-N 3.34Å; L684-T686 VanDerWaalsContact O-N 3.14Å; L684-R687 PolarHBondContact O-N 2.88Å; L684-R687 VanDerWaalsContact O-N 3.11Å; L684-L689 HydrophobicContact CD1-CD1 4.15Å; L684-L689 HydrophobicContact CD2-CB 4.49Å; L684-L689 HydrophobicContact CD2-CD1 3.87Å; L684-L689 HydrophobicContact CG-CD1 4.42Å; L684-F808 HydrophobicContact CB-CD2 4.31Å; L684-F808 HydrophobicContact CB-CE2 3.84Å; L684-F808 HydrophobicContact CB-CZ 4.14Å; L684-F808 HydrophobicContact CD1-CZ 4.45Å; L684-F808 VanDerWaalsContact O-CB 3.32Å; L684-F808 WeakPolarHBondContact O-CB 3.31Å; L684-F808 WeakPolarHBondContact O-CD2 3.31Å; L684-F808 WeakPolarHBondContact O-CG 3.5Å
685	N	52.5	Low	51	Low	72.6667 Å²	72.6667	73.4 Å²	73.4	39%	0.389	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-63.2	-1.7	-180	-34.3	-11.3	0	0	0	114.8	I679 E680 G683 F808 H809	I679-N685 WeakPolarHBondContact CG2-OD1 3.25Å; E680-N685 HydrophobicContact CG-CB 4.48Å; E680-N685 WeakPolarHBondContact CG-ND2 3.5Å; G683-N685 VanDerWaalsContact C-N 3.29Å; G683-N685 PolarHBondContact O-N 2.98Å; G683-N685 VanDerWaalsContact O-N 3.11Å; N685-F808 CarbonylContact C-O 3.56Å; N685-H809 PolarHBondContact O-CE1 2.71Å; N685-H809 PolarHBondContact O-ND1 2.69Å; N685-H809 PolarHBondContact O-NE2 2.63Å
686	T	48	Very low	51.4	Low	86.3333 Å²	86.3333	67.5 Å²	67.5	53%	0.53	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-128	7.9	-178.5	61.7	0	0	0	0	114.1	G683 L684 H809	G683-T686 PolarHBondContact O-N 3.35Å; G683-T686 PolarHBondContact O-OG1 3.46Å; G683-T686 VanDerWaalsContact O-OG1 3.07Å; L684-T686 PolarHBondContact O-N 3.34Å; L684-T686 VanDerWaalsContact O-N 3.14Å; T686-H809 VanDerWaalsContact C-CE1 3.46Å; T686-H809 PolarHBondContact O-CE1 2.78Å; T686-H809 PolarHBondContact O-ND1 3.37Å; T686-H809 PolarHBondContact O-NE2 3.1Å
687	R	53.9	Low	51.5	Low	71.3333 Å²	71.3333	67.1 Å²	67.1	27%	0.269	32%	0.316	S	S	.	.	S	Bend	trans	-134.3	163.3	-173	-62.2	-172.2	-176.3	-175.8	3	112.2	S586 H596 S597 L684 F808	S586-R687 WeakPolarHBondContact O-CA 3.5Å; H596-R687 PolarHBondContact ND1-NH1 2.95Å; S597-R687 PolarHBondContact O-NH1 3.31Å; L684-R687 PolarHBondContact O-N 2.88Å; L684-R687 VanDerWaalsContact O-N 3.11Å; R687-F808 WeakPolarHBondContact O-CB 3.2Å; R687-F808 VanDerWaalsContact O-CD2 3.32Å; R687-F808 WeakPolarHBondContact O-CD2 3.39Å; R687-F808 PolarHBondContact O-N 2.9Å; R687-F808 VanDerWaalsContact O-N 3.1Å
688	Q	56.8	Low	51.1	Low	71.6667 Å²	71.6667	63.6 Å²	63.6	34%	0.335	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	140.3	168.6	-58.1	-173.2	-40.4	0	0	110.3	S586 I587 C588 Q805 F806 D807	S586-Q688 PolarHBondContact O-N 2.82Å; I587-Q688 WeakPolarHBondContact CA-O 3.47Å; C588-Q688 PolarHBondContact N-O 2.91Å; Q688-Q805 VanDerWaalsContact OE1-NE2 3.12Å; Q688-F806 CarbonylContact C-O 3.53Å; Q688-F806 VanDerWaalsContact CA-O 3.23Å; Q688-F806 WeakPolarHBondContact CA-O 3.46Å; Q688-D807 WeakPolarHBondContact CG-OD1 3.33Å; Q688-D807 VanDerWaalsContact NE2-CG 3.29Å; Q688-D807 PolarHBondContact NE2-OD1 2.95Å; Q688-D807 VanDerWaalsContact NE2-OD1 3.13Å; Q688-D807 PolarHBondContact NE2-OD2 3.09Å
689	L	57.3	Low	50.4	Low	16 Å²	16	61.5 Å²	61.5	8%	0.084	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	125.3	174	-173.8	101.2	0	0	0	109.9	C588 I590 L592 I594 L684 V691 Q805 F806 F808	C588-L689 HydrophobicContact CB-CB 4.49Å; C588-L689 WeakPolarHBondContact O-CA 3.44Å; I590-L689 HydrophobicContact CD1-CD1 3.99Å; I590-L689 HydrophobicContact CD1-CG 4.44Å; L592-L689 HydrophobicContact CD2-CD1 3.84Å; L592-L689 HydrophobicContact CD2-CD2 4.29Å; L592-L689 HydrophobicContact CD2-CG 4.24Å; I594-L689 HydrophobicContact CG1-CD1 4.01Å; L684-L689 HydrophobicContact CD1-CD1 4.15Å; L684-L689 HydrophobicContact CD2-CB 4.49Å; L684-L689 HydrophobicContact CD2-CD1 3.87Å; L684-L689 HydrophobicContact CG-CD1 4.42Å; L689-V691 HydrophobicContact CD2-CG2 3.59Å; L689-V691 HydrophobicContact CG-CG2 4.03Å; L689-Q805 WeakPolarHBondContact O-CA 3.44Å; L689-F806 HydrophobicContact CB-CB 4.41Å; L689-F806 HydrophobicContact CB-CD2 3.77Å; L689-F806 HydrophobicContact CB-CE1 4.3Å; L689-F806 HydrophobicContact CB-CE2 3.43Å; L689-F806 VanDerWaalsContact CB-CE2 3.43Å; L689-F806 HydrophobicContact CB-CG 4.38Å; L689-F806 HydrophobicContact CB-CZ 3.78Å; L689-F806 HydrophobicContact CD2-CD2 3.87Å; L689-F806 HydrophobicContact CD2-CE1 3.99Å; L689-F806 HydrophobicContact CD2-CE2 4.12Å; L689-F806 VanDerWaalsContact CD2-CE2 3.45Å; L689-F806 HydrophobicContact CD2-CZ 3.13Å; L689-F806 HydrophobicContact CG-CE1 4.47Å; L689-F806 HydrophobicContact CG-CE2 4.01Å; L689-F806 HydrophobicContact CG-CZ 3.9Å; L689-F806 PolarHBondContact N-O 3.01Å; L689-F806 PolarHBondContact O-N 3.06Å; L689-F808 HydrophobicContact CB-CD2 4.22Å; L689-F808 HydrophobicContact CB-CE2 3.67Å; L689-F808 HydrophobicContact CB-CZ 3.8Å; L689-F808 HydrophobicContact CD1-CE2 3.85Å; L689-F808 HydrophobicContact CD1-CZ 3.95Å; L689-F808 HydrophobicContact CD2-CE2 4.14Å; L689-F808 HydrophobicContact CD2-CZ 4.06Å; L689-F808 HydrophobicContact CG-CE2 4.19Å; L689-F808 HydrophobicContact CG-CZ 4.03Å
690	N	58.4	Low	49.4	Very low	20.6667 Å²	20.6667	63.6 Å²	63.6	11%	0.111	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	116.2	175.1	-132.5	-25.1	0	0	0	109.7	I587 C588 N589 I590 N593 N803 L804 Q805	I587-N690 WeakPolarHBondContact CG2-ND2 3.39Å; C588-N690 PolarHBondContact O-N 3.18Å; N589-N690 WeakPolarHBondContact OD1-CB 3.46Å; N589-N690 PolarHBondContact OD1-ND2 2.94Å; I590-N690 PolarHBondContact N-O 2.75Å; N593-N690 PolarHBondContact N-O 3.38Å; N593-N690 VanDerWaalsContact N-O 3.1Å; N593-N690 PolarHBondContact O-N 3.03Å; N690-N803 PolarHBondContact OD1-ND2 2.88Å; N690-N803 PolarHBondContact OD1-OD1 3.27Å; N690-L804 CarbonylContact C-O 3.51Å; N690-L804 WeakPolarHBondContact CA-O 3.39Å; N690-L804 PolarHBondContact OD1-O 3.23Å; N690-Q805 PolarHBondContact ND2-OE1 2.91Å; N690-Q805 VanDerWaalsContact OD1-CG 3.29Å; N690-Q805 WeakPolarHBondContact OD1-CG 3.25Å
691	V	60.5	Low	48.4	Very low	24 Å²	24	62.4 Å²	62.4	15%	0.145	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	117.2	175.9	-173.1	0	0	0	0	108.9	I590 L592 L689 I693 N803 L804 F806	I590-V691 HydrophobicContact CB-CG2 4.46Å; I590-V691 HydrophobicContact CG2-CG1 4.39Å; I590-V691 CarbonylContact O-C 3.53Å; I590-V691 VanDerWaalsContact O-CA 3.3Å; I590-V691 WeakPolarHBondContact O-CA 3.44Å; L592-V691 HydrophobicContact CD2-CG2 3.78Å; L592-V691 HydrophobicContact CG-CG2 4.25Å; L689-V691 HydrophobicContact CD2-CG2 3.59Å; L689-V691 HydrophobicContact CG-CG2 4.03Å; V691-I693 HydrophobicContact CG1-CG1 4.15Å; V691-N803 CarbonylContact O-C 3.52Å; V691-N803 WeakPolarHBondContact O-CA 3.44Å; V691-L804 HydrophobicContact CB-CB 4.35Å; V691-L804 PolarHBondContact N-O 3.25Å; V691-L804 PolarHBondContact O-N 2.96Å; V691-F806 HydrophobicContact CG2-CE1 4.26Å; V691-F806 HydrophobicContact CG2-CE2 4.16Å
692	R	57.3	Low	47.4	Very low	92.6667 Å²	92.6667	65.3 Å²	65.3	35%	0.35	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	113.5	174.9	-102.1	179.9	-145.9	166.3	6.9	110.4	I590 Y591 L592 Y694 L801 V802 N803	I590-R692 PolarHBondContact O-N 3.21Å; Y591-R692 CarbonylContact C-O 3.55Å; Y591-R692 WeakPolarHBondContact CA-O 3.34Å; Y591-R692 HydrophobicContact CD1-CB 4.05Å; Y591-R692 PolarHBondContact N-O 3.49Å; Y591-R692 PolarHBondContact O-N 3.37Å; L592-R692 PolarHBondContact N-O 3.37Å; R692-Y694 HydrophobicContact CB-CD2 4.31Å; R692-Y694 HydrophobicContact CB-CE2 3.69Å; R692-Y694 HydrophobicContact CG-CE2 4.46Å; R692-L801 HydrophobicContact CB-CD1 4.22Å; R692-L801 HydrophobicContact CG-CD1 4.15Å; R692-V802 CarbonylContact C-O 3.56Å; R692-V802 WeakPolarHBondContact CA-O 3.24Å; R692-N803 HydrophobicContact CG-CB 4.33Å; R692-N803 WeakPolarHBondContact CG-OD1 3.29Å; R692-N803 PolarHBondContact NE-OD1 3.22Å; R692-N803 PolarHBondContact NH2-OD1 3.28Å
693	I	60.6	Low	46.4	Very low	38.6667 Å²	38.6667	68.7 Å²	68.7	20%	0.198	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	118.9	175	-48.3	177	0	0	0	108.3	N589 I590 L592 V691 F695 L801 V802	N589-I693 WeakPolarHBondContact O-CA 3.21Å; I590-I693 HydrophobicContact CG1-CG2 4.4Å; L592-I693 HydrophobicContact CB-CG1 4.47Å; L592-I693 HydrophobicContact CB-CG2 4.46Å; L592-I693 HydrophobicContact CD2-CG2 3.89Å; L592-I693 CarbonylContact O-C 3.46Å; L592-I693 VanDerWaalsContact O-CA 3.29Å; L592-I693 WeakPolarHBondContact O-CA 3.36Å; V691-I693 HydrophobicContact CG1-CG1 4.15Å; I693-F695 HydrophobicContact CB-CE2 4.31Å; I693-F695 HydrophobicContact CG2-CD2 4.1Å; I693-F695 HydrophobicContact CG2-CE1 4.41Å; I693-F695 HydrophobicContact CG2-CE2 3.44Å; I693-F695 VanDerWaalsContact CG2-CE2 3.45Å; I693-F695 HydrophobicContact CG2-CZ 3.64Å; I693-L801 CarbonylContact O-C 3.43Å; I693-L801 WeakPolarHBondContact O-CA 3.3Å; I693-V802 HydrophobicContact CB-CB 4.28Å; I693-V802 HydrophobicContact CB-CG2 4.36Å; I693-V802 PolarHBondContact N-O 3.24Å; I693-V802 PolarHBondContact O-N 2.94Å
694	Y	56.1	Low	45.2	Very low	77 Å²	77	72.2 Å²	72.2	30%	0.302	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	127.3	176.3	-97.2	-95.4	0	0	0	110.3	N589 Y591 L592 N593 I594 R692 S800 L801	N589-Y694 PolarHBondContact N-O 3.14Å; N589-Y694 PolarHBondContact O-N 2.95Å; Y591-Y694 HydrophobicContact CD1-CE2 4.41Å; L592-Y694 PolarHBondContact O-N 3.05Å; N593-Y694 WeakPolarHBondContact OD1-CD2 3.22Å; I594-Y694 PolarHBondContact N-O 3.44Å; R692-Y694 HydrophobicContact CB-CD2 4.31Å; R692-Y694 HydrophobicContact CB-CE2 3.69Å; R692-Y694 HydrophobicContact CG-CE2 4.46Å; Y694-S800 CarbonylContact C-O 3.47Å; Y694-L801 HydrophobicContact CD1-CB 4.5Å; Y694-L801 HydrophobicContact CD1-CD1 3.79Å; Y694-L801 HydrophobicContact CD2-CD1 4.07Å; Y694-L801 HydrophobicContact CE1-CD1 3.57Å; Y694-L801 HydrophobicContact CE1-CD2 3.98Å; Y694-L801 HydrophobicContact CE1-CG 4.24Å; Y694-L801 HydrophobicContact CE2-CD1 3.85Å; Y694-L801 HydrophobicContact CG-CD1 4.04Å
695	F	56.3	Low	43.9	Very low	52 Å²	52	77.6 Å²	77.6	23%	0.228	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	104.8	169	-52.7	-96.9	0	0	0	108.5	C588 I594 I693 I780 N799 S800 V802	C588-F695 HydrophobicContact CB-CD1 4.19Å; C588-F695 HydrophobicContact CB-CE1 4.2Å; C588-F695 VanDerWaalsContact SG-CE1 3.56Å; I594-F695 HydrophobicContact CB-CD1 3.94Å; I594-F695 HydrophobicContact CB-CE1 4.33Å; I594-F695 HydrophobicContact CD1-CD1 4.07Å; I594-F695 HydrophobicContact CD1-CE1 3.55Å; I594-F695 HydrophobicContact CD1-CZ 4.24Å; I594-F695 HydrophobicContact CG2-CD1 4.01Å; I594-F695 HydrophobicContact CG2-CE1 4.46Å; I693-F695 HydrophobicContact CB-CE2 4.31Å; I693-F695 HydrophobicContact CG2-CD2 4.1Å; I693-F695 HydrophobicContact CG2-CE1 4.41Å; I693-F695 HydrophobicContact CG2-CE2 3.44Å; I693-F695 VanDerWaalsContact CG2-CE2 3.45Å; I693-F695 HydrophobicContact CG2-CZ 3.64Å; F695-I780 HydrophobicContact CB-CD1 4.19Å; F695-I780 HydrophobicContact CD1-CD1 3.7Å; F695-I780 HydrophobicContact CE1-CD1 4.25Å; F695-I780 HydrophobicContact CG-CD1 4.07Å; F695-N799 CarbonylContact O-C 3.53Å; F695-N799 VanDerWaalsContact O-CA 3.28Å; F695-N799 WeakPolarHBondContact O-CA 3.35Å; F695-N799 PolarHBondContact O-N 3.45Å; F695-S800 VanDerWaalsContact CB-OG 3.23Å; F695-S800 WeakPolarHBondContact CB-OG 3.45Å; F695-S800 VanDerWaalsContact CD2-OG 3.25Å; F695-S800 WeakPolarHBondContact CD2-OG 3.24Å; F695-S800 WeakPolarHBondContact CG-OG 3.48Å; F695-S800 PolarHBondContact N-O 3.3Å; F695-S800 PolarHBondContact O-N 3Å; F695-S800 VanDerWaalsContact O-N 3.16Å; F695-V802 HydrophobicContact CE2-CG2 4.18Å
696	G	48.6	Very low	42.5	Very low	5.33333 Å²	5.33333	82.7 Å²	82.7	6%	0.055	46%	0.457	C	S	.	.	S	Bend	trans	177.1	159	-175.1	0	0	0	0	0	113.9	I587 L595 V698 N799	I587-G696 PolarHBondContact N-O 2.8Å; I587-G696 PolarHBondContact O-N 2.95Å; L595-G696 WeakPolarHBondContact CD2-O 3.43Å; G696-V698 PolarHBondContact O-N 3.19Å; G696-N799 WeakPolarHBondContact CA-OD1 3.36Å
697	N	45.3	Very low	41.4	Very low	96 Å²	96	85.1 Å²	85.1	51%	0.513	47%	0.467	S	S	.	.			trans	-82.6	125	176.4	-163.6	3.8	0	0	0	110.4	H596 G699 Q779 N799	H596-N697 PolarHBondContact NE2-ND2 2.9Å; N697-G699 PolarHBondContact O-N 3.04Å; N697-Q779 HydrophobicContact CB-CG 4.09Å; N697-Q779 VanDerWaalsContact N-NE2 3.14Å; N697-N799 PolarHBondContact N-OD1 2.93Å
698	V	34.7	Very low	39.9	Very low	81.3333 Å²	81.3333	87.8 Å²	87.8	49%	0.493	49%	0.487	S	S	.	.			trans	-75	85.5	176.1	-176.4	0	0	0	0	109.4	I587 G696 G700 R702	I587-V698 HydrophobicContact CD1-CG2 3.57Å; I587-V698 HydrophobicContact CG1-CG2 3.94Å; G696-V698 PolarHBondContact O-N 3.19Å; V698-G700 PolarHBondContact O-N 2.93Å; V698-R702 HydrophobicContact CG1-CG 4.49Å
699	G	29.7	Very low	38.4	Very low	79.6667 Å²	79.6667	91.7 Å²	91.7	82%	0.821	51%	0.51	S	S	*	.			trans	-71.2	84.6	170.6	0	0	0	0	0	111.9	N697	N697-G699 PolarHBondContact O-N 3.04Å
700	G	25.9	Very low	36.9	Very low	69 Å²	69	98.4 Å²	98.4	71%	0.711	54%	0.544	S	S	*	.	S	Bend	trans	94.1	65.8	160.1	0	0	0	0	0	115.6	V698 R702	V698-G700 PolarHBondContact O-N 2.93Å; G700-R702 PolarHBondContact O-N 3.42Å; G700-R702 VanDerWaalsContact O-N 3.14Å
701	S	24.5	Very low	35.3	Very low	93.3333 Å²	93.3333	104.1 Å²	104.1	65%	0.653	57%	0.574	S	S	*	*			trans	-126.5	107.3	158.5	161.2	0	0	0	0	112.9	T703	S701-T703 PolarHBondContact O-N 3.14Å
702	R	23.5	Very low	33.5	Very low	221.667 Å²	221.667	109.5 Å²	109.5	84%	0.836	61%	0.608	S	S	*	*			trans	-110.3	41.8	158	-86.1	-171.5	173.4	179.7	-0.4	110.9	V698 G700 S704	V698-R702 HydrophobicContact CG1-CG 4.49Å; G700-R702 PolarHBondContact O-N 3.42Å; G700-R702 VanDerWaalsContact O-N 3.14Å; R702-S704 PolarHBondContact O-N 2.74Å
703	T	24.4	Very low	31.9	Very low	124.667 Å²	124.667	110 Å²	110	77%	0.765	63%	0.626	S	S	*	*			trans	-84.2	100.3	168	47.2	0	0	0	0	109.8	S701 V705	S701-T703 PolarHBondContact O-N 3.14Å; T703-V705 PolarHBondContact O-N 3.11Å; T703-V705 VanDerWaalsContact O-N 3.11Å
704	S	23.5	Very low	30.2	Very low	103 Å²	103	113.8 Å²	113.8	72%	0.72	65%	0.654	S	S	*	*			trans	-89.4	105	170.7	155	0	0	0	0	110.8	R702 R706	R702-S704 PolarHBondContact O-N 2.74Å; S704-R706 PolarHBondContact O-N 3.31Å; S704-R706 PolarHBondContact OG-N 2.88Å
705	V	24.5	Very low	28.6	Very low	132.333 Å²	132.333	116.3 Å²	116.3	80%	0.802	68%	0.678	S	S	*	*			trans	-119.6	78.9	150.9	-175.5	0	0	0	0	107.6	T703 N707	T703-V705 PolarHBondContact O-N 3.11Å; T703-V705 VanDerWaalsContact O-N 3.11Å; V705-N707 PolarHBondContact O-N 3.39Å
706	R	22.9	Very low	27	Very low	179.333 Å²	179.333	118.7 Å²	118.7	68%	0.677	70%	0.701	S	S	*	*			trans	-108.3	95.2	163.4	-156.3	-177	-169.5	173.5	9.6	108.3	Q429 S704 N708	Q429-R706 VanDerWaalsContact OE1-CZ 3.29Å; S704-R706 PolarHBondContact O-N 3.31Å; S704-R706 PolarHBondContact OG-N 2.88Å; R706-N708 PolarHBondContact O-N 2.92Å
707	N	23.9	Very low	25.8	Very low	137.667 Å²	137.667	125.9 Å²	125.9	74%	0.736	74%	0.736	S	S	*	*			trans	-58.5	128.3	164	-90.4	1.4	0	0	0	111.6	V705	V705-N707 PolarHBondContact O-N 3.39Å
708	N	24	Very low	24.8	Very low	127.667 Å²	127.667	127.3 Å²	127.3	68%	0.683	75%	0.748	S	S	*	*			trans	-68.1	120.7	174.4	-74	-8.4	0	0	0	112.3	R706	R706-N708 PolarHBondContact O-N 2.92Å
709	N	25.6	Very low	24.2	Very low	153.667 Å²	153.667	133.8 Å²	133.8	82%	0.822	76%	0.764	S	S	*	*				174.3	131.6	124.8	-80.6	-25.7	0	0	0	112.9
710	I	25.7	Very low	23.9	Very low	157.333 Å²	157.333	137.8 Å²	137.8	81%	0.807	76%	0.761	S	S	*	*				-129.3	137	124.2	-88.4	175.2	0	0	0	106.7
711	N	24.3	Very low	23.8	Very low	139.333 Å²	139.333	140.2 Å²	140.2	75%	0.745	76%	0.758	S	S	*	*			trans	-137.9	152.2	132.4	-105.3	-26	0	0	0	111.4	S713	N711-S713 PolarHBondContact O-N 3.2Å
712	T	22.9	Very low	23.8	Very low	137.667 Å²	137.667	143.8 Å²	143.8	85%	0.845	76%	0.764	S	S	*	*			trans	17	114.5	162	58.7	0	0	0	0	113.7
713	S	23.1	Very low	23.7	Very low	104 Å²	104	141.1 Å²	141.1	73%	0.727	76%	0.761	S	S	*	*			trans	-155.5	143.1	131.4	53.6	0	0	0	0	111.6	N711	N711-S713 PolarHBondContact O-N 3.2Å
714	C	24	Very low	23.7	Very low	118 Å²	118	145 Å²	145	80%	0.797	77%	0.768	S	S	*	*			trans	75.2	99.9	160.3	-58.6	0	0	0	0	117.7
715	T	22.5	Very low	23.8	Very low	130.333 Å²	130.333	143.4 Å²	143.4	80%	0.8	77%	0.768	S	S	*	*				-12.6	139.4	118.5	52.4	0	0	0	0	113.7
716	S	22.9	Very low	23.8	Very low	100.667 Å²	100.667	142 Å²	142	70%	0.704	77%	0.77	S	S	*	*			cis	157.9	139.1	44.2	21.8	0	0	0	0	114.4
717	I	24.6	Very low	24	Very low	157.667 Å²	157.667	138.5 Å²	138.5	81%	0.809	77%	0.773	S	S	*	*			trans	79.9	108	145.7	-55.3	172.8	0	0	0	115.1
718	T	23.2	Very low	23.9	Very low	124 Å²	124	139.2 Å²	139.2	76%	0.761	78%	0.777	S	S	*	*			trans	-87.2	157.9	138.3	35.7	0	0	0	0	115
719	R	22.9	Very low	24.1	Very low	219 Å²	219	138 Å²	138	83%	0.826	78%	0.778	S	S	*	*			trans	124.2	142.2	163.3	-64.9	-176.7	176	136.5	-1.6	115.4
720	H	23.9	Very low	24.1	Very low	162.667 Å²	162.667	136.8 Å²	136.8	75%	0.753	78%	0.777	S	S	*	*				166.3	133.3	115.5	-102.4	-71.1	0	0	0	111.9
721	N	23.2	Very low	24.2	Very low	120.333 Å²	120.333	134.9 Å²	134.9	64%	0.643	77%	0.772	S	S	*	*			trans	50.2	155	150.9	-63.4	15.5	0	0	0	113.4
722	E	24.1	Very low	24.5	Very low	168.333 Å²	168.333	133.2 Å²	133.2	79%	0.787	77%	0.771	S	S	*	*			cis	-167.5	161.4	25.8	-105.2	156.8	-162.6	0	0	108.7
723	E	22.3	Very low	24.7	Very low	165.333 Å²	165.333	133.3 Å²	133.3	77%	0.773	77%	0.767	S	S	*	*			trans	-26.7	150.5	167.5	-64	174.1	145.3	0	0	118.4
724	F	24.4	Very low	25.1	Very low	206 Å²	206	135.2 Å²	135.2	90%	0.904	77%	0.768	S	S	*	*			trans	140.8	141.5	131.3	-92.3	-71.1	0	0	0	116.8
725	G	24.5	Very low	25.3	Very low	70.3333 Å²	70.3333	136.1 Å²	136.1	73%	0.725	77%	0.765	S	S	*	*			trans	103.4	106.9	161.2	0	0	0	0	0	116.1
726	A	24.3	Very low	25.7	Very low	102 Å²	102	135.7 Å²	135.7	84%	0.843	77%	0.768	S	S	*	*				87.3	129.5	84.7	0	0	0	0	0	113.3
727	S	26.8	Very low	25.8	Very low	105.667 Å²	105.667	134.8 Å²	134.8	74%	0.739	78%	0.775	S	S	*	*			trans	-175	141.3	136.6	53.2	0	0	0	0	112.5
728	D	23.5	Very low	25.9	Very low	153.667 Å²	153.667	131.3 Å²	131.3	82%	0.822	78%	0.777	S	S	*	*			trans	58.5	152.1	161.8	-52.9	-40	0	0	0	116.9
729	S	28.2	Very low	25.9	Very low	101.333 Å²	101.333	129.1 Å²	129.1	71%	0.709	78%	0.78	S	S	*	*				-166.5	130	56.9	28	0	0	0	0	108.2
730	T	25.1	Very low	26	Very low	129 Å²	129	125.2 Å²	125.2	79%	0.791	78%	0.78	S	S	*	*				55.2	125.4	72.3	67.1	0	0	0	0	114.9
731	V	28.2	Very low	26	Very low	118 Å²	118	125.2 Å²	125.2	72%	0.715	78%	0.783	S	S	*	*			cis	-151.7	126.2	45.2	173.9	0	0	0	0	108.8	D733	V731-D733 VanDerWaalsContact CG1-OD2 3.27Å; V731-D733 WeakPolarHBondContact CG1-OD2 3.42Å
732	S	29.6	Very low	26	Very low	103.333 Å²	103.333	126.5 Å²	126.5	72%	0.723	79%	0.789	S	S	*	*				135.7	147.7	108.9	55.5	0	0	0	0	112.8
733	D	28.1	Very low	26	Very low	139.667 Å²	139.667	124.3 Å²	124.3	75%	0.747	79%	0.787	S	S	*	*			cis	159.3	151.2	-15.6	-90.3	-32.4	0	0	0	110.3	V731	V731-D733 VanDerWaalsContact CG1-OD2 3.27Å; V731-D733 WeakPolarHBondContact CG1-OD2 3.42Å
734	D	30.9	Very low	26	Very low	143 Å²	143	125.1 Å²	125.1	77%	0.765	79%	0.791	S	S	*	*			trans	107.8	108.7	155.6	-89.9	-7.9	0	0	0	119.2
735	N	28.4	Very low	25.9	Very low	137.667 Å²	137.667	120.8 Å²	120.8	74%	0.736	79%	0.785	S	S	*	*				51.7	131.8	119.5	-71.2	-52.3	0	0	0	118.7
736	S	29.8	Very low	25.9	Very low	122.333 Å²	122.333	127.3 Å²	127.3	86%	0.855	79%	0.793	S	S	*	*			trans	101.4	135.2	132.9	64.9	0	0	0	0	116.1
737	G	26	Very low	25.8	Very low	82 Å²	82	127.4 Å²	127.4	85%	0.845	79%	0.788	S	S	*	*			cis	116.5	117.7	39.9	0	0	0	0	0	114.2
738	G	25.7	Very low	25.7	Very low	83.6667 Å²	83.6667	128.9 Å²	128.9	86%	0.863	79%	0.792	S	S	*	*			trans	144.1	87.8	165.8	0	0	0	0	0	117
739	G	23.7	Very low	25.7	Very low	78.6667 Å²	78.6667	127.9 Å²	127.9	81%	0.811	79%	0.787	S	S	*	*			trans	-77.5	128.6	171.7	0	0	0	0	0	116.2
740	V	24.3	Very low	25.4	Very low	136 Å²	136	128.2 Å²	128.2	82%	0.824	79%	0.788	S	S	*	*			trans	-104.6	122.2	155.7	-179.8	0	0	0	0	111.9	I742	V740-I742 HydrophobicContact CG1-CD1 3.96Å; V740-I742 HydrophobicContact CG1-CG1 3.8Å
741	I	24.9	Very low	25.3	Very low	162.333 Å²	162.333	127.7 Å²	127.7	83%	0.832	78%	0.784	S	S	*	*			trans	-122.2	126.6	158.6	-66	176.2	0	0	0	108.1
742	I	22.9	Very low	25.1	Very low	147.667 Å²	147.667	128.3 Å²	128.3	76%	0.757	78%	0.784	S	S	*	*			trans	-114	138	168.9	-75.6	157.2	0	0	0	110.5	V740	V740-I742 HydrophobicContact CG1-CD1 3.96Å; V740-I742 HydrophobicContact CG1-CG1 3.8Å
743	T	24.9	Very low	24.9	Very low	123.667 Å²	123.667	130 Å²	130	76%	0.759	79%	0.785	S	S	*	*			trans	-96.7	125	173.9	43.5	0	0	0	0	113.3
744	H	22.7	Very low	24.6	Very low	181 Å²	181	131.6 Å²	131.6	84%	0.838	79%	0.785	S	S	*	*			trans	-51	130	146.9	-90.9	-86.4	0	0	0	115.6
745	C	22.2	Very low	24.3	Very low	115 Å²	115	131.3 Å²	131.3	78%	0.777	78%	0.784	S	S	*	*			trans	-97.4	133.4	155.6	-66.1	0	0	0	0	110.7
746	K	23	Very low	24.1	Very low	207 Å²	207	130.2 Å²	130.2	90%	0.9	78%	0.782	S	S	*	*				172.9	118.4	126.5	-105	179.3	-177.9	179.4	0	113
747	S	22.4	Very low	23.8	Very low	105.333 Å²	105.333	132 Å²	132	74%	0.737	78%	0.777	S	S	*	*			trans	-102.3	126.1	172.8	53	0	0	0	0	111.8
748	V	25.4	Very low	23.7	Very low	135.667 Å²	135.667	135.5 Å²	135.5	82%	0.822	77%	0.771	S	S	*	*			trans	-149.6	124.4	164.5	179.2	0	0	0	0	106.1
749	N	22.4	Very low	23.6	Very low	134 Å²	134	139.4 Å²	139.4	72%	0.717	77%	0.767	S	S	*	*			cis	-121.2	138.8	49.3	-79.3	-3.7	0	0	0	111.7
750	C	22.7	Very low	23.6	Very low	107.667 Å²	107.667	146.2 Å²	146.2	73%	0.727	77%	0.77	S	S	*	*				90.6	130.7	120.2	-66.5	0	0	0	0	112
751	T	22.5	Very low	23.7	Very low	117.333 Å²	117.333	145 Å²	145	72%	0.72	77%	0.765	S	S	*	*			cis	-166.9	154.7	31.6	41	0	0	0	0	112.9
752	D	24.4	Very low	23.7	Very low	131.667 Å²	131.667	144.5 Å²	144.5	70%	0.704	76%	0.764	S	S	*	*			trans	117.3	167.7	175.6	-61.2	-33.1	0	0	0	115
753	D	24.8	Very low	23.9	Very low	138 Å²	138	145.3 Å²	145.3	74%	0.738	76%	0.764	S	S	*	*			cis	179	145.2	41.8	-119	-18	0	0	0	115.5
754	F	23.3	Very low	24.1	Very low	173.333 Å²	173.333	147.1 Å²	147.1	76%	0.76	77%	0.767	S	S	*	*			trans	23.5	123.4	160.2	-72.9	-81.2	0	0	0	116.7
755	N	24.7	Very low	24.4	Very low	137.333 Å²	137.333	146.9 Å²	146.9	73%	0.734	77%	0.767	S	S	*	*				-174.7	143.1	75.5	-104.1	-39.7	0	0	0	114.5
756	T	24	Very low	24.8	Very low	114 Å²	114	147 Å²	147	70%	0.699	76%	0.758	S	S	*	*			trans	-8.6	134.7	154.2	49.7	0	0	0	0	116.8
757	E	23.1	Very low	25	Very low	160 Å²	160	139.4 Å²	139.4	75%	0.748	74%	0.739	S	S	*	*				157.7	152.3	100.8	-98.7	-178	-139.9	0	0	113.2
758	Q	24.5	Very low	25.3	Very low	157 Å²	157	141 Å²	141	73%	0.734	74%	0.736	S	S	*	*			cis	-174.1	149.7	39	-89.1	-170.8	22.2	0	0	114.6
759	Q	22.1	Very low	25.4	Very low	164 Å²	164	140.9 Å²	140.9	77%	0.766	73%	0.729	S	S	*	*			trans	-26.9	128.2	163.1	-59.5	168.7	-4.9	0	0	117.4
760	Y	25	Very low	25.8	Very low	222.667 Å²	222.667	141 Å²	141	87%	0.873	73%	0.725	S	S	*	*				-165.7	136.8	124.8	-95.5	-78.6	0	0	0	109.7
761	P	26.2	Very low	26.1	Very low	111.333 Å²	111.333	145.6 Å²	145.6	72%	0.723	73%	0.727	S	S	*	*			trans	-102.2	117.9	-173.5	35	-27.5	0	0	0	113.3
762	D	24.4	Very low	26.4	Very low	151 Å²	151	144.9 Å²	144.9	81%	0.807	72%	0.718	S	S	*	*			trans	-145.8	68.7	165.8	-105.5	-25.8	0	0	0	112.9
763	H	27	Very low	26.8	Very low	165.333 Å²	165.333	146.8 Å²	146.8	77%	0.765	72%	0.72	S	S	*	*			trans	-122.8	68.1	177.1	-89.6	-29.1	0	0	0	113.2	Q765 I766	H763-Q765 PolarHBondContact O-N 3.1Å; H763-I766 HydrophobicContact CB-CD1 4.14Å; H763-I766 WeakPolarHBondContact CD2-CD1 3.44Å
764	I	28.3	Very low	27.2	Very low	160.667 Å²	160.667	144.7 Å²	144.7	82%	0.824	72%	0.716	S	S	*	*	H	α-helix	trans	-114.3	-15.9	166	-77.2	168.5	0	0	0	113	I766	I764-I766 PolarHBondContact O-N 3.3Å
765	Q	29.2	Very low	27.5	Very low	176.667 Å²	176.667	145.2 Å²	145.2	83%	0.826	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	-16.5	-175.5	-69.7	-168.6	-3	0	0	115.9	H763 M768 M769	H763-Q765 PolarHBondContact O-N 3.1Å; Q765-M768 PolarHBondContact O-N 3.46Å; Q765-M769 PolarHBondContact O-N 3.09Å
766	I	30.5	Very low	28.2	Very low	117 Å²	117	148 Å²	148	60%	0.6	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-27.9	-174.4	-62.2	178.1	0	0	0	112.4	H763 I764 M768 M769 E770	H763-I766 HydrophobicContact CB-CD1 4.14Å; H763-I766 WeakPolarHBondContact CD2-CD1 3.44Å; I764-I766 PolarHBondContact O-N 3.3Å; I766-M768 VanDerWaalsContact C-N 3.26Å; I766-M768 PolarHBondContact O-N 3.15Å; I766-M769 PolarHBondContact O-N 3.14Å; I766-M769 VanDerWaalsContact O-N 3.12Å; I766-E770 HydrophobicContact CG2-CG 4.22Å; I766-E770 PolarHBondContact O-N 2.99Å
767	G	28.5	Very low	29	Very low	48.3333 Å²	48.3333	146.3 Å²	146.3	50%	0.498	71%	0.705	S	S	.	*	H	α-helix	trans	-70.4	-16.9	-175.3	0	0	0	0	0	116.2	R771	G767-R771 PolarHBondContact O-N 2.86Å
768	M	28.6	Very low	30.1	Very low	137.667 Å²	137.667	140.2 Å²	140.2	68%	0.678	68%	0.679	S	S	*	*	H	α-helix	trans	-85.7	-31.2	178	-79.5	-164.3	147.4	0	0	113.7	Q765 I766 E770 R771 L772	Q765-M768 PolarHBondContact O-N 3.46Å; I766-M768 VanDerWaalsContact C-N 3.26Å; I766-M768 PolarHBondContact O-N 3.15Å; M768-E770 VanDerWaalsContact C-N 3.27Å; M768-E770 PolarHBondContact O-N 3.15Å; M768-R771 PolarHBondContact O-N 2.94Å; M768-L772 WeakPolarHBondContact O-CG 3.45Å; M768-L772 PolarHBondContact O-N 2.88Å
769	M	27.8	Very low	31.4	Very low	134.667 Å²	134.667	133.8 Å²	133.8	66%	0.663	65%	0.649	S	S	*	*	H	α-helix	trans	-70.2	-29.4	-177.8	-118.7	159.7	97.7	0	0	112.8	Q765 I766 L772 K773	Q765-M769 PolarHBondContact O-N 3.09Å; I766-M769 PolarHBondContact O-N 3.14Å; I766-M769 VanDerWaalsContact O-N 3.12Å; M769-L772 PolarHBondContact O-N 3.5Å; M769-K773 PolarHBondContact O-N 3.15Å
770	E	30.4	Very low	32.8	Very low	135.333 Å²	135.333	127 Å²	127	63%	0.632	62%	0.618	S	S	*	*	H	α-helix	trans	-78.1	-32.4	177.5	-64.3	-154.1	127	0	0	113.1	I766 M768 L772 K773 S774	I766-E770 HydrophobicContact CG2-CG 4.22Å; I766-E770 PolarHBondContact O-N 2.99Å; M768-E770 VanDerWaalsContact C-N 3.27Å; M768-E770 PolarHBondContact O-N 3.15Å; E770-L772 VanDerWaalsContact C-N 3.27Å; E770-L772 PolarHBondContact O-N 3.08Å; E770-K773 WeakPolarHBondContact O-CB 3.35Å; E770-K773 PolarHBondContact O-N 3.29Å; E770-K773 VanDerWaalsContact O-N 3.08Å; E770-K773 IonicContact OE1-NZ 2.81Å; E770-K773 PolarHBondContact OE1-NZ 3.26Å; E770-S774 PolarHBondContact O-N 2.92Å
771	R	28.1	Very low	34.1	Very low	204.667 Å²	204.667	118 Å²	118	77%	0.772	59%	0.585	S	S	*	*	H	α-helix	trans	-69.8	-22.8	174.6	-75.9	-177.1	174.9	172.1	-0.6	113.4	G767 M768 K773 S774	G767-R771 PolarHBondContact O-N 2.86Å; M768-R771 PolarHBondContact O-N 2.94Å; R771-K773 VanDerWaalsContact C-N 3.33Å; R771-K773 PolarHBondContact O-N 3.15Å; R771-S774 PolarHBondContact O-N 2.74Å; R771-S774 PolarHBondContact O-OG 3.14Å
772	L	29.6	Very low	35.4	Very low	103 Å²	103	116.9 Å²	116.9	54%	0.539	57%	0.569	S	S	.	*	H	α-helix	trans	-80.4	-19.4	175.9	-72.7	169.6	0	0	0	113.6	M768 M769 E770 S774 R775	M768-L772 WeakPolarHBondContact O-CG 3.45Å; M768-L772 PolarHBondContact O-N 2.88Å; M769-L772 PolarHBondContact O-N 3.5Å; E770-L772 VanDerWaalsContact C-N 3.27Å; E770-L772 PolarHBondContact O-N 3.08Å; L772-S774 PolarHBondContact O-N 3.35Å; L772-S774 VanDerWaalsContact O-N 3.16Å; L772-R775 PolarHBondContact O-N 3.24Å; L772-R775 VanDerWaalsContact O-N 3.15Å
773	K	33.4	Very low	36.8	Very low	170.333 Å²	170.333	110.8 Å²	110.8	74%	0.741	54%	0.537	S	S	*	.	H	α-helix	trans	-71	-19.6	174.1	-72.2	177.7	-176.7	170.3	0	113.5	M769 E770 R771	M769-K773 PolarHBondContact O-N 3.15Å; E770-K773 WeakPolarHBondContact O-CB 3.35Å; E770-K773 PolarHBondContact O-N 3.29Å; E770-K773 VanDerWaalsContact O-N 3.08Å; E770-K773 IonicContact OE1-NZ 2.81Å; E770-K773 PolarHBondContact OE1-NZ 3.26Å; R771-K773 VanDerWaalsContact C-N 3.33Å; R771-K773 PolarHBondContact O-N 3.15Å
774	S	31.9	Very low	38	Very low	94.3333 Å²	94.3333	105.9 Å²	105.9	66%	0.66	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-10.7	-172.1	67	0	0	0	0	115.6	E770 R771 L772	E770-S774 PolarHBondContact O-N 2.92Å; R771-S774 PolarHBondContact O-N 2.74Å; R771-S774 PolarHBondContact O-OG 3.14Å; L772-S774 PolarHBondContact O-N 3.35Å; L772-S774 VanDerWaalsContact O-N 3.16Å
775	R	30	Very low	39.2	Very low	183.333 Å²	183.333	100.2 Å²	100.2	69%	0.692	49%	0.487	S	S	*	.	S	Bend	trans	-114	121.8	176.8	-71.2	-171.9	168.8	-176.1	-1.5	111.6	L772 I777 E881	L772-R775 PolarHBondContact O-N 3.24Å; L772-R775 VanDerWaalsContact O-N 3.15Å; R775-I777 VanDerWaalsContact C-N 3.29Å; R775-I777 HydrophobicContact CB-CG1 4.49Å; R775-I777 PolarHBondContact O-N 3.17Å; R775-E881 WeakPolarHBondContact CD-OE1 3.48Å; R775-E881 IonicContact CZ-OE1 2.66Å; R775-E881 IonicContact NE-OE1 2.67Å; R775-E881 PolarHBondContact NE-OE1 3.31Å; R775-E881 IonicContact NH2-OE1 2.81Å; R775-E881 PolarHBondContact NH2-OE1 3.06Å
776	K	39.1	Very low	40.1	Very low	197.667 Å²	197.667	95 Å²	95	86%	0.859	47%	0.468	S	S	*	.			trans	-69.7	77.9	176.4	-68.9	178.6	178.5	175.3	0	111	P778 L882	K776-P778 WeakPolarHBondContact O-CD 3.32Å; K776-L882 WeakPolarHBondContact O-CD1 3.34Å
777	I	41.6	Very low	40.9	Very low	77.6667 Å²	77.6667	92.5 Å²	92.5	40%	0.398	46%	0.456	S	S	.	.			trans	-77.1	131.6	166.6	-59.1	168.4	0	0	0	107.7	R775 Y876	R775-I777 VanDerWaalsContact C-N 3.29Å; R775-I777 HydrophobicContact CB-CG1 4.49Å; R775-I777 PolarHBondContact O-N 3.17Å; I777-Y876 HydrophobicContact CD1-CD1 3.79Å; I777-Y876 HydrophobicContact CD1-CE1 3.32Å; I777-Y876 HydrophobicContact CG1-CD1 4.16Å; I777-Y876 HydrophobicContact CG1-CE1 3.81Å; I777-Y876 HydrophobicContact CG2-CE1 4.09Å
778	P	45.2	Very low	41.8	Very low	31.3333 Å²	31.3333	93.5 Å²	93.5	20%	0.203	45%	0.45	C	S	.	.			trans	-77	154.2	175.2	14	-11.2	0	0	0	112.4	K776 I780 L781 T798 L882	K776-P778 WeakPolarHBondContact O-CD 3.32Å; P778-I780 VanDerWaalsContact C-N 3.35Å; P778-I780 PolarHBondContact O-N 3.04Å; P778-L781 HydrophobicContact CB-CD1 4.18Å; P778-L781 HydrophobicContact CG-CD1 3.86Å; P778-T798 HydrophobicContact CB-CG2 3.75Å; P778-T798 HydrophobicContact CG-CG2 3.14Å; P778-L882 HydrophobicContact CB-CD1 3.83Å; P778-L882 HydrophobicContact CB-CG 4.29Å; P778-L882 HydrophobicContact CG-CD1 3.84Å; P778-L882 HydrophobicContact CG-CD2 4.18Å; P778-L882 HydrophobicContact CG-CG 4.14Å
779	Q	51.9	Low	42.7	Very low	22.3333 Å²	22.3333	93.9 Å²	93.9	10%	0.104	45%	0.448	C	S	.	.	S	Bend	trans	-83.8	22.7	-163.9	-63.5	-179.1	-7.9	0	0	112.4	H596 N697 F797 T798 N799	H596-Q779 PolarHBondContact CD2-NE2 3.41Å; H596-Q779 VanDerWaalsContact N-NE2 3.19Å; H596-Q779 PolarHBondContact ND1-NE2 3.01Å; N697-Q779 HydrophobicContact CB-CG 4.09Å; N697-Q779 VanDerWaalsContact N-NE2 3.14Å; Q779-F797 PolarHBondContact N-O 3.23Å; Q779-T798 HydrophobicContact CG-CG2 4.1Å; Q779-N799 PolarHBondContact NE2-OD1 3.39Å; Q779-N799 PolarHBondContact OE1-OD1 3.08Å; Q779-N799 VanDerWaalsContact OE1-OD1 3.13Å
780	I	51.4	Low	43.8	Very low	22 Å²	22	87.8 Å²	87.8	11%	0.113	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	117.6	172.7	-52.4	177.8	0	0	0	108.1	S598 F695 P778 F782 V783 G796 F797 I879	S598-I780 WeakPolarHBondContact CA-O 3.37Å; F695-I780 HydrophobicContact CB-CD1 4.19Å; F695-I780 HydrophobicContact CD1-CD1 3.7Å; F695-I780 HydrophobicContact CE1-CD1 4.25Å; F695-I780 HydrophobicContact CG-CD1 4.07Å; P778-I780 VanDerWaalsContact C-N 3.35Å; P778-I780 PolarHBondContact O-N 3.04Å; I780-F782 HydrophobicContact CG2-CD2 4.04Å; I780-F782 HydrophobicContact CG2-CE2 3.44Å; I780-F782 VanDerWaalsContact CG2-CE2 3.44Å; I780-F782 HydrophobicContact CG2-CZ 3.95Å; I780-V783 HydrophobicContact CG2-CG2 3.83Å; I780-G796 CarbonylContact O-C 3.49Å; I780-G796 WeakPolarHBondContact O-CA 3.47Å; I780-F797 HydrophobicContact CB-CB 4.29Å; I780-F797 HydrophobicContact CB-CD2 4.39Å; I780-F797 HydrophobicContact CG2-CD2 4.34Å; I780-F797 PolarHBondContact N-O 3.31Å; I780-F797 VanDerWaalsContact N-O 3.17Å; I780-F797 PolarHBondContact O-N 3.32Å; I780-I879 HydrophobicContact CD1-CD1 3.69Å; I780-I879 HydrophobicContact CD1-CG2 3.8Å
781	L	52.9	Low	45	Very low	33.6667 Å²	33.6667	81.9 Å²	81.9	18%	0.176	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	93.7	-176.6	-158.6	76.4	0	0	0	110.6	S597 I599 P778 V783 Q794 F795 F797 I879	S597-L781 WeakPolarHBondContact OG-CD1 3.22Å; I599-L781 WeakPolarHBondContact CB-O 3.48Å; P778-L781 HydrophobicContact CB-CD1 4.18Å; P778-L781 HydrophobicContact CG-CD1 3.86Å; L781-V783 HydrophobicContact CD2-CG2 3.75Å; L781-V783 HydrophobicContact CG-CG2 3.84Å; L781-Q794 HydrophobicContact CD1-CG 3.62Å; L781-Q794 VanDerWaalsContact CD1-CG 3.47Å; L781-Q794 HydrophobicContact CG-CG 4.25Å; L781-F795 CarbonylContact C-O 3.39Å; L781-F795 WeakPolarHBondContact CA-O 3.27Å; L781-F797 HydrophobicContact CB-CB 4.41Å; L781-F797 HydrophobicContact CB-CD2 3.63Å; L781-F797 HydrophobicContact CB-CE2 4.37Å; L781-F797 HydrophobicContact CB-CG 4.43Å; L781-F797 HydrophobicContact CD2-CB 4.45Å; L781-F797 HydrophobicContact CD2-CD2 3.87Å; L781-F797 HydrophobicContact CD2-CE2 4.35Å; L781-F797 HydrophobicContact CD2-CG 4.27Å; L781-F797 HydrophobicContact CG-CD2 4.38Å; L781-I879 HydrophobicContact CD2-CD1 3.61Å; L781-I879 HydrophobicContact CD2-CG1 4.26Å; L781-I879 HydrophobicContact CD2-CG2 4.39Å
782	F	54.6	Low	46.3	Very low	88 Å²	88	72.3 Å²	72.3	39%	0.386	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	127	169.6	-59	-88.6	0	0	0	110.2	I599 I780 Q794 F795 F797	I599-F782 HydrophobicContact CB-CD1 4.25Å; I599-F782 HydrophobicContact CD1-CD1 4.19Å; I599-F782 HydrophobicContact CD1-CE1 3.66Å; I599-F782 HydrophobicContact CD1-CZ 4.23Å; I599-F782 HydrophobicContact CG2-CD1 4.25Å; I599-F782 HydrophobicContact CG2-CE1 4.48Å; I780-F782 HydrophobicContact CG2-CD2 4.04Å; I780-F782 HydrophobicContact CG2-CE2 3.44Å; I780-F782 VanDerWaalsContact CG2-CE2 3.44Å; I780-F782 HydrophobicContact CG2-CZ 3.95Å; F782-Q794 CarbonylContact O-C 3.33Å; F782-Q794 WeakPolarHBondContact O-CA 3.39Å; F782-F795 HydrophobicContact CB-CB 4.26Å; F782-F795 HydrophobicContact CB-CD2 4.39Å; F782-F795 HydrophobicContact CD2-CB 4.45Å; F782-F795 PolarHBondContact N-O 3.21Å; F782-F795 PolarHBondContact O-N 3.07Å; F782-F797 HydrophobicContact CD2-CD2 4.26Å; F782-F797 AromaticContact CD2-CE2 3.89Å; F782-F797 HydrophobicContact CD2-CE2 3.89Å; F782-F797 HydrophobicContact CE2-CD2 4.1Å; F782-F797 AromaticContact CE2-CE2 3.81Å; F782-F797 HydrophobicContact CE2-CE2 3.81Å
783	V	52.1	Low	47.8	Very low	22.3333 Å²	22.3333	69.1 Å²	69.1	14%	0.135	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	117.7	169.3	-173.3	0	0	0	0	108.4	I599 F600 Y601 I780 L781 I785 L793 Q794 L837	I599-V783 PolarHBondContact O-N 2.88Å; F600-V783 HydrophobicContact CD1-CB 4.09Å; F600-V783 HydrophobicContact CD1-CG2 4.12Å; F600-V783 HydrophobicContact CE1-CG2 4.04Å; Y601-V783 PolarHBondContact N-O 3.08Å; I780-V783 HydrophobicContact CG2-CG2 3.83Å; L781-V783 HydrophobicContact CD2-CG2 3.75Å; L781-V783 HydrophobicContact CG-CG2 3.84Å; V783-I785 HydrophobicContact CG1-CD1 4Å; V783-I785 HydrophobicContact CG1-CG1 4.07Å; V783-L793 WeakPolarHBondContact CA-O 3.05Å; V783-Q794 HydrophobicContact CG2-CG 4.44Å; V783-L837 HydrophobicContact CG1-CD1 3.88Å; V783-L837 HydrophobicContact CG1-CD2 4.01Å
784	L	52.8	Low	49.2	Very low	62.6667 Å²	62.6667	61.4 Å²	61.4	33%	0.328	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	119.7	178.5	-61.2	175.9	0	0	0	109.3	I602 E608 G792 L793 F795	I602-L784 HydrophobicContact CB-CD2 4.03Å; I602-L784 HydrophobicContact CD1-CD2 3.52Å; I602-L784 HydrophobicContact CG1-CD2 3.91Å; E608-L784 WeakPolarHBondContact OE1-CB 3.3Å; L784-G792 CarbonylContact O-C 3.58Å; L784-G792 WeakPolarHBondContact O-CA 3.29Å; L784-L793 HydrophobicContact CB-CB 4.35Å; L784-L793 WeakPolarHBondContact CB-O 3.37Å; L784-L793 HydrophobicContact CD1-CB 4.34Å; L784-L793 HydrophobicContact CD1-CD2 4.21Å; L784-L793 PolarHBondContact N-O 3.26Å; L784-L793 PolarHBondContact O-N 3Å; L784-F795 HydrophobicContact CD1-CD2 4.3Å; L784-F795 HydrophobicContact CD1-CE2 3.94Å; L784-F795 HydrophobicContact CG-CE2 4.47Å
785	I	52.7	Low	50.5	Low	41.6667 Å²	41.6667	59.8 Å²	59.8	21%	0.214	29%	0.287	C	S	.	.			trans	-126.8	104.7	176.7	-56.1	176.1	0	0	0	107.8	Y601 I602 H603 E608 V783 D787 I840	Y601-I785 PolarHBondContact O-N 2.77Å; I602-I785 HydrophobicContact CD1-CD1 4.2Å; I602-I785 HydrophobicContact CG1-CB 4.31Å; I602-I785 HydrophobicContact CG1-CD1 4.23Å; I602-I785 HydrophobicContact CG2-CB 4.28Å; I602-I785 HydrophobicContact CG2-CG2 4.36Å; H603-I785 PolarHBondContact N-O 2.76Å; E608-I785 PolarHBondContact OE1-N 2.86Å; V783-I785 HydrophobicContact CG1-CD1 4Å; V783-I785 HydrophobicContact CG1-CG1 4.07Å; I785-D787 WeakPolarHBondContact CG2-O 3.41Å; I785-I840 HydrophobicContact CD1-CD1 3.94Å
786	P	48.2	Very low	51.9	Low	67.6667 Å²	67.6667	51.3 Å²	51.3	44%	0.439	26%	0.257	S	S	.	.	S	Bend	trans	-73.8	-34.8	-177.9	16.3	-16	0	0	0	113.4	H603 N605 E608 S790	H603-P786 PolarHBondContact ND1-O 3.05Å; N605-P786 PolarHBondContact ND2-O 2.74Å; N605-P786 PolarHBondContact OD1-O 3.46Å; N605-P786 VanDerWaalsContact OD1-O 3.11Å; E608-P786 WeakPolarHBondContact OE2-CA 3.47Å; P786-S790 WeakPolarHBondContact CD-OG 3.41Å; P786-S790 WeakPolarHBondContact CG-OG 3.3Å
787	D	47.5	Very low	53	Low	64.3333 Å²	64.3333	44.1 Å²	44.1	34%	0.344	23%	0.226	S	C	.	.			trans	-151.6	150.9	176.6	-179.1	11.8	0	0	0	110.3	I785 K789 S790 Y930	I785-D787 WeakPolarHBondContact CG2-O 3.41Å; D787-K789 PolarHBondContact O-N 2.86Å; D787-K789 VanDerWaalsContact O-N 3.12Å; D787-K789 PolarHBondContact OD1-N 2.91Å; D787-K789 WeakPolarHBondContact OD2-CB 3.39Å; D787-K789 PolarHBondContact OD2-N 3.36Å; D787-S790 PolarHBondContact N-OG 3.23Å; D787-S790 VanDerWaalsContact N-OG 3.12Å; D787-S790 WeakPolarHBondContact O-CB 3.38Å; D787-S790 PolarHBondContact O-N 3.07Å; D787-S790 VanDerWaalsContact O-N 3.12Å; D787-S790 PolarHBondContact O-OG 2.97Å; D787-Y930 PolarHBondContact OD2-OH 3.02Å
788	L	48.3	Very low	53.8	Low	69 Å²	69	41.1 Å²	41.1	36%	0.361	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-22.4	174.4	-75.6	164.2	0	0	0	113.9	L864 I867	L788-L864 HydrophobicContact CD1-CD1 3.63Å; L788-L864 HydrophobicContact CD1-CD2 3.69Å; L788-L864 HydrophobicContact CD2-CD1 3.38Å; L788-L864 HydrophobicContact CD2-CD2 4.16Å; L788-L864 HydrophobicContact CD2-CG 4.26Å; L788-L864 HydrophobicContact CG-CD1 4.12Å; L788-L864 HydrophobicContact CG-CD2 3.87Å; L788-I867 HydrophobicContact CD1-CD1 4.32Å
789	K	47.1	Very low	54.3	Low	146.667 Å²	146.667	43.9 Å²	43.9	64%	0.638	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.1	-7	177.8	-61.4	174.9	-178.4	171.7	0	113.8	D787 K839 Y930	D787-K789 PolarHBondContact O-N 2.86Å; D787-K789 VanDerWaalsContact O-N 3.12Å; D787-K789 PolarHBondContact OD1-N 2.91Å; D787-K789 WeakPolarHBondContact OD2-CB 3.39Å; D787-K789 PolarHBondContact OD2-N 3.36Å; K789-K839 VanDerWaalsContact O-CD 3.3Å; K789-K839 WeakPolarHBondContact O-CD 3.4Å; K789-K839 WeakPolarHBondContact O-CE 3.35Å; K789-K839 WeakPolarHBondContact O-CG 3.38Å; K789-Y930 PolarHBondContact O-OH 3.04Å
790	S	51.6	Low	54.6	Low	5.66667 Å²	5.66667	43.2 Å²	43.2	4%	0.04	22%	0.222	C	C	.	.	S	Bend	trans	-93.6	152.1	177.9	69.3	0	0	0	0	111.4	P786 D787	P786-S790 WeakPolarHBondContact CD-OG 3.41Å; P786-S790 WeakPolarHBondContact CG-OG 3.3Å; D787-S790 PolarHBondContact N-OG 3.23Å; D787-S790 VanDerWaalsContact N-OG 3.12Å; D787-S790 WeakPolarHBondContact O-CB 3.38Å; D787-S790 PolarHBondContact O-N 3.07Å; D787-S790 VanDerWaalsContact O-N 3.12Å; D787-S790 PolarHBondContact O-OG 2.97Å
791	P	55.1	Low	55	Low	11.6667 Å²	11.6667	44.4 Å²	44.4	8%	0.076	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-68.5	135.8	168.2	29.8	-33.4	0	0	0	110.4	L836 L837 L927	P791-L836 HydrophobicContact CB-CD2 4.03Å; P791-L836 HydrophobicContact CB-CG 4.25Å; P791-L836 HydrophobicContact CG-CD2 4.05Å; P791-L837 CarbonylContact C-O 3.55Å; P791-L837 VanDerWaalsContact CA-O 3.28Å; P791-L837 WeakPolarHBondContact CA-O 3.23Å; P791-L837 WeakPolarHBondContact CB-O 3.36Å; P791-L927 HydrophobicContact CG-CB 4.28Å; P791-L927 HydrophobicContact CG-CD1 4.31Å
792	G	56.4	Low	55.3	Low	3 Å²	3	44 Å²	44	3%	0.031	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	156.6	178	0	0	0	0	0	112.2	L784 L836 L837	L784-G792 CarbonylContact O-C 3.58Å; L784-G792 WeakPolarHBondContact O-CA 3.29Å; G792-L836 CarbonylContact O-C 3.51Å; G792-L836 WeakPolarHBondContact O-CA 3.36Å; G792-L837 PolarHBondContact N-O 3.05Å; G792-L837 VanDerWaalsContact N-O 3.1Å; G792-L837 PolarHBondContact O-N 3.09Å
793	L	59.9	Low	55.4	Low	36.3333 Å²	36.3333	41 Å²	41	19%	0.19	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	119.2	177.2	-167.9	95	0	0	0	110.3	V783 L784 F795 V834 L836 L927	V783-L793 WeakPolarHBondContact CA-O 3.05Å; L784-L793 HydrophobicContact CB-CB 4.35Å; L784-L793 WeakPolarHBondContact CB-O 3.37Å; L784-L793 HydrophobicContact CD1-CB 4.34Å; L784-L793 HydrophobicContact CD1-CD2 4.21Å; L784-L793 PolarHBondContact N-O 3.26Å; L784-L793 PolarHBondContact O-N 3Å; L793-F795 HydrophobicContact CD2-CD1 4.38Å; L793-F795 HydrophobicContact CD2-CD2 4.15Å; L793-F795 HydrophobicContact CD2-CE1 3.96Å; L793-F795 HydrophobicContact CD2-CE2 3.42Å; L793-F795 HydrophobicContact CD2-CG 4.32Å; L793-F795 HydrophobicContact CD2-CZ 3.49Å; L793-F795 VanDerWaalsContact CD2-CZ 3.44Å; L793-F795 HydrophobicContact CG-CD2 4.34Å; L793-F795 HydrophobicContact CG-CE2 3.75Å; L793-F795 HydrophobicContact CG-CZ 4.08Å; L793-V834 HydrophobicContact CD1-CG1 3.74Å; L793-V834 HydrophobicContact CD2-CG1 3.98Å; L793-V834 HydrophobicContact CG-CG1 4.33Å; L793-L836 HydrophobicContact CB-CD2 4.27Å; L793-L836 HydrophobicContact CD1-CD1 3.9Å; L793-L836 HydrophobicContact CD1-CD2 4.17Å; L793-L836 HydrophobicContact CD1-CG 4.36Å; L793-L836 HydrophobicContact CG-CD2 4.3Å; L793-L927 HydrophobicContact CD1-CD1 4.48Å
794	Q	62	Low	55.6	Low	7.66667 Å²	7.66667	41.9 Å²	41.9	4%	0.036	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	130.9	-179.7	171.7	174.5	-45.1	0	0	110.6	L781 F782 V783 V834 C835 L837 H880	L781-Q794 HydrophobicContact CD1-CG 3.62Å; L781-Q794 VanDerWaalsContact CD1-CG 3.47Å; L781-Q794 HydrophobicContact CG-CG 4.25Å; F782-Q794 CarbonylContact O-C 3.33Å; F782-Q794 WeakPolarHBondContact O-CA 3.39Å; V783-Q794 HydrophobicContact CG2-CG 4.44Å; Q794-V834 VanDerWaalsContact O-CA 3.29Å; Q794-V834 WeakPolarHBondContact O-CA 3.41Å; Q794-C835 HydrophobicContact CB-CB 4.44Å; Q794-C835 PolarHBondContact N-O 2.87Å; Q794-C835 VanDerWaalsContact N-O 3.08Å; Q794-C835 PolarHBondContact O-N 3.18Å; Q794-L837 HydrophobicContact CB-CD1 3.8Å; Q794-L837 VanDerWaalsContact CB-CD1 3.42Å; Q794-L837 HydrophobicContact CG-CD1 4.49Å; Q794-H880 PolarHBondContact NE2-O 2.88Å; Q794-H880 VanDerWaalsContact NE2-O 3.16Å
795	F	60	Low	55.8	Low	61 Å²	61	41.6 Å²	41.6	27%	0.268	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	118.9	168.3	-65.7	-86.8	0	0	0	110.5	L781 F782 L784 L793 F797 H833 V834	L781-F795 CarbonylContact C-O 3.39Å; L781-F795 WeakPolarHBondContact CA-O 3.27Å; F782-F795 HydrophobicContact CB-CB 4.26Å; F782-F795 HydrophobicContact CB-CD2 4.39Å; F782-F795 HydrophobicContact CD2-CB 4.45Å; F782-F795 PolarHBondContact N-O 3.21Å; F782-F795 PolarHBondContact O-N 3.07Å; L784-F795 HydrophobicContact CD1-CD2 4.3Å; L784-F795 HydrophobicContact CD1-CE2 3.94Å; L784-F795 HydrophobicContact CG-CE2 4.47Å; L793-F795 HydrophobicContact CD2-CD1 4.38Å; L793-F795 HydrophobicContact CD2-CD2 4.15Å; L793-F795 HydrophobicContact CD2-CE1 3.96Å; L793-F795 HydrophobicContact CD2-CE2 3.42Å; L793-F795 HydrophobicContact CD2-CG 4.32Å; L793-F795 HydrophobicContact CD2-CZ 3.49Å; L793-F795 VanDerWaalsContact CD2-CZ 3.44Å; L793-F795 HydrophobicContact CG-CD2 4.34Å; L793-F795 HydrophobicContact CG-CE2 3.75Å; L793-F795 HydrophobicContact CG-CZ 4.08Å; F795-F797 HydrophobicContact CB-CE2 4.1Å; F795-H833 CarbonylContact C-O 3.51Å; F795-H833 VanDerWaalsContact CA-O 3.29Å; F795-H833 WeakPolarHBondContact CA-O 3.4Å; F795-V834 HydrophobicContact CD1-CB 4.33Å; F795-V834 HydrophobicContact CD1-CG1 4.17Å; F795-V834 HydrophobicContact CD1-CG2 3.69Å; F795-V834 HydrophobicContact CE1-CB 4.28Å; F795-V834 HydrophobicContact CE1-CG1 3.98Å; F795-V834 HydrophobicContact CE1-CG2 3.75Å; F795-V834 HydrophobicContact CZ-CG1 4.27Å
796	G	59.7	Low	55.9	Low	5.33333 Å²	5.33333	41.5 Å²	41.5	6%	0.055	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	135.7	173.6	0	0	0	0	0	112.5	I780 I832 H833	I780-G796 CarbonylContact O-C 3.49Å; I780-G796 WeakPolarHBondContact O-CA 3.47Å; G796-I832 WeakPolarHBondContact O-CA 3.46Å; G796-H833 PolarHBondContact N-O 3Å; G796-H833 VanDerWaalsContact N-O 3.08Å; G796-H833 PolarHBondContact O-N 3.38Å
797	F	61.2	Low	56.1	Low	45.6667 Å²	45.6667	41.4 Å²	41.4	20%	0.2	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	141.2	170.4	-60	-88.1	0	0	0	110.3	Q779 I780 L781 F782 F795 L829 N831 I832	Q779-F797 PolarHBondContact N-O 3.23Å; I780-F797 HydrophobicContact CB-CB 4.29Å; I780-F797 HydrophobicContact CB-CD2 4.39Å; I780-F797 HydrophobicContact CG2-CD2 4.34Å; I780-F797 PolarHBondContact N-O 3.31Å; I780-F797 VanDerWaalsContact N-O 3.17Å; I780-F797 PolarHBondContact O-N 3.32Å; L781-F797 HydrophobicContact CB-CB 4.41Å; L781-F797 HydrophobicContact CB-CD2 3.63Å; L781-F797 HydrophobicContact CB-CE2 4.37Å; L781-F797 HydrophobicContact CB-CG 4.43Å; L781-F797 HydrophobicContact CD2-CB 4.45Å; L781-F797 HydrophobicContact CD2-CD2 3.87Å; L781-F797 HydrophobicContact CD2-CE2 4.35Å; L781-F797 HydrophobicContact CD2-CG 4.27Å; L781-F797 HydrophobicContact CG-CD2 4.38Å; F782-F797 HydrophobicContact CD2-CD2 4.26Å; F782-F797 AromaticContact CD2-CE2 3.89Å; F782-F797 HydrophobicContact CD2-CE2 3.89Å; F782-F797 HydrophobicContact CE2-CD2 4.1Å; F782-F797 AromaticContact CE2-CE2 3.81Å; F782-F797 HydrophobicContact CE2-CE2 3.81Å; F795-F797 HydrophobicContact CB-CE2 4.1Å; F797-L829 HydrophobicContact CD1-CD1 4.15Å; F797-L829 HydrophobicContact CD1-CD2 3.83Å; F797-L829 HydrophobicContact CE1-CD2 4.08Å; F797-N831 WeakPolarHBondContact CA-O 3.49Å; F797-I832 HydrophobicContact CD1-CB 4.49Å; F797-I832 HydrophobicContact CD1-CD1 4.29Å; F797-I832 HydrophobicContact CD1-CG1 3.9Å; F797-I832 HydrophobicContact CE1-CB 4.35Å; F797-I832 HydrophobicContact CE1-CD1 3.9Å; F797-I832 HydrophobicContact CE1-CG1 3.86Å; F797-I832 HydrophobicContact CE1-CG2 4.28Å
798	T	59.7	Low	56.1	Low	15.6667 Å²	15.6667	40.2 Å²	40.2	10%	0.096	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	139.8	176.2	72.6	0	0	0	0	111.3	P778 Q779 S800 S830 N831 L882	P778-T798 HydrophobicContact CB-CG2 3.75Å; P778-T798 HydrophobicContact CG-CG2 3.14Å; Q779-T798 HydrophobicContact CG-CG2 4.1Å; T798-S800 PolarHBondContact O-N 3.01Å; T798-S800 VanDerWaalsContact O-N 3.13Å; T798-S830 PolarHBondContact N-O 2.87Å; T798-S830 PolarHBondContact O-N 2.75Å; T798-S830 PolarHBondContact O-OG 3.27Å; T798-S830 PolarHBondContact OG1-OG 2.89Å; T798-N831 HydrophobicContact CG2-CB 3.87Å; T798-N831 PolarHBondContact N-O 3.45Å; T798-N831 VanDerWaalsContact OG1-CB 3.24Å; T798-N831 WeakPolarHBondContact OG1-CB 3.34Å; T798-N831 PolarHBondContact OG1-N 2.9Å; T798-N831 VanDerWaalsContact OG1-N 3.17Å; T798-N831 PolarHBondContact OG1-ND2 3.1Å; T798-N831 VanDerWaalsContact OG1-ND2 3.13Å; T798-L882 HydrophobicContact CG2-CD1 3.85Å
799	N	56.1	Low	56	Low	89.6667 Å²	89.6667	43.4 Å²	43.4	48%	0.48	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	40	60.4	178	-66.6	-5.5	0	0	0	113.8	F695 G696 N697 Q779 S830	F695-N799 CarbonylContact O-C 3.53Å; F695-N799 VanDerWaalsContact O-CA 3.28Å; F695-N799 WeakPolarHBondContact O-CA 3.35Å; F695-N799 PolarHBondContact O-N 3.45Å; G696-N799 WeakPolarHBondContact CA-OD1 3.36Å; N697-N799 PolarHBondContact N-OD1 2.93Å; Q779-N799 PolarHBondContact NE2-OD1 3.39Å; Q779-N799 PolarHBondContact OE1-OD1 3.08Å; Q779-N799 VanDerWaalsContact OE1-OD1 3.13Å; N799-S830 WeakPolarHBondContact CB-OG 3.38Å; N799-S830 PolarHBondContact N-OG 2.89Å; N799-S830 PolarHBondContact O-N 3.17Å; N799-S830 PolarHBondContact O-OG 2.71Å; N799-S830 VanDerWaalsContact O-OG 3.1Å
800	S	58.3	Low	55.8	Low	7.33333 Å²	7.33333	43.5 Å²	43.5	5%	0.051	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	134.2	175.8	51.2	0	0	0	0	111.8	Y694 F695 T798 K828	Y694-S800 CarbonylContact C-O 3.47Å; F695-S800 VanDerWaalsContact CB-OG 3.23Å; F695-S800 WeakPolarHBondContact CB-OG 3.45Å; F695-S800 VanDerWaalsContact CD2-OG 3.25Å; F695-S800 WeakPolarHBondContact CD2-OG 3.24Å; F695-S800 WeakPolarHBondContact CG-OG 3.48Å; F695-S800 PolarHBondContact N-O 3.3Å; F695-S800 PolarHBondContact O-N 3Å; F695-S800 VanDerWaalsContact O-N 3.16Å; T798-S800 PolarHBondContact O-N 3.01Å; T798-S800 VanDerWaalsContact O-N 3.13Å; S800-K828 CarbonylContact C-O 3.54Å; S800-K828 WeakPolarHBondContact CA-O 3.4Å
801	L	58.5	Low	55.2	Low	47 Å²	47	45.3 Å²	45.3	25%	0.246	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	118.6	175	173.2	66.8	0	0	0	108.8	R692 I693 Y694 K828	R692-L801 HydrophobicContact CB-CD1 4.22Å; R692-L801 HydrophobicContact CG-CD1 4.15Å; I693-L801 CarbonylContact O-C 3.43Å; I693-L801 WeakPolarHBondContact O-CA 3.3Å; Y694-L801 HydrophobicContact CD1-CB 4.5Å; Y694-L801 HydrophobicContact CD1-CD1 3.79Å; Y694-L801 HydrophobicContact CD2-CD1 4.07Å; Y694-L801 HydrophobicContact CE1-CD1 3.57Å; Y694-L801 HydrophobicContact CE1-CD2 3.98Å; Y694-L801 HydrophobicContact CE1-CG 4.24Å; Y694-L801 HydrophobicContact CE2-CD1 3.85Å; Y694-L801 HydrophobicContact CG-CD1 4.04Å; L801-K828 CarbonylContact C-O 3.5Å; L801-K828 HydrophobicContact CB-CB 4.41Å; L801-K828 PolarHBondContact N-O 3.09Å; L801-K828 CarbonylContact O-C 3.52Å; L801-K828 PolarHBondContact O-N 2.93Å
802	V	58.8	Low	54.5	Low	26.25 Å²	26.25	51.8 Å²	51.8	16%	0.159	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	113	170.9	-170.9	0	0	0	0	107.7	R692 I693 F695 L804 L827	R692-V802 CarbonylContact C-O 3.56Å; R692-V802 WeakPolarHBondContact CA-O 3.24Å; I693-V802 HydrophobicContact CB-CB 4.28Å; I693-V802 HydrophobicContact CB-CG2 4.36Å; I693-V802 PolarHBondContact N-O 3.24Å; I693-V802 PolarHBondContact O-N 2.94Å; F695-V802 HydrophobicContact CE2-CG2 4.18Å; V802-L804 HydrophobicContact CG1-CD1 4.37Å; V802-L804 HydrophobicContact CG1-CD2 4.16Å; V802-L804 HydrophobicContact CG1-CG 4.05Å; V802-L827 HydrophobicContact CB-CD1 4.18Å; V802-L827 HydrophobicContact CG1-CD1 4.28Å; V802-L827 HydrophobicContact CG2-CD1 3.7Å
803	N	58.3	Low	53.8	Low	23.5 Å²	23.5	55.2 Å²	55.2	13%	0.126	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	111.7	176.1	-172.9	84.4	0	0	0	109.4	N690 V691 R692 N826	N690-N803 PolarHBondContact OD1-ND2 2.88Å; N690-N803 PolarHBondContact OD1-OD1 3.27Å; V691-N803 CarbonylContact O-C 3.52Å; V691-N803 WeakPolarHBondContact O-CA 3.44Å; R692-N803 HydrophobicContact CG-CB 4.33Å; R692-N803 WeakPolarHBondContact CG-OD1 3.29Å; R692-N803 PolarHBondContact NE-OD1 3.22Å; R692-N803 PolarHBondContact NH2-OD1 3.28Å; N803-N826 HydrophobicContact CB-CB 4.37Å; N803-N826 PolarHBondContact N-O 3.37Å; N803-N826 VanDerWaalsContact N-O 3.13Å; N803-N826 CarbonylContact O-C 3.36Å; N803-N826 PolarHBondContact O-N 3.12Å; N803-N826 VanDerWaalsContact O-N 3.16Å
804	L	55.2	Low	52.8	Low	42 Å²	42	62.3 Å²	62.3	22%	0.22	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	116.9	179.9	-58.1	169.7	0	0	0	108.9	N690 V691 V802 F806 L825	N690-L804 CarbonylContact C-O 3.51Å; N690-L804 WeakPolarHBondContact CA-O 3.39Å; N690-L804 PolarHBondContact OD1-O 3.23Å; V691-L804 HydrophobicContact CB-CB 4.35Å; V691-L804 PolarHBondContact N-O 3.25Å; V691-L804 PolarHBondContact O-N 2.96Å; V802-L804 HydrophobicContact CG1-CD1 4.37Å; V802-L804 HydrophobicContact CG1-CD2 4.16Å; V802-L804 HydrophobicContact CG1-CG 4.05Å; L804-F806 HydrophobicContact CB-CD2 4.28Å; L804-F806 HydrophobicContact CB-CE2 3.52Å; L804-F806 VanDerWaalsContact CB-CE2 3.46Å; L804-F806 HydrophobicContact CB-CZ 4.09Å; L804-F806 HydrophobicContact CD1-CE2 4.32Å; L804-F806 HydrophobicContact CD1-CZ 4.24Å; L804-F806 HydrophobicContact CG-CE2 4.43Å; L804-L825 HydrophobicContact CD2-CB 4.21Å; L804-L825 HydrophobicContact CD2-CD1 3.53Å; L804-L825 VanDerWaalsContact CD2-CD1 3.4Å; L804-L825 HydrophobicContact CD2-CG 3.7Å
805	Q	56.9	Low	51.7	Low	56.75 Å²	56.75	67.5 Å²	67.5	27%	0.265	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	126	175.3	-177.3	170.3	-19.9	0	0	110.1	Q688 L689 N690 D807 T823 D824	Q688-Q805 VanDerWaalsContact OE1-NE2 3.12Å; L689-Q805 WeakPolarHBondContact O-CA 3.44Å; N690-Q805 PolarHBondContact ND2-OE1 2.91Å; N690-Q805 VanDerWaalsContact OD1-CG 3.29Å; N690-Q805 WeakPolarHBondContact OD1-CG 3.25Å; Q805-D807 PolarHBondContact NE2-OD1 3.39Å; Q805-T823 WeakPolarHBondContact O-CB 3.38Å; Q805-D824 HydrophobicContact CB-CB 4.25Å; Q805-D824 PolarHBondContact N-O 3.15Å; Q805-D824 PolarHBondContact O-N 3.02Å; Q805-D824 VanDerWaalsContact O-N 3.13Å
806	F	55.2	Low	50.9	Low	39 Å²	39	69.3 Å²	69.3	17%	0.171	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	127.1	-179.7	-40.7	-95.2	0	0	0	111.1	Q688 L689 V691 L804 F808 L811 L819 T823	Q688-F806 CarbonylContact C-O 3.53Å; Q688-F806 VanDerWaalsContact CA-O 3.23Å; Q688-F806 WeakPolarHBondContact CA-O 3.46Å; L689-F806 HydrophobicContact CB-CB 4.41Å; L689-F806 HydrophobicContact CB-CD2 3.77Å; L689-F806 HydrophobicContact CB-CE1 4.3Å; L689-F806 HydrophobicContact CB-CE2 3.43Å; L689-F806 VanDerWaalsContact CB-CE2 3.43Å; L689-F806 HydrophobicContact CB-CG 4.38Å; L689-F806 HydrophobicContact CB-CZ 3.78Å; L689-F806 HydrophobicContact CD2-CD2 3.87Å; L689-F806 HydrophobicContact CD2-CE1 3.99Å; L689-F806 HydrophobicContact CD2-CE2 4.12Å; L689-F806 VanDerWaalsContact CD2-CE2 3.45Å; L689-F806 HydrophobicContact CD2-CZ 3.13Å; L689-F806 HydrophobicContact CG-CE1 4.47Å; L689-F806 HydrophobicContact CG-CE2 4.01Å; L689-F806 HydrophobicContact CG-CZ 3.9Å; L689-F806 PolarHBondContact N-O 3.01Å; L689-F806 PolarHBondContact O-N 3.06Å; V691-F806 HydrophobicContact CG2-CE1 4.26Å; V691-F806 HydrophobicContact CG2-CE2 4.16Å; L804-F806 HydrophobicContact CB-CD2 4.28Å; L804-F806 HydrophobicContact CB-CE2 3.52Å; L804-F806 VanDerWaalsContact CB-CE2 3.46Å; L804-F806 HydrophobicContact CB-CZ 4.09Å; L804-F806 HydrophobicContact CD1-CE2 4.32Å; L804-F806 HydrophobicContact CD1-CZ 4.24Å; L804-F806 HydrophobicContact CG-CE2 4.43Å; F806-F808 HydrophobicContact CB-CD2 4.19Å; F806-F808 HydrophobicContact CB-CE1 4.43Å; F806-F808 HydrophobicContact CB-CE2 3.64Å; F806-F808 VanDerWaalsContact CB-CE2 3.49Å; F806-F808 HydrophobicContact CB-CZ 4.03Å; F806-F808 HydrophobicContact CD1-CZ 4.39Å; F806-F808 HydrophobicContact CE2-CE1 4.17Å; F806-F808 HydrophobicContact CE2-CZ 4.36Å; F806-F808 HydrophobicContact CG-CE2 4.45Å; F806-F808 HydrophobicContact CG-CZ 4.2Å; F806-F808 WeakPolarHBondContact O-CD2 3.21Å; F806-L811 HydrophobicContact CD2-CD1 3.49Å; F806-L811 VanDerWaalsContact CD2-CD1 3.49Å; F806-L811 HydrophobicContact CD2-CG 4.46Å; F806-L811 HydrophobicContact CE2-CD1 3.43Å; F806-L811 VanDerWaalsContact CE2-CD1 3.43Å; F806-L811 HydrophobicContact CZ-CD1 4.5Å; F806-L819 HydrophobicContact CD1-CD1 4.07Å; F806-L819 HydrophobicContact CE1-CD1 3.97Å; F806-L819 HydrophobicContact CE1-CD2 4.18Å; F806-L819 HydrophobicContact CE1-CG 4.19Å; F806-T823 HydrophobicContact CB-CG2 3.9Å; F806-T823 HydrophobicContact CD1-CG2 3.46Å; F806-T823 HydrophobicContact CE1-CG2 3.76Å; F806-T823 HydrophobicContact CG-CG2 4.28Å; F806-T823 HydrophobicContact CZ-CG2 4.25Å
807	D	51.8	Low	50	Low	66 Å²	66	75.5 Å²	75.5	35%	0.353	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	109	172.6	-82.1	11.7	0	0	0	109.4	Q688 Q805 H809 E810	Q688-D807 WeakPolarHBondContact CG-OD1 3.33Å; Q688-D807 VanDerWaalsContact NE2-CG 3.29Å; Q688-D807 PolarHBondContact NE2-OD1 2.95Å; Q688-D807 VanDerWaalsContact NE2-OD1 3.13Å; Q688-D807 PolarHBondContact NE2-OD2 3.09Å; Q805-D807 PolarHBondContact NE2-OD1 3.39Å; D807-H809 PolarHBondContact O-N 3.25Å; D807-H809 VanDerWaalsContact O-N 3.09Å; D807-E810 PolarHBondContact O-N 2.84Å
808	F	49.1	Very low	49.1	Very low	38.5 Å²	38.5	75.7 Å²	75.7	17%	0.169	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-73	-3.4	-175.8	-77.2	-77.9	0	0	0	114.5	I679 L684 N685 R687 L689 F806 E810 L811	I679-F808 HydrophobicContact CD1-CD1 4.42Å; I679-F808 HydrophobicContact CD1-CE1 3.92Å; I679-F808 HydrophobicContact CG2-CD1 4.05Å; I679-F808 HydrophobicContact CG2-CE1 4.05Å; L684-F808 HydrophobicContact CB-CD2 4.31Å; L684-F808 HydrophobicContact CB-CE2 3.84Å; L684-F808 HydrophobicContact CB-CZ 4.14Å; L684-F808 HydrophobicContact CD1-CZ 4.45Å; L684-F808 VanDerWaalsContact O-CB 3.32Å; L684-F808 WeakPolarHBondContact O-CB 3.31Å; L684-F808 WeakPolarHBondContact O-CD2 3.31Å; L684-F808 WeakPolarHBondContact O-CG 3.5Å; N685-F808 CarbonylContact C-O 3.56Å; R687-F808 WeakPolarHBondContact O-CB 3.2Å; R687-F808 VanDerWaalsContact O-CD2 3.32Å; R687-F808 WeakPolarHBondContact O-CD2 3.39Å; R687-F808 PolarHBondContact O-N 2.9Å; R687-F808 VanDerWaalsContact O-N 3.1Å; L689-F808 HydrophobicContact CB-CD2 4.22Å; L689-F808 HydrophobicContact CB-CE2 3.67Å; L689-F808 HydrophobicContact CB-CZ 3.8Å; L689-F808 HydrophobicContact CD1-CE2 3.85Å; L689-F808 HydrophobicContact CD1-CZ 3.95Å; L689-F808 HydrophobicContact CD2-CE2 4.14Å; L689-F808 HydrophobicContact CD2-CZ 4.06Å; L689-F808 HydrophobicContact CG-CE2 4.19Å; L689-F808 HydrophobicContact CG-CZ 4.03Å; F806-F808 HydrophobicContact CB-CD2 4.19Å; F806-F808 HydrophobicContact CB-CE1 4.43Å; F806-F808 HydrophobicContact CB-CE2 3.64Å; F806-F808 VanDerWaalsContact CB-CE2 3.49Å; F806-F808 HydrophobicContact CB-CZ 4.03Å; F806-F808 HydrophobicContact CD1-CZ 4.39Å; F806-F808 HydrophobicContact CE2-CE1 4.17Å; F806-F808 HydrophobicContact CE2-CZ 4.36Å; F806-F808 HydrophobicContact CG-CE2 4.45Å; F806-F808 HydrophobicContact CG-CZ 4.2Å; F806-F808 WeakPolarHBondContact O-CD2 3.21Å; F808-E810 VanDerWaalsContact C-N 3.31Å; F808-E810 PolarHBondContact O-N 2.89Å; F808-L811 HydrophobicContact CB-CD1 4.17Å; F808-L811 HydrophobicContact CD1-CB 4.44Å; F808-L811 HydrophobicContact CD1-CD1 3.6Å; F808-L811 VanDerWaalsContact CD1-CD1 3.48Å; F808-L811 HydrophobicContact CE1-CD1 4.09Å; F808-L811 HydrophobicContact CG-CD1 3.97Å; F808-L811 PolarHBondContact O-N 3.23Å
809	H	45.1	Very low	48.3	Very low	137.75 Å²	137.75	78.2 Å²	78.2	64%	0.638	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-68	-21.7	-171.5	-85.2	-68.1	0	0	0	115.6	N685 T686 D807	N685-H809 PolarHBondContact O-CE1 2.71Å; N685-H809 PolarHBondContact O-ND1 2.69Å; N685-H809 PolarHBondContact O-NE2 2.63Å; T686-H809 VanDerWaalsContact C-CE1 3.46Å; T686-H809 PolarHBondContact O-CE1 2.78Å; T686-H809 PolarHBondContact O-ND1 3.37Å; T686-H809 PolarHBondContact O-NE2 3.1Å; D807-H809 PolarHBondContact O-N 3.25Å; D807-H809 VanDerWaalsContact O-N 3.09Å
810	E	42.7	Very low	47.9	Very low	147.25 Å²	147.25	78.5 Å²	78.5	69%	0.688	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-116.2	8.4	-178.3	-67.1	-167.6	146.4	0	0	114.3	D807 F808 N812 L822	D807-E810 PolarHBondContact O-N 2.84Å; F808-E810 VanDerWaalsContact C-N 3.31Å; F808-E810 PolarHBondContact O-N 2.89Å; E810-N812 PolarHBondContact O-N 3.09Å; E810-L822 HydrophobicContact CB-CD2 4.21Å
811	L	38.9	Very low	47.6	Very low	44.25 Å²	44.25	80 Å²	80	23%	0.232	40%	0.399	C	S	.	.			trans	-78.8	68.1	-171.8	-82.9	171	0	0	0	114	F676 F806 F808 L813 L819 L822	F676-L811 VanDerWaalsContact CZ-O 3.31Å; F676-L811 WeakPolarHBondContact CZ-O 3.49Å; F806-L811 HydrophobicContact CD2-CD1 3.49Å; F806-L811 VanDerWaalsContact CD2-CD1 3.49Å; F806-L811 HydrophobicContact CD2-CG 4.46Å; F806-L811 HydrophobicContact CE2-CD1 3.43Å; F806-L811 VanDerWaalsContact CE2-CD1 3.43Å; F806-L811 HydrophobicContact CZ-CD1 4.5Å; F808-L811 HydrophobicContact CB-CD1 4.17Å; F808-L811 HydrophobicContact CD1-CB 4.44Å; F808-L811 HydrophobicContact CD1-CD1 3.6Å; F808-L811 VanDerWaalsContact CD1-CD1 3.48Å; F808-L811 HydrophobicContact CE1-CD1 4.09Å; F808-L811 HydrophobicContact CG-CD1 3.97Å; F808-L811 PolarHBondContact O-N 3.23Å; L811-L813 VanDerWaalsContact C-N 3.29Å; L811-L813 HydrophobicContact CB-CD1 4Å; L811-L813 HydrophobicContact CB-CG 3.99Å; L811-L813 HydrophobicContact CD1-CD1 4.05Å; L811-L813 HydrophobicContact CD2-CD1 4.13Å; L811-L813 HydrophobicContact CD2-CD2 4.01Å; L811-L813 HydrophobicContact CD2-CG 3.99Å; L811-L813 HydrophobicContact CG-CD1 4.35Å; L811-L813 HydrophobicContact CG-CG 4.4Å; L811-L813 PolarHBondContact O-N 3.15Å; L811-L819 HydrophobicContact CD2-CD1 3.7Å; L811-L819 HydrophobicContact CG-CD1 3.89Å; L811-L822 HydrophobicContact CD2-CB 4.15Å; L811-L822 HydrophobicContact CD2-CD1 4.24Å; L811-L822 HydrophobicContact CD2-CD2 4.2Å; L811-L822 HydrophobicContact CD2-CG 4.44Å; L811-L822 HydrophobicContact CG-CD2 4.48Å
812	N	40.8	Very low	47.1	Very low	147.25 Å²	147.25	81 Å²	81	79%	0.787	40%	0.404	S	S	*	.			trans	-77.3	66.3	164.9	-139.8	-17.5	0	0	0	110	E810 K814 K815	E810-N812 PolarHBondContact O-N 3.09Å; N812-K814 PolarHBondContact O-N 3.36Å; N812-K815 PolarHBondContact O-N 2.87Å; N812-K815 VanDerWaalsContact O-N 3.13Å
813	L	41.2	Very low	47.1	Very low	76 Å²	76	80.4 Å²	80.4	40%	0.398	40%	0.401	S	S	.	.			trans	-62.4	77.1	-170.7	-86.7	164	0	0	0	114.1	Y630 F676 L811 K815 D818 L819	Y630-L813 PolarHBondContact OH-O 3.32Å; Y630-L813 VanDerWaalsContact OH-O 3.13Å; F676-L813 HydrophobicContact CE2-CB 4.3Å; F676-L813 HydrophobicContact CE2-CD1 3.69Å; F676-L813 HydrophobicContact CE2-CG 4.49Å; F676-L813 HydrophobicContact CZ-CB 4.48Å; F676-L813 HydrophobicContact CZ-CD1 4.02Å; L811-L813 VanDerWaalsContact C-N 3.29Å; L811-L813 HydrophobicContact CB-CD1 4Å; L811-L813 HydrophobicContact CB-CG 3.99Å; L811-L813 HydrophobicContact CD1-CD1 4.05Å; L811-L813 HydrophobicContact CD2-CD1 4.13Å; L811-L813 HydrophobicContact CD2-CD2 4.01Å; L811-L813 HydrophobicContact CD2-CG 3.99Å; L811-L813 HydrophobicContact CG-CD1 4.35Å; L811-L813 HydrophobicContact CG-CG 4.4Å; L811-L813 PolarHBondContact O-N 3.15Å; L813-K815 VanDerWaalsContact CD2-O 3.31Å; L813-K815 WeakPolarHBondContact CD2-O 3.37Å; L813-K815 PolarHBondContact O-N 2.88Å; L813-D818 HydrophobicContact CD2-CB 4.01Å; L813-L819 HydrophobicContact CD1-CD1 4.07Å; L813-L819 HydrophobicContact CD2-CD1 3.96Å
814	K	40.2	Very low	47.2	Very low	184 Å²	184	81.4 Å²	81.4	80%	0.8	41%	0.406	S	S	*	.	S	Bend	trans	-91.5	-14.7	162.8	-81.3	-174.6	176.3	177.8	0	113.8	Y630 N812	Y630-K814 PolarHBondContact OH-O 2.91Å; N812-K814 PolarHBondContact O-N 3.36Å
815	K	39.2	Very low	47.6	Very low	117.75 Å²	117.75	81.3 Å²	81.3	51%	0.512	41%	0.405	S	S	.	.			trans	-138.2	130.6	-177.2	-61.7	-178.5	-178.1	175.1	0	111.3	N812 L813 F817 D818 L819	N812-K815 PolarHBondContact O-N 2.87Å; N812-K815 VanDerWaalsContact O-N 3.13Å; L813-K815 VanDerWaalsContact CD2-O 3.31Å; L813-K815 WeakPolarHBondContact CD2-O 3.37Å; L813-K815 PolarHBondContact O-N 2.88Å; K815-F817 VanDerWaalsContact C-N 3.33Å; K815-F817 PolarHBondContact O-N 3.24Å; K815-D818 HydrophobicContact CB-CB 3.67Å; K815-D818 HydrophobicContact CD-CB 4.11Å; K815-D818 VanDerWaalsContact CD-CG 3.44Å; K815-D818 WeakPolarHBondContact CD-OD2 3.32Å; K815-D818 WeakPolarHBondContact CE-OD2 3.24Å; K815-D818 IonicContact NZ-OD2 2.86Å; K815-D818 PolarHBondContact NZ-OD2 2.86Å; K815-D818 PolarHBondContact O-N 3.16Å; K815-D818 VanDerWaalsContact O-N 3.07Å; K815-L819 PolarHBondContact O-N 3.45Å
816	S	41.9	Very low	48.1	Very low	98 Å²	98	81.2 Å²	81.2	69%	0.685	41%	0.407	S	S	*	.	S	Bend	trans	-74.5	-20.4	-175.8	52.5	0	0	0	0	114.4	L819	S816-L819 VanDerWaalsContact O-CB 3.3Å; S816-L819 WeakPolarHBondContact O-CB 3.34Å; S816-L819 PolarHBondContact O-N 3.22Å
817	F	40.2	Very low	48.7	Very low	135 Å²	135	81.3 Å²	81.3	59%	0.592	41%	0.409	S	S	*	.	H	α-helix	trans	-78.4	-27.6	-179	-106.7	-85.3	0	0	0	113.5	K815 L819 L820 P1008	K815-F817 VanDerWaalsContact C-N 3.33Å; K815-F817 PolarHBondContact O-N 3.24Å; F817-L819 PolarHBondContact O-N 2.98Å; F817-L819 VanDerWaalsContact O-N 3.13Å; F817-L820 PolarHBondContact O-N 2.88Å; F817-P1008 HydrophobicContact CD2-CB 4.3Å
818	D	43.2	Very low	49.3	Very low	51.5 Å²	51.5	82 Å²	82	28%	0.275	41%	0.409	S	S	.	.	H	α-helix	trans	-65.7	-24.7	178	-59.5	-25.7	0	0	0	111.1	L813 K815 L820 N821 L822	L813-D818 HydrophobicContact CD2-CB 4.01Å; K815-D818 HydrophobicContact CB-CB 3.67Å; K815-D818 HydrophobicContact CD-CB 4.11Å; K815-D818 VanDerWaalsContact CD-CG 3.44Å; K815-D818 WeakPolarHBondContact CD-OD2 3.32Å; K815-D818 WeakPolarHBondContact CE-OD2 3.24Å; K815-D818 IonicContact NZ-OD2 2.86Å; K815-D818 PolarHBondContact NZ-OD2 2.86Å; K815-D818 PolarHBondContact O-N 3.16Å; K815-D818 VanDerWaalsContact O-N 3.07Å; D818-L820 VanDerWaalsContact C-N 3.31Å; D818-L820 PolarHBondContact O-N 2.81Å; D818-N821 CarbonylContact O-C 3.46Å; D818-N821 PolarHBondContact O-N 3.29Å; D818-L822 HydrophobicContact CB-CD1 4.1Å; D818-L822 HydrophobicContact CB-CG 4.37Å; D818-L822 WeakPolarHBondContact O-CB 3.28Å; D818-L822 VanDerWaalsContact O-CD1 3.3Å; D818-L822 WeakPolarHBondContact O-CD1 3.11Å; D818-L822 VanDerWaalsContact O-CG 3.3Å; D818-L822 WeakPolarHBondContact O-CG 3.26Å; D818-L822 PolarHBondContact O-N 3.17Å; D818-L822 VanDerWaalsContact O-N 3.1Å
819	L	43.8	Very low	50.1	Low	66.5 Å²	66.5	81.6 Å²	81.6	35%	0.348	41%	0.408	S	S	.	.	H	α-helix	trans	-62.5	-34.1	177.1	-159.1	97.6	0	0	0	112.4	F806 L811 L813 K815 S816 F817 N821 L822 T823	F806-L819 HydrophobicContact CD1-CD1 4.07Å; F806-L819 HydrophobicContact CE1-CD1 3.97Å; F806-L819 HydrophobicContact CE1-CD2 4.18Å; F806-L819 HydrophobicContact CE1-CG 4.19Å; L811-L819 HydrophobicContact CD2-CD1 3.7Å; L811-L819 HydrophobicContact CG-CD1 3.89Å; L813-L819 HydrophobicContact CD1-CD1 4.07Å; L813-L819 HydrophobicContact CD2-CD1 3.96Å; K815-L819 PolarHBondContact O-N 3.45Å; S816-L819 VanDerWaalsContact O-CB 3.3Å; S816-L819 WeakPolarHBondContact O-CB 3.34Å; S816-L819 PolarHBondContact O-N 3.22Å; F817-L819 PolarHBondContact O-N 2.98Å; F817-L819 VanDerWaalsContact O-N 3.13Å; L819-N821 VanDerWaalsContact C-N 3.29Å; L819-N821 PolarHBondContact O-N 3.21Å; L819-N821 VanDerWaalsContact O-N 3.13Å; L819-L822 PolarHBondContact O-N 3.28Å; L819-T823 HydrophobicContact CD1-CG2 4.31Å; L819-T823 HydrophobicContact CG-CG2 4.29Å; L819-T823 VanDerWaalsContact O-CB 3.29Å; L819-T823 WeakPolarHBondContact O-CB 3.26Å; L819-T823 VanDerWaalsContact O-CG2 3.26Å; L819-T823 WeakPolarHBondContact O-CG2 3.36Å; L819-T823 PolarHBondContact O-N 3.25Å; L819-T823 VanDerWaalsContact O-N 3.15Å; L819-T823 PolarHBondContact O-OG1 3.08Å
820	L	47.4	Very low	51.1	Low	97.75 Å²	97.75	76.6 Å²	76.6	51%	0.512	39%	0.388	S	S	.	.	H	α-helix	trans	-80	-24.8	177.7	-82.5	162.4	0	0	0	113.2	F817 D818 T823 L825 N903	F817-L820 PolarHBondContact O-N 2.88Å; D818-L820 VanDerWaalsContact C-N 3.31Å; D818-L820 PolarHBondContact O-N 2.81Å; L820-T823 PolarHBondContact O-OG1 3.27Å; L820-L825 HydrophobicContact CD2-CD1 4.34Å; L820-N903 PolarHBondContact O-ND2 3.15Å
821	N	50.3	Low	52.2	Low	38.75 Å²	38.75	71 Å²	71	21%	0.207	36%	0.364	C	S	.	.	H	α-helix	trans	-92.6	-18.6	-177.1	-67.9	-15.7	0	0	0	113.4	D818 L819 K905 Y906	D818-N821 CarbonylContact O-C 3.46Å; D818-N821 PolarHBondContact O-N 3.29Å; L819-N821 VanDerWaalsContact C-N 3.29Å; L819-N821 PolarHBondContact O-N 3.21Å; L819-N821 VanDerWaalsContact O-N 3.13Å; N821-K905 CarbonylContact C-O 3.57Å; N821-K905 CarbonylContact O-C 3.54Å; N821-K905 WeakPolarHBondContact O-CA 3.34Å; N821-Y906 HydrophobicContact CB-CD1 4.29Å; N821-Y906 HydrophobicContact CB-CE1 3.92Å
822	L	49.8	Very low	53.7	Low	67.75 Å²	67.75	70.2 Å²	70.2	36%	0.355	36%	0.359	S	S	.	.	H	α-helix	trans	-103.8	-8.7	178.3	-71.1	153.6	0	0	0	113.1	E810 L811 D818 L819	E810-L822 HydrophobicContact CB-CD2 4.21Å; L811-L822 HydrophobicContact CD2-CB 4.15Å; L811-L822 HydrophobicContact CD2-CD1 4.24Å; L811-L822 HydrophobicContact CD2-CD2 4.2Å; L811-L822 HydrophobicContact CD2-CG 4.44Å; L811-L822 HydrophobicContact CG-CD2 4.48Å; D818-L822 HydrophobicContact CB-CD1 4.1Å; D818-L822 HydrophobicContact CB-CG 4.37Å; D818-L822 WeakPolarHBondContact O-CB 3.28Å; D818-L822 VanDerWaalsContact O-CD1 3.3Å; D818-L822 WeakPolarHBondContact O-CD1 3.11Å; D818-L822 VanDerWaalsContact O-CG 3.3Å; D818-L822 WeakPolarHBondContact O-CG 3.26Å; D818-L822 PolarHBondContact O-N 3.17Å; D818-L822 VanDerWaalsContact O-N 3.1Å; L819-L822 PolarHBondContact O-N 3.28Å
823	T	56.9	Low	55	Low	12.75 Å²	12.75	63.4 Å²	63.4	8%	0.078	32%	0.323	C	S	.	.	S	Bend	trans	-97.8	136	-176.5	55.9	0	0	0	0	112.9	Q805 F806 L819 L820 L825 N903	Q805-T823 WeakPolarHBondContact O-CB 3.38Å; F806-T823 HydrophobicContact CB-CG2 3.9Å; F806-T823 HydrophobicContact CD1-CG2 3.46Å; F806-T823 HydrophobicContact CE1-CG2 3.76Å; F806-T823 HydrophobicContact CG-CG2 4.28Å; F806-T823 HydrophobicContact CZ-CG2 4.25Å; L819-T823 HydrophobicContact CD1-CG2 4.31Å; L819-T823 HydrophobicContact CG-CG2 4.29Å; L819-T823 VanDerWaalsContact O-CB 3.29Å; L819-T823 WeakPolarHBondContact O-CB 3.26Å; L819-T823 VanDerWaalsContact O-CG2 3.26Å; L819-T823 WeakPolarHBondContact O-CG2 3.36Å; L819-T823 PolarHBondContact O-N 3.25Å; L819-T823 VanDerWaalsContact O-N 3.15Å; L819-T823 PolarHBondContact O-OG1 3.08Å; L820-T823 PolarHBondContact O-OG1 3.27Å; T823-L825 PolarHBondContact O-N 3.27Å; T823-N903 PolarHBondContact O-ND2 3.25Å
824	D	60.7	Low	56.2	Low	44 Å²	44	60.8 Å²	60.8	24%	0.235	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	106.2	171.5	-71.6	-13.1	0	0	0	109.1	Q805 N903 H904	Q805-D824 HydrophobicContact CB-CB 4.25Å; Q805-D824 PolarHBondContact N-O 3.15Å; Q805-D824 PolarHBondContact O-N 3.02Å; Q805-D824 VanDerWaalsContact O-N 3.13Å; D824-N903 VanDerWaalsContact CA-O 3.32Å; D824-N903 WeakPolarHBondContact CA-O 3.42Å; D824-H904 VanDerWaalsContact CG-ND1 3.32Å; D824-H904 WeakPolarHBondContact OD1-CA 3.3Å; D824-H904 IonicContact OD1-CD2 3.3Å; D824-H904 PolarHBondContact OD1-CD2 3.39Å; D824-H904 VanDerWaalsContact OD1-CD2 3.27Å; D824-H904 IonicContact OD1-CE1 3.17Å; D824-H904 IonicContact OD1-CG 3.04Å; D824-H904 IonicContact OD1-ND1 3.4Å; D824-H904 PolarHBondContact OD1-ND1 2.91Å; D824-H904 IonicContact OD2-CD2 3.19Å; D824-H904 PolarHBondContact OD2-CD2 3.38Å; D824-H904 IonicContact OD2-CE1 3.29Å; D824-H904 PolarHBondContact OD2-CE1 2.94Å; D824-H904 IonicContact OD2-ND1 3.57Å; D824-H904 PolarHBondContact OD2-ND1 3.43Å
825	L	63.7	Low	57.4	Low	40.75 Å²	40.75	52.4 Å²	52.4	21%	0.213	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	124.6	-178	-178.5	150.2	0	0	0	109.4	L804 L820 T823 L827 W902 N903	L804-L825 HydrophobicContact CD2-CB 4.21Å; L804-L825 HydrophobicContact CD2-CD1 3.53Å; L804-L825 VanDerWaalsContact CD2-CD1 3.4Å; L804-L825 HydrophobicContact CD2-CG 3.7Å; L820-L825 HydrophobicContact CD2-CD1 4.34Å; T823-L825 PolarHBondContact O-N 3.27Å; L825-L827 HydrophobicContact CD2-CB 3.97Å; L825-W902 CarbonylContact O-C 3.48Å; L825-W902 WeakPolarHBondContact O-CA 3.33Å; L825-N903 HydrophobicContact CB-CB 4.22Å; L825-N903 PolarHBondContact N-O 2.9Å; L825-N903 VanDerWaalsContact N-O 3.14Å; L825-N903 PolarHBondContact O-N 3.14Å
826	N	67.8	Low	58.5	Low	54.25 Å²	54.25	46.9 Å²	46.9	29%	0.29	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	102.1	174.7	-150.5	-27.5	0	0	0	109.5	N803 K828 I901 W902	N803-N826 HydrophobicContact CB-CB 4.37Å; N803-N826 PolarHBondContact N-O 3.37Å; N803-N826 VanDerWaalsContact N-O 3.13Å; N803-N826 CarbonylContact O-C 3.36Å; N803-N826 PolarHBondContact O-N 3.12Å; N803-N826 VanDerWaalsContact O-N 3.16Å; N826-K828 WeakPolarHBondContact OD1-CE 3.46Å; N826-K828 WeakPolarHBondContact OD1-CG 3.26Å; N826-I901 CarbonylContact C-O 3.55Å; N826-I901 VanDerWaalsContact CA-O 3.3Å; N826-I901 WeakPolarHBondContact CA-O 3.43Å; N826-W902 WeakPolarHBondContact OD1-CB 3.5Å; N826-W902 VanDerWaalsContact OD1-CD1 3.25Å; N826-W902 PolarHBondContact OD1-NE1 2.9Å
827	L	68.5	Low	59.3	Low	41.5 Å²	41.5	43.1 Å²	43.1	22%	0.217	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	120.3	179.2	172.8	107.3	0	0	0	108.9	V802 L825 L829 D900 I901	V802-L827 HydrophobicContact CB-CD1 4.18Å; V802-L827 HydrophobicContact CG1-CD1 4.28Å; V802-L827 HydrophobicContact CG2-CD1 3.7Å; L825-L827 HydrophobicContact CD2-CB 3.97Å; L827-L829 HydrophobicContact CD1-CD1 4.33Å; L827-L829 HydrophobicContact CD1-CG 4.45Å; L827-L829 HydrophobicContact CD2-CD1 3.67Å; L827-L829 VanDerWaalsContact CD2-CD1 3.42Å; L827-L829 HydrophobicContact CD2-CG 3.75Å; L827-L829 HydrophobicContact CG-CD1 3.91Å; L827-L829 HydrophobicContact CG-CG 4.4Å; L827-D900 CarbonylContact O-C 3.57Å; L827-D900 WeakPolarHBondContact O-CA 3.36Å; L827-I901 HydrophobicContact CB-CB 4.31Å; L827-I901 HydrophobicContact CD2-CB 4.19Å; L827-I901 HydrophobicContact CD2-CD1 4.03Å; L827-I901 HydrophobicContact CD2-CG1 4.09Å; L827-I901 PolarHBondContact N-O 3.11Å; L827-I901 PolarHBondContact O-N 3.13Å
828	K	64.6	Low	60	Low	81.5 Å²	81.5	41.2 Å²	41.2	35%	0.354	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	117.7	177.1	-58.3	-160.7	166.2	-129.7	0	110.5	S800 L801 N826 I899 D900	S800-K828 CarbonylContact C-O 3.54Å; S800-K828 WeakPolarHBondContact CA-O 3.4Å; L801-K828 CarbonylContact C-O 3.5Å; L801-K828 HydrophobicContact CB-CB 4.41Å; L801-K828 PolarHBondContact N-O 3.09Å; L801-K828 CarbonylContact O-C 3.52Å; L801-K828 PolarHBondContact O-N 2.93Å; N826-K828 WeakPolarHBondContact OD1-CE 3.46Å; N826-K828 WeakPolarHBondContact OD1-CG 3.26Å; K828-I899 CarbonylContact C-O 3.54Å; K828-I899 VanDerWaalsContact CA-O 3.29Å; K828-I899 WeakPolarHBondContact CA-O 3.24Å; K828-D900 WeakPolarHBondContact CB-OD1 3.45Å; K828-D900 VanDerWaalsContact CD-OD1 3.27Å; K828-D900 WeakPolarHBondContact CD-OD1 3.44Å; K828-D900 WeakPolarHBondContact CE-OD1 3.33Å; K828-D900 VanDerWaalsContact CG-OD1 3.24Å; K828-D900 WeakPolarHBondContact CG-OD1 3.37Å; K828-D900 IonicContact NZ-OD1 3.49Å; K828-D900 PolarHBondContact NZ-OD1 3.08Å; K828-D900 IonicContact NZ-OD2 3.01Å; K828-D900 PolarHBondContact NZ-OD2 2.92Å
829	L	65.3	Low	60.5	Low	30 Å²	30	43.1 Å²	43.1	16%	0.157	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	133	176.2	-85.4	139.2	0	0	0	109.6	F797 L827 N831 I832 G898 I899	F797-L829 HydrophobicContact CD1-CD1 4.15Å; F797-L829 HydrophobicContact CD1-CD2 3.83Å; F797-L829 HydrophobicContact CE1-CD2 4.08Å; L827-L829 HydrophobicContact CD1-CD1 4.33Å; L827-L829 HydrophobicContact CD1-CG 4.45Å; L827-L829 HydrophobicContact CD2-CD1 3.67Å; L827-L829 VanDerWaalsContact CD2-CD1 3.42Å; L827-L829 HydrophobicContact CD2-CG 3.75Å; L827-L829 HydrophobicContact CG-CD1 3.91Å; L827-L829 HydrophobicContact CG-CG 4.4Å; L829-N831 WeakPolarHBondContact CD2-O 3.48Å; L829-I832 HydrophobicContact CB-CD1 3.91Å; L829-I832 HydrophobicContact CB-CG1 4.37Å; L829-I832 HydrophobicContact CD1-CD1 4.07Å; L829-I832 HydrophobicContact CD2-CB 4.46Å; L829-I832 HydrophobicContact CD2-CD1 3.99Å; L829-I832 HydrophobicContact CD2-CG1 3.68Å; L829-I832 HydrophobicContact CG-CD1 4.48Å; L829-G898 CarbonylContact O-C 3.52Å; L829-G898 VanDerWaalsContact O-CA 3.3Å; L829-G898 WeakPolarHBondContact O-CA 3.36Å; L829-I899 HydrophobicContact CB-CB 4.3Å; L829-I899 HydrophobicContact CD2-CD1 4.18Å; L829-I899 PolarHBondContact N-O 2.98Å; L829-I899 PolarHBondContact O-N 2.82Å
830	S	66.8	Low	60.6	Low	31.25 Å²	31.25	42.9 Å²	42.9	22%	0.219	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	-130	-178.7	63.4	0	0	0	0	113.1	T798 N799 H897 G898	T798-S830 PolarHBondContact N-O 2.87Å; T798-S830 PolarHBondContact O-N 2.75Å; T798-S830 PolarHBondContact O-OG 3.27Å; T798-S830 PolarHBondContact OG1-OG 2.89Å; N799-S830 WeakPolarHBondContact CB-OG 3.38Å; N799-S830 PolarHBondContact N-OG 2.89Å; N799-S830 PolarHBondContact O-N 3.17Å; N799-S830 PolarHBondContact O-OG 2.71Å; N799-S830 VanDerWaalsContact O-OG 3.1Å; S830-H897 CarbonylContact C-O 3.51Å; S830-H897 WeakPolarHBondContact CA-O 3.37Å; S830-H897 WeakPolarHBondContact CB-O 3.25Å; S830-H897 CarbonylContact O-C 3.58Å; S830-H897 WeakPolarHBondContact O-CA 3.37Å; S830-H897 PolarHBondContact O-ND1 3.14Å; S830-H897 VanDerWaalsContact O-ND1 3.16Å; S830-G898 PolarHBondContact O-N 3.42Å
831	N	65.7	Low	60.3	Low	31 Å²	31	44.9 Å²	44.9	17%	0.166	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	135.4	101.3	178	-55.1	-38	0	0	0	112.7	F797 T798 L829 H833 L882 Y895 V896 H897	F797-N831 WeakPolarHBondContact CA-O 3.49Å; T798-N831 HydrophobicContact CG2-CB 3.87Å; T798-N831 PolarHBondContact N-O 3.45Å; T798-N831 VanDerWaalsContact OG1-CB 3.24Å; T798-N831 WeakPolarHBondContact OG1-CB 3.34Å; T798-N831 PolarHBondContact OG1-N 2.9Å; T798-N831 VanDerWaalsContact OG1-N 3.17Å; T798-N831 PolarHBondContact OG1-ND2 3.1Å; T798-N831 VanDerWaalsContact OG1-ND2 3.13Å; L829-N831 WeakPolarHBondContact CD2-O 3.48Å; N831-H833 PolarHBondContact O-N 2.74Å; N831-H833 PolarHBondContact O-ND1 2.96Å; N831-L882 HydrophobicContact CB-CD2 4.17Å; N831-Y895 HydrophobicContact CB-CE2 4.27Å; N831-Y895 PolarHBondContact OD1-OH 2.86Å; N831-V896 CarbonylContact C-O 3.52Å; N831-V896 VanDerWaalsContact CA-O 3.28Å; N831-V896 WeakPolarHBondContact CA-O 3.36Å; N831-V896 PolarHBondContact N-O 3.23Å; N831-H897 PolarHBondContact N-O 3.18Å; N831-H897 PolarHBondContact OD1-CE1 3.03Å; N831-H897 PolarHBondContact OD1-ND1 3.05Å
832	I	69.3	Low	59.6	Low	26.5 Å²	26.5	45.6 Å²	45.6	14%	0.136	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	125.7	163.9	-60	179.5	0	0	0	108	G796 F797 L829 V834 F894 Y895 V896 I899	G796-I832 WeakPolarHBondContact O-CA 3.46Å; F797-I832 HydrophobicContact CD1-CB 4.49Å; F797-I832 HydrophobicContact CD1-CD1 4.29Å; F797-I832 HydrophobicContact CD1-CG1 3.9Å; F797-I832 HydrophobicContact CE1-CB 4.35Å; F797-I832 HydrophobicContact CE1-CD1 3.9Å; F797-I832 HydrophobicContact CE1-CG1 3.86Å; F797-I832 HydrophobicContact CE1-CG2 4.28Å; L829-I832 HydrophobicContact CB-CD1 3.91Å; L829-I832 HydrophobicContact CB-CG1 4.37Å; L829-I832 HydrophobicContact CD1-CD1 4.07Å; L829-I832 HydrophobicContact CD2-CB 4.46Å; L829-I832 HydrophobicContact CD2-CD1 3.99Å; L829-I832 HydrophobicContact CD2-CG1 3.68Å; L829-I832 HydrophobicContact CG-CD1 4.48Å; I832-V834 HydrophobicContact CG2-CG2 4.24Å; I832-F894 HydrophobicContact CG2-CD1 4.4Å; I832-F894 HydrophobicContact CG2-CE1 4.15Å; I832-Y895 CarbonylContact O-C 3.59Å; I832-Y895 VanDerWaalsContact O-CA 3.32Å; I832-Y895 WeakPolarHBondContact O-CA 3.14Å; I832-Y895 WeakPolarHBondContact O-CD2 3.38Å; I832-V896 HydrophobicContact CB-CB 4.41Å; I832-V896 PolarHBondContact N-O 3.19Å; I832-V896 PolarHBondContact O-N 2.88Å; I832-I899 HydrophobicContact CB-CD1 4.24Å; I832-I899 HydrophobicContact CD1-CD1 3.35Å; I832-I899 HydrophobicContact CD1-CG1 4.1Å; I832-I899 HydrophobicContact CG1-CD1 3.53Å; I832-I899 VanDerWaalsContact CG1-CD1 3.5Å
833	H	67.7	Low	59	Low	5.25 Å²	5.25	47.3 Å²	47.3	2%	0.024	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	137.9	176.9	158	-109.5	0	0	0	110.7	F795 G796 N831 C835 L882 P883 D892 F894 Y895	F795-H833 CarbonylContact C-O 3.51Å; F795-H833 VanDerWaalsContact CA-O 3.29Å; F795-H833 WeakPolarHBondContact CA-O 3.4Å; G796-H833 PolarHBondContact N-O 3Å; G796-H833 VanDerWaalsContact N-O 3.08Å; G796-H833 PolarHBondContact O-N 3.38Å; N831-H833 PolarHBondContact O-N 2.74Å; N831-H833 PolarHBondContact O-ND1 2.96Å; H833-C835 WeakPolarHBondContact CE1-CB 3.48Å; H833-L882 HydrophobicContact CB-CD2 4.1Å; H833-P883 VanDerWaalsContact CD2-CD 3.47Å; H833-P883 WeakPolarHBondContact CD2-CD 3.44Å; H833-P883 VanDerWaalsContact CD2-CG 3.49Å; H833-P883 WeakPolarHBondContact CD2-CG 3.48Å; H833-P883 WeakPolarHBondContact NE2-CD 3.48Å; H833-D892 IonicContact CD2-OD1 2.96Å; H833-D892 IonicContact CD2-OD2 3.34Å; H833-D892 IonicContact CE1-OD1 3.23Å; H833-D892 PolarHBondContact CE1-OD1 2.75Å; H833-D892 IonicContact CE1-OD2 2.72Å; H833-D892 VanDerWaalsContact NE2-CG 3.35Å; H833-D892 IonicContact NE2-OD1 3.74Å; H833-D892 PolarHBondContact NE2-OD1 2.97Å; H833-D892 IonicContact NE2-OD2 3.16Å; H833-D892 PolarHBondContact NE2-OD2 3.48Å; H833-F894 CarbonylContact C-O 3.49Å; H833-F894 VanDerWaalsContact CA-O 3.3Å; H833-F894 WeakPolarHBondContact CA-O 3.32Å; H833-Y895 HydrophobicContact CB-CD2 4.2Å; H833-Y895 AromaticContact CD2-CD2 3.83Å
834	V	67.3	Low	58.2	Low	20.75 Å²	20.75	50.9 Å²	50.9	13%	0.126	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	114.7	174.6	-170.5	0	0	0	0	109.2	L793 Q794 F795 I832 L893 F894	L793-V834 HydrophobicContact CD1-CG1 3.74Å; L793-V834 HydrophobicContact CD2-CG1 3.98Å; L793-V834 HydrophobicContact CG-CG1 4.33Å; Q794-V834 VanDerWaalsContact O-CA 3.29Å; Q794-V834 WeakPolarHBondContact O-CA 3.41Å; F795-V834 HydrophobicContact CD1-CB 4.33Å; F795-V834 HydrophobicContact CD1-CG1 4.17Å; F795-V834 HydrophobicContact CD1-CG2 3.69Å; F795-V834 HydrophobicContact CE1-CB 4.28Å; F795-V834 HydrophobicContact CE1-CG1 3.98Å; F795-V834 HydrophobicContact CE1-CG2 3.75Å; F795-V834 HydrophobicContact CZ-CG1 4.27Å; I832-V834 HydrophobicContact CG2-CG2 4.24Å; V834-L893 HydrophobicContact CB-CB 4.46Å; V834-L893 HydrophobicContact CG1-CB 4.48Å; V834-L893 HydrophobicContact CG1-CD1 4.22Å; V834-L893 WeakPolarHBondContact O-CB 3.48Å; V834-L893 PolarHBondContact O-N 3.24Å; V834-F894 HydrophobicContact CB-CB 4.18Å; V834-F894 HydrophobicContact CG2-CB 4.18Å; V834-F894 HydrophobicContact CG2-CD1 4.09Å; V834-F894 PolarHBondContact N-O 3.22Å; V834-F894 PolarHBondContact O-N 2.9Å
835	C	64.3	Low	57	Low	7 Å²	7	56.3 Å²	56.3	5%	0.047	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	150	-175.8	-154.5	0	0	0	0	111.3	Q794 H833 D892	Q794-C835 HydrophobicContact CB-CB 4.44Å; Q794-C835 PolarHBondContact N-O 2.87Å; Q794-C835 VanDerWaalsContact N-O 3.08Å; Q794-C835 PolarHBondContact O-N 3.18Å; H833-C835 WeakPolarHBondContact CE1-CB 3.48Å; C835-D892 WeakPolarHBondContact CB-OD1 3.33Å; C835-D892 PolarHBondContact SG-OD1 3.05Å
836	L	62.4	Low	55.2	Low	2.25 Å²	2.25	61.4 Å²	61.4	1%	0.012	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	117.8	172.5	-89.9	153.8	0	0	0	110.8	P791 G792 L793 D891 L893 S921 K923 M924 L927	P791-L836 HydrophobicContact CB-CD2 4.03Å; P791-L836 HydrophobicContact CB-CG 4.25Å; P791-L836 HydrophobicContact CG-CD2 4.05Å; G792-L836 CarbonylContact O-C 3.51Å; G792-L836 WeakPolarHBondContact O-CA 3.36Å; L793-L836 HydrophobicContact CB-CD2 4.27Å; L793-L836 HydrophobicContact CD1-CD1 3.9Å; L793-L836 HydrophobicContact CD1-CD2 4.17Å; L793-L836 HydrophobicContact CD1-CG 4.36Å; L793-L836 HydrophobicContact CG-CD2 4.3Å; L836-D891 HydrophobicContact CB-CB 4.27Å; L836-D891 PolarHBondContact N-O 3.15Å; L836-L893 HydrophobicContact CD1-CD1 3.57Å; L836-L893 VanDerWaalsContact CD1-CD1 3.45Å; L836-L893 HydrophobicContact CD1-CD2 3.84Å; L836-L893 HydrophobicContact CD1-CG 4.06Å; L836-L893 HydrophobicContact CD2-CD1 4.03Å; L836-L893 HydrophobicContact CG-CD1 3.73Å; L836-L893 HydrophobicContact CG-CD2 4.39Å; L836-L893 HydrophobicContact CG-CG 3.99Å; L836-S921 WeakPolarHBondContact CD1-OG 3.41Å; L836-K923 HydrophobicContact CB-CB 4.34Å; L836-K923 HydrophobicContact CB-CD 4.12Å; L836-K923 HydrophobicContact CD1-CB 3.8Å; L836-K923 HydrophobicContact CD2-CB 3.46Å; L836-K923 VanDerWaalsContact CD2-CB 3.46Å; L836-K923 HydrophobicContact CG-CB 4.45Å; L836-K923 PolarHBondContact O-NZ 3.02Å; L836-M924 HydrophobicContact CD1-CB 4.15Å; L836-L927 HydrophobicContact CD1-CB 4.08Å; L836-L927 HydrophobicContact CD1-CD1 4Å; L836-L927 HydrophobicContact CD1-CD2 4.35Å; L836-L927 HydrophobicContact CD2-CB 4.37Å; L836-L927 HydrophobicContact CD2-CD1 4.19Å; L836-L927 HydrophobicContact CD2-CD2 4.33Å
837	L	58.7	Low	53.4	Low	18.25 Å²	18.25	67.1 Å²	67.1	10%	0.096	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	141.6	175.2	-84.7	120.8	0	0	0	111	V783 P791 G792 Q794 I840 L878	V783-L837 HydrophobicContact CG1-CD1 3.88Å; V783-L837 HydrophobicContact CG1-CD2 4.01Å; P791-L837 CarbonylContact C-O 3.55Å; P791-L837 VanDerWaalsContact CA-O 3.28Å; P791-L837 WeakPolarHBondContact CA-O 3.23Å; P791-L837 WeakPolarHBondContact CB-O 3.36Å; G792-L837 PolarHBondContact N-O 3.05Å; G792-L837 VanDerWaalsContact N-O 3.1Å; G792-L837 PolarHBondContact O-N 3.09Å; Q794-L837 HydrophobicContact CB-CD1 3.8Å; Q794-L837 VanDerWaalsContact CB-CD1 3.42Å; Q794-L837 HydrophobicContact CG-CD1 4.49Å; L837-I840 HydrophobicContact CD2-CG1 4.39Å; L837-L878 HydrophobicContact CD2-CB 4.19Å; L837-L878 VanDerWaalsContact CD2-O 3.27Å; L837-L878 WeakPolarHBondContact CD2-O 3.27Å
838	D	56.4	Low	51.4	Low	96.5 Å²	96.5	70.1 Å²	70.1	52%	0.516	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-67.1	160.8	173.5	-76	-21.2	0	0	0	112.5	I840 L878 K923	D838-I840 PolarHBondContact O-N 3.11Å; D838-I840 VanDerWaalsContact O-N 3.08Å; D838-L878 HydrophobicContact CB-CD2 4.46Å; D838-K923 WeakPolarHBondContact OD1-CE 3.36Å; D838-K923 IonicContact OD1-NZ 3.03Å; D838-K923 PolarHBondContact OD1-NZ 3.18Å; D838-K923 IonicContact OD2-NZ 3.22Å; D838-K923 PolarHBondContact OD2-NZ 3.13Å
839	K	52.1	Low	49.8	Very low	90.25 Å²	90.25	74.3 Å²	74.3	39%	0.392	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-61.3	125.1	176	-66.7	170	-177.5	154.8	0	109.6	K789 H841 E926	K789-K839 VanDerWaalsContact O-CD 3.3Å; K789-K839 WeakPolarHBondContact O-CD 3.4Å; K789-K839 WeakPolarHBondContact O-CE 3.35Å; K789-K839 WeakPolarHBondContact O-CG 3.38Å; K839-H841 VanDerWaalsContact C-N 3.3Å; K839-H841 HydrophobicContact CB-CB 4.44Å; K839-H841 PolarHBondContact O-N 3.25Å; K839-E926 WeakPolarHBondContact CE-OE2 3.29Å; K839-E926 IonicContact NZ-OE1 2.96Å; K839-E926 PolarHBondContact NZ-OE1 3.19Å; K839-E926 IonicContact NZ-OE2 2.88Å; K839-E926 PolarHBondContact NZ-OE2 3.26Å
840	I	47.7	Very low	48	Very low	63 Å²	63	79.1 Å²	79.1	32%	0.323	43%	0.43	S	S	.	.			trans	-69.6	66.7	179.3	-57.4	175	0	0	0	109.7	I785 L837 D838 G842 F845 L878	I785-I840 HydrophobicContact CD1-CD1 3.94Å; L837-I840 HydrophobicContact CD2-CG1 4.39Å; D838-I840 PolarHBondContact O-N 3.11Å; D838-I840 VanDerWaalsContact O-N 3.08Å; I840-G842 PolarHBondContact O-N 3.08Å; I840-F845 HydrophobicContact CG2-CE2 4.08Å; I840-L878 HydrophobicContact CD1-CD1 4.14Å; I840-L878 HydrophobicContact CG1-CD1 4.22Å; I840-L878 HydrophobicContact CG1-CD2 4.05Å; I840-L878 HydrophobicContact CG2-CD1 4.15Å; I840-L878 HydrophobicContact CG2-CD2 4.17Å
841	H	39.4	Very low	46.1	Very low	140 Å²	140	82.5 Å²	82.5	65%	0.648	45%	0.454	S	S	*	.			trans	-106.4	104.6	-179.1	-120.8	-71.6	0	0	0	112.9	K839 S843 I844	K839-H841 VanDerWaalsContact C-N 3.3Å; K839-H841 HydrophobicContact CB-CB 4.44Å; K839-H841 PolarHBondContact O-N 3.25Å; H841-S843 PolarHBondContact O-N 2.96Å; H841-I844 PolarHBondContact O-N 3.39Å
842	G	37.4	Very low	44.3	Very low	52.5 Å²	52.5	90.2 Å²	90.2	54%	0.541	49%	0.489	S	S	.	.	G	3₁₀ helix	trans	-135.4	-29.2	168.8	0	0	0	0	0	117.2	I840 I844 F845	I840-G842 PolarHBondContact O-N 3.08Å; G842-I844 PolarHBondContact O-N 3.13Å; G842-F845 WeakPolarHBondContact O-CB 3.48Å; G842-F845 PolarHBondContact O-N 3.3Å
843	S	36.4	Very low	42.2	Very low	103.25 Å²	103.25	93.4 Å²	93.4	72%	0.722	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-10.3	-170	54	0	0	0	0	115.6	H841 F845	H841-S843 PolarHBondContact O-N 2.96Å; S843-F845 PolarHBondContact O-N 3.34Å
844	I	39.8	Very low	40.4	Very low	88.75 Å²	88.75	98.8 Å²	98.8	46%	0.455	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.4	-11.5	-176.7	-61.4	176	0	0	0	112.7	H841 G842 N846 A874	H841-I844 PolarHBondContact O-N 3.39Å; G842-I844 PolarHBondContact O-N 3.13Å; I844-N846 VanDerWaalsContact C-N 3.33Å; I844-N846 PolarHBondContact O-N 3.07Å; I844-A874 HydrophobicContact CG2-CB 4.29Å
845	F	34.7	Very low	38.4	Very low	157 Å²	157	103 Å²	103	69%	0.689	59%	0.586	S	S	*	*	S	Bend	trans	-104.3	4.1	-173.2	-79.8	-76.4	0	0	0	116	I840 G842 S843 E847	I840-F845 HydrophobicContact CG2-CE2 4.08Å; G842-F845 WeakPolarHBondContact O-CB 3.48Å; G842-F845 PolarHBondContact O-N 3.3Å; S843-F845 PolarHBondContact O-N 3.34Å; F845-E847 VanDerWaalsContact C-N 3.33Å; F845-E847 PolarHBondContact O-N 3.47Å
846	N	28	Very low	36.6	Very low	148.75 Å²	148.75	110.6 Å²	110.6	80%	0.795	63%	0.625	S	S	*	*			trans	-103.2	36.5	-177.3	-89.4	4.1	0	0	0	114.6	I844 S848	I844-N846 VanDerWaalsContact C-N 3.33Å; I844-N846 PolarHBondContact O-N 3.07Å; N846-S848 PolarHBondContact O-N 3.01Å; N846-S848 VanDerWaalsContact O-N 3.11Å
847	E	29.8	Very low	34.8	Very low	173.5 Å²	173.5	115.6 Å²	115.6	81%	0.811	66%	0.66	S	S	*	*			trans	-98.3	101.6	162	-90.2	-174.5	174.1	0	0	109.7	F845 H849	F845-E847 VanDerWaalsContact C-N 3.33Å; F845-E847 PolarHBondContact O-N 3.47Å; E847-H849 VanDerWaalsContact C-N 3.28Å; E847-H849 PolarHBondContact O-N 3.25Å
848	S	26.1	Very low	33.2	Very low	104.5 Å²	104.5	122.3 Å²	122.3	73%	0.731	70%	0.695	S	S	*	*			trans	-91.2	82.1	179.2	55.4	0	0	0	0	111.7	N846	N846-S848 PolarHBondContact O-N 3.01Å; N846-S848 VanDerWaalsContact O-N 3.11Å
849	H	31.6	Very low	31.8	Very low	169.75 Å²	169.75	122.7 Å²	122.7	79%	0.786	70%	0.703	S	S	*	*			trans	-105.3	101.1	164	-76.4	-63	0	0	0	110.8	E847 S851	E847-H849 VanDerWaalsContact C-N 3.28Å; E847-H849 PolarHBondContact O-N 3.25Å; H849-S851 PolarHBondContact O-N 3.21Å
850	T	25.7	Very low	30.6	Very low	130.25 Å²	130.25	127.5 Å²	127.5	80%	0.799	73%	0.726	S	S	*	*			trans	-56	116.7	165.8	49.7	0	0	0	0	113.9
851	S	27.1	Very low	29.5	Very low	103.5 Å²	103.5	129 Å²	129	72%	0.724	74%	0.742	S	S	*	*			trans	151.2	131.1	154	69.2	0	0	0	0	114.2	H849 A853	H849-S851 PolarHBondContact O-N 3.21Å; S851-A853 PolarHBondContact O-N 2.93Å; S851-A853 VanDerWaalsContact O-N 3.17Å
852	Q	28.3	Very low	28.8	Very low	192 Å²	192	133.2 Å²	133.2	90%	0.897	75%	0.754	S	S	*	*			trans	21	121.3	160.7	-64.8	176.4	-11.6	0	0	114.3	P854	Q852-P854 VanDerWaalsContact O-CD 3.27Å; Q852-P854 WeakPolarHBondContact O-CD 3.27Å
853	A	26.3	Very low	28.5	Very low	94.25 Å²	94.25	134.7 Å²	134.7	78%	0.779	76%	0.756	S	S	*	*			trans	-90.5	149.8	163.4	0	0	0	0	0	110.3	S851	S851-A853 PolarHBondContact O-N 2.93Å; S851-A853 VanDerWaalsContact O-N 3.17Å
854	P	30	Very low	28.1	Very low	118.5 Å²	118.5	135.3 Å²	135.3	77%	0.769	75%	0.751	S	S	*	*				-122.7	135.6	126.6	33	-22.8	0	0	0	113.4	Q852 L856	Q852-P854 VanDerWaalsContact O-CD 3.27Å; Q852-P854 WeakPolarHBondContact O-CD 3.27Å; P854-L856 PolarHBondContact O-N 3.06Å; P854-L856 VanDerWaalsContact O-N 3.11Å
855	S	23.9	Very low	27.6	Very low	110 Å²	110	138.5 Å²	138.5	77%	0.769	76%	0.759	S	S	*	*			trans	-14.8	113.9	159.5	55.6	0	0	0	0	117
856	L	26.7	Very low	27.3	Very low	166.75 Å²	166.75	135.2 Å²	135.2	87%	0.873	75%	0.754	S	S	*	*			trans	-152.8	132.8	138.3	-104.8	145.3	0	0	0	109	P854 L858	P854-L856 PolarHBondContact O-N 3.06Å; P854-L856 VanDerWaalsContact O-N 3.11Å; L856-L858 VanDerWaalsContact C-N 3.27Å; L856-L858 HydrophobicContact CB-CD1 4.36Å; L856-L858 PolarHBondContact O-N 3.01Å
857	S	24.1	Very low	27.5	Very low	107.25 Å²	107.25	132.7 Å²	132.7	75%	0.75	74%	0.74	S	S	*	*			trans	-80.1	116.3	-175.9	53	0	0	0	0	112.4
858	L	26.2	Very low	27.6	Very low	159 Å²	159	131.3 Å²	131.3	83%	0.832	73%	0.728	S	S	*	*			trans	-141.9	151.9	154.1	-117.7	83.7	0	0	0	109.5	L856 H860	L856-L858 VanDerWaalsContact C-N 3.27Å; L856-L858 HydrophobicContact CB-CD1 4.36Å; L856-L858 PolarHBondContact O-N 3.01Å; L858-H860 PolarHBondContact O-N 2.86Å
859	P	27.3	Very low	28	Very low	103 Å²	103	130.2 Å²	130.2	67%	0.669	72%	0.719	S	S	*	*			trans	-96.2	164.1	-150.7	30.6	-22.9	0	0	0	114.1	S861	P859-S861 PolarHBondContact O-N 3.18Å; P859-S861 VanDerWaalsContact O-N 3.14Å; P859-S861 PolarHBondContact O-OG 2.88Å
860	H	25.6	Very low	28.2	Very low	192.5 Å²	192.5	128.8 Å²	128.8	89%	0.891	72%	0.717	S	S	*	*			trans	-29.7	100.1	172.7	-64.1	-71.7	0	0	0	118.2	L858	L858-H860 PolarHBondContact O-N 2.86Å
861	S	24.4	Very low	28.7	Very low	94 Å²	94	126.5 Å²	126.5	66%	0.657	70%	0.697	S	S	*	*			trans	-164.8	50.9	163.1	61.2	0	0	0	0	114.6	P859 S863	P859-S861 PolarHBondContact O-N 3.18Å; P859-S861 VanDerWaalsContact O-N 3.14Å; P859-S861 PolarHBondContact O-OG 2.88Å; S861-S863 VanDerWaalsContact C-N 3.27Å; S861-S863 PolarHBondContact O-N 3.17Å; S861-S863 VanDerWaalsContact O-N 3.1Å
862	Y	26.5	Very low	29.4	Very low	227.75 Å²	227.75	124.2 Å²	124.2	89%	0.893	68%	0.682	S	S	*	*			trans	-72	93.9	159.8	-75.9	-74.8	0	0	0	109.8	L864	Y862-L864 PolarHBondContact O-N 3.31Å
863	S	29.6	Very low	30	Very low	84.75 Å²	84.75	120.5 Å²	120.5	59%	0.593	67%	0.668	S	S	*	*			trans	-71.6	135	172.3	60	0	0	0	0	110.6	S861 Y865 S866	S861-S863 VanDerWaalsContact C-N 3.27Å; S861-S863 PolarHBondContact O-N 3.17Å; S861-S863 VanDerWaalsContact O-N 3.1Å; S863-Y865 PolarHBondContact O-N 3.04Å; S863-S866 PolarHBondContact O-N 3.07Å; S863-S866 PolarHBondContact O-OG 3.3Å
864	L	28.7	Very low	30.8	Very low	116.5 Å²	116.5	117.5 Å²	117.5	61%	0.61	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58	12.6	-178.5	-74.5	154.4	0	0	0	116	L788 Y862 S866 I867 R868	L788-L864 HydrophobicContact CD1-CD1 3.63Å; L788-L864 HydrophobicContact CD1-CD2 3.69Å; L788-L864 HydrophobicContact CD2-CD1 3.38Å; L788-L864 HydrophobicContact CD2-CD2 4.16Å; L788-L864 HydrophobicContact CD2-CG 4.26Å; L788-L864 HydrophobicContact CG-CD1 4.12Å; L788-L864 HydrophobicContact CG-CD2 3.87Å; Y862-L864 PolarHBondContact O-N 3.31Å; L864-S866 PolarHBondContact O-N 2.85Å; L864-I867 PolarHBondContact O-N 2.96Å; L864-R868 WeakPolarHBondContact O-CB 3.42Å; L864-R868 WeakPolarHBondContact O-CG 3.16Å; L864-R868 PolarHBondContact O-N 2.94Å
865	Y	29.3	Very low	31.6	Very low	156 Å²	156	115.1 Å²	115.1	61%	0.612	62%	0.623	S	S	*	*	H	α-helix	trans	-81.7	-25.3	177.1	-129.3	-93.4	0	0	0	112.1	E466 S863 I867 R868 C869	E466-Y865 WeakPolarHBondContact OE1-CD1 3.43Å; E466-Y865 WeakPolarHBondContact OE1-CE1 3.23Å; S863-Y865 PolarHBondContact O-N 3.04Å; Y865-I867 VanDerWaalsContact C-N 3.32Å; Y865-I867 PolarHBondContact O-N 3.32Å; Y865-R868 PolarHBondContact O-N 3.07Å; Y865-C869 HydrophobicContact CD1-CB 4.42Å; Y865-C869 HydrophobicContact CE1-CB 4.09Å; Y865-C869 PolarHBondContact O-N 3.46Å
866	S	29.1	Very low	32.6	Very low	86 Å²	86	114.2 Å²	114.2	60%	0.601	60%	0.603	S	S	*	*	H	α-helix	trans	-60.7	-11.2	179.6	67.4	0	0	0	0	115	S863 L864	S863-S866 PolarHBondContact O-N 3.07Å; S863-S866 PolarHBondContact O-OG 3.3Å; L864-S866 PolarHBondContact O-N 2.85Å
867	I	32.1	Very low	33.6	Very low	97.25 Å²	97.25	110.8 Å²	110.8	50%	0.499	59%	0.593	S	S	.	*	H	α-helix	trans	-86.8	-14.7	171.6	-60.8	174.5	0	0	0	110.3	L788 L864 Y865 C869 Q871	L788-I867 HydrophobicContact CD1-CD1 4.32Å; L864-I867 PolarHBondContact O-N 2.96Å; Y865-I867 VanDerWaalsContact C-N 3.32Å; Y865-I867 PolarHBondContact O-N 3.32Å; I867-C869 WeakPolarHBondContact CG2-SG 3.35Å; I867-C869 PolarHBondContact O-N 2.96Å; I867-Q871 PolarHBondContact O-N 3.05Å
868	R	30.6	Very low	34.7	Very low	144.75 Å²	144.75	108.7 Å²	108.7	55%	0.546	57%	0.573	S	S	.	*	H	α-helix	trans	-71.5	-12.2	-177.8	-78.2	-174.8	177.6	169.7	0.4	112.8	L864 Y865 N870 Q871	L864-R868 WeakPolarHBondContact O-CB 3.42Å; L864-R868 WeakPolarHBondContact O-CG 3.16Å; L864-R868 PolarHBondContact O-N 2.94Å; Y865-R868 PolarHBondContact O-N 3.07Å; R868-N870 PolarHBondContact O-N 3.47Å; R868-Q871 PolarHBondContact O-N 2.99Å; R868-Q871 VanDerWaalsContact O-N 3.13Å
869	C	35	Very low	36	Very low	80.5 Å²	80.5	102.7 Å²	102.7	54%	0.544	54%	0.542	S	S	.	.	H	α-helix	trans	-74	-7.1	-178.1	-70.6	0	0	0	0	112.9	Y865 I867 Q871	Y865-C869 HydrophobicContact CD1-CB 4.42Å; Y865-C869 HydrophobicContact CE1-CB 4.09Å; Y865-C869 PolarHBondContact O-N 3.46Å; I867-C869 WeakPolarHBondContact CG2-SG 3.35Å; I867-C869 PolarHBondContact O-N 2.96Å; C869-Q871 HydrophobicContact CB-CB 4.39Å; C869-Q871 PolarHBondContact O-N 2.99Å
870	N	35.4	Very low	37.1	Very low	141.25 Å²	141.25	102.6 Å²	102.6	76%	0.755	53%	0.532	S	S	*	.	S	Bend	trans	-91.4	-2.2	178.9	-75.7	-8.7	0	0	0	114.1	R868 S872 N873	R868-N870 PolarHBondContact O-N 3.47Å; N870-S872 VanDerWaalsContact C-N 3.32Å; N870-S872 PolarHBondContact O-N 2.93Å; N870-N873 PolarHBondContact O-N 2.89Å
871	Q	37.1	Very low	38.5	Very low	80 Å²	80	100.3 Å²	100.3	37%	0.374	52%	0.522	S	S	.	.			trans	-108.9	32.4	-176.6	-67.3	-172.1	-24.3	0	0	113.2	I867 R868 C869 N873 A874 I875	I867-Q871 PolarHBondContact O-N 3.05Å; R868-Q871 PolarHBondContact O-N 2.99Å; R868-Q871 VanDerWaalsContact O-N 3.13Å; C869-Q871 HydrophobicContact CB-CB 4.39Å; C869-Q871 PolarHBondContact O-N 2.99Å; Q871-N873 PolarHBondContact O-N 2.99Å; Q871-N873 VanDerWaalsContact O-N 3.16Å; Q871-A874 HydrophobicContact CB-CB 3.99Å; Q871-A874 HydrophobicContact CG-CB 4.46Å; Q871-A874 WeakPolarHBondContact O-CB 3.39Å; Q871-A874 PolarHBondContact O-N 3.26Å; Q871-A874 VanDerWaalsContact O-N 3.07Å; Q871-I875 PolarHBondContact O-N 3.14Å
872	S	41.1	Very low	39.9	Very low	57 Å²	57	98 Å²	98	40%	0.399	50%	0.502	S	S	.	.	H	α-helix	trans	-51.5	-38	169.9	51	0	0	0	0	111.9	N870 A874 I875 Y876	N870-S872 VanDerWaalsContact C-N 3.32Å; N870-S872 PolarHBondContact O-N 2.93Å; S872-A874 VanDerWaalsContact C-N 3.28Å; S872-A874 PolarHBondContact O-N 3.05Å; S872-I875 PolarHBondContact O-N 3.02Å; S872-I875 VanDerWaalsContact O-N 3.17Å; S872-Y876 WeakPolarHBondContact O-CB 3.31Å; S872-Y876 WeakPolarHBondContact O-CD2 3.34Å; S872-Y876 PolarHBondContact O-N 3.15Å; S872-Y876 VanDerWaalsContact O-N 3.14Å
873	N	41.5	Very low	41.4	Very low	114.5 Å²	114.5	87.4 Å²	87.4	61%	0.612	46%	0.461	S	S	*	.	H	α-helix	trans	-63.2	-31.5	177.9	-68	-8.6	0	0	0	113.6	N870 Q871 Y876 S877	N870-N873 PolarHBondContact O-N 2.89Å; Q871-N873 PolarHBondContact O-N 2.99Å; Q871-N873 VanDerWaalsContact O-N 3.16Å; N873-Y876 PolarHBondContact O-N 2.78Å; N873-S877 WeakPolarHBondContact O-CB 3.4Å; N873-S877 PolarHBondContact O-N 2.93Å; N873-S877 VanDerWaalsContact O-N 3.15Å; N873-S877 PolarHBondContact O-OG 2.95Å
874	A	43.2	Very low	42.9	Very low	30.75 Å²	30.75	86.8 Å²	86.8	25%	0.254	45%	0.454	S	S	.	.	H	α-helix	trans	-71.9	-39.6	177.5	0	0	0	0	0	111.3	I844 Q871 S872 Y876 S877 L878	I844-A874 HydrophobicContact CG2-CB 4.29Å; Q871-A874 HydrophobicContact CB-CB 3.99Å; Q871-A874 HydrophobicContact CG-CB 4.46Å; Q871-A874 WeakPolarHBondContact O-CB 3.39Å; Q871-A874 PolarHBondContact O-N 3.26Å; Q871-A874 VanDerWaalsContact O-N 3.07Å; S872-A874 VanDerWaalsContact C-N 3.28Å; S872-A874 PolarHBondContact O-N 3.05Å; A874-Y876 VanDerWaalsContact C-N 3.34Å; A874-Y876 PolarHBondContact O-N 2.84Å; A874-S877 WeakPolarHBondContact CA-OG 3.11Å; A874-S877 WeakPolarHBondContact O-CB 3.32Å; A874-S877 PolarHBondContact O-N 3.05Å; A874-S877 PolarHBondContact O-OG 3.01Å; A874-L878 VanDerWaalsContact O-CD1 3.29Å; A874-L878 WeakPolarHBondContact O-CD1 3.39Å; A874-L878 PolarHBondContact O-N 2.79Å
875	I	45.4	Very low	44.4	Very low	67.25 Å²	67.25	84.9 Å²	84.9	35%	0.345	44%	0.444	S	S	.	.	H	α-helix	trans	-65.7	-42.2	174.4	-60	175.8	0	0	0	110.1	F600 Q871 S872 S877 L878 I879	F600-I875 HydrophobicContact CD1-CG2 4.06Å; F600-I875 HydrophobicContact CE1-CG2 3.68Å; F600-I875 HydrophobicContact CZ-CG2 4.31Å; Q871-I875 PolarHBondContact O-N 3.14Å; S872-I875 PolarHBondContact O-N 3.02Å; S872-I875 VanDerWaalsContact O-N 3.17Å; I875-S877 VanDerWaalsContact C-N 3.33Å; I875-S877 PolarHBondContact O-N 2.87Å; I875-L878 WeakPolarHBondContact O-CB 3.43Å; I875-L878 PolarHBondContact O-N 3.05Å; I875-L878 VanDerWaalsContact O-N 3.1Å; I875-I879 HydrophobicContact CG2-CD1 4.3Å; I875-I879 HydrophobicContact CG2-CG1 4.45Å; I875-I879 VanDerWaalsContact O-CG1 3.3Å; I875-I879 WeakPolarHBondContact O-CG1 3.3Å; I875-I879 PolarHBondContact O-N 2.88Å
876	Y	46.3	Very low	46.2	Very low	92.25 Å²	92.25	82.5 Å²	82.5	36%	0.362	44%	0.442	S	S	.	.	H	α-helix	trans	-63.8	-23.7	174.8	-78.9	-64.1	0	0	0	114.2	F600 I777 S872 N873 A874 L878 I879	F600-Y876 HydrophobicContact CE2-CE1 4.49Å; F600-Y876 HydrophobicContact CZ-CE1 4.07Å; I777-Y876 HydrophobicContact CD1-CD1 3.79Å; I777-Y876 HydrophobicContact CD1-CE1 3.32Å; I777-Y876 HydrophobicContact CG1-CD1 4.16Å; I777-Y876 HydrophobicContact CG1-CE1 3.81Å; I777-Y876 HydrophobicContact CG2-CE1 4.09Å; S872-Y876 WeakPolarHBondContact O-CB 3.31Å; S872-Y876 WeakPolarHBondContact O-CD2 3.34Å; S872-Y876 PolarHBondContact O-N 3.15Å; S872-Y876 VanDerWaalsContact O-N 3.14Å; N873-Y876 PolarHBondContact O-N 2.78Å; A874-Y876 VanDerWaalsContact C-N 3.34Å; A874-Y876 PolarHBondContact O-N 2.84Å; Y876-L878 PolarHBondContact O-N 3.13Å; Y876-I879 HydrophobicContact CD1-CD1 3.93Å; Y876-I879 HydrophobicContact CE1-CD1 4.2Å
877	S	47.2	Very low	48.1	Very low	95 Å²	95	80.8 Å²	80.8	66%	0.664	43%	0.426	S	S	*	.	H	α-helix	trans	-83.1	-16.8	173.6	40.2	0	0	0	0	113.7	N873 A874 I875	N873-S877 WeakPolarHBondContact O-CB 3.4Å; N873-S877 PolarHBondContact O-N 2.93Å; N873-S877 VanDerWaalsContact O-N 3.15Å; N873-S877 PolarHBondContact O-OG 2.95Å; A874-S877 WeakPolarHBondContact CA-OG 3.11Å; A874-S877 WeakPolarHBondContact O-CB 3.32Å; A874-S877 PolarHBondContact O-N 3.05Å; A874-S877 PolarHBondContact O-OG 3.01Å; I875-S877 VanDerWaalsContact C-N 3.33Å; I875-S877 PolarHBondContact O-N 2.87Å
878	L	47.5	Very low	50.1	Low	61.75 Å²	61.75	76.2 Å²	76.2	32%	0.323	40%	0.402	S	S	.	.	H	α-helix	trans	-88.3	-16.7	175.1	-95.6	120.8	0	0	0	113.3	L837 D838 I840 A874 I875 Y876 H880	L837-L878 HydrophobicContact CD2-CB 4.19Å; L837-L878 VanDerWaalsContact CD2-O 3.27Å; L837-L878 WeakPolarHBondContact CD2-O 3.27Å; D838-L878 HydrophobicContact CB-CD2 4.46Å; I840-L878 HydrophobicContact CD1-CD1 4.14Å; I840-L878 HydrophobicContact CG1-CD1 4.22Å; I840-L878 HydrophobicContact CG1-CD2 4.05Å; I840-L878 HydrophobicContact CG2-CD1 4.15Å; I840-L878 HydrophobicContact CG2-CD2 4.17Å; A874-L878 VanDerWaalsContact O-CD1 3.29Å; A874-L878 WeakPolarHBondContact O-CD1 3.39Å; A874-L878 PolarHBondContact O-N 2.79Å; I875-L878 WeakPolarHBondContact O-CB 3.43Å; I875-L878 PolarHBondContact O-N 3.05Å; I875-L878 VanDerWaalsContact O-N 3.1Å; Y876-L878 PolarHBondContact O-N 3.13Å; L878-H880 PolarHBondContact O-N 3.28Å; L878-H880 VanDerWaalsContact O-N 3.11Å
879	I	52.6	Low	52	Low	34.75 Å²	34.75	71.9 Å²	71.9	18%	0.178	39%	0.388	C	S	.	.	S	Bend	trans	-76	114.8	180	-68.5	164.7	0	0	0	109	F600 I780 L781 I875 Y876	F600-I879 HydrophobicContact CE1-CD1 3.97Å; F600-I879 HydrophobicContact CZ-CD1 4.19Å; I780-I879 HydrophobicContact CD1-CD1 3.69Å; I780-I879 HydrophobicContact CD1-CG2 3.8Å; L781-I879 HydrophobicContact CD2-CD1 3.61Å; L781-I879 HydrophobicContact CD2-CG1 4.26Å; L781-I879 HydrophobicContact CD2-CG2 4.39Å; I875-I879 HydrophobicContact CG2-CD1 4.3Å; I875-I879 HydrophobicContact CG2-CG1 4.45Å; I875-I879 VanDerWaalsContact O-CG1 3.3Å; I875-I879 WeakPolarHBondContact O-CG1 3.3Å; I875-I879 PolarHBondContact O-N 2.88Å; Y876-I879 HydrophobicContact CD1-CD1 3.93Å; Y876-I879 HydrophobicContact CE1-CD1 4.2Å
880	H	52	Low	53.6	Low	99.25 Å²	99.25	69.8 Å²	69.8	46%	0.459	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-62.1	146.1	176.9	-91.3	-109.6	0	0	0	112.1	Q794 L878 L882	Q794-H880 PolarHBondContact NE2-O 2.88Å; Q794-H880 VanDerWaalsContact NE2-O 3.16Å; L878-H880 PolarHBondContact O-N 3.28Å; L878-H880 VanDerWaalsContact O-N 3.11Å; H880-L882 PolarHBondContact O-N 3.27Å
881	E	53.3	Low	55.1	Low	145 Å²	145	65.3 Å²	65.3	68%	0.678	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-62.3	144.2	171	-66.1	-171.3	161.8	0	0	110.6	R775	R775-E881 WeakPolarHBondContact CD-OE1 3.48Å; R775-E881 IonicContact CZ-OE1 2.66Å; R775-E881 IonicContact NE-OE1 2.67Å; R775-E881 PolarHBondContact NE-OE1 3.31Å; R775-E881 IonicContact NH2-OE1 2.81Å; R775-E881 PolarHBondContact NH2-OE1 3.06Å
882	L	54.9	Low	56.6	Low	44.75 Å²	44.75	61.8 Å²	61.8	23%	0.234	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-61.3	133.2	177.8	-89.1	152.8	0	0	0	110.5	K776 P778 T798 N831 H833 H880 T884	K776-L882 WeakPolarHBondContact O-CD1 3.34Å; P778-L882 HydrophobicContact CB-CD1 3.83Å; P778-L882 HydrophobicContact CB-CG 4.29Å; P778-L882 HydrophobicContact CG-CD1 3.84Å; P778-L882 HydrophobicContact CG-CD2 4.18Å; P778-L882 HydrophobicContact CG-CG 4.14Å; T798-L882 HydrophobicContact CG2-CD1 3.85Å; N831-L882 HydrophobicContact CB-CD2 4.17Å; H833-L882 HydrophobicContact CB-CD2 4.1Å; H880-L882 PolarHBondContact O-N 3.27Å; L882-T884 PolarHBondContact O-N 3.22Å; L882-T884 VanDerWaalsContact O-N 3.14Å
883	P	58.6	Low	57.9	Low	5.75 Å²	5.75	59.8 Å²	59.8	4%	0.037	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-58.2	134.3	174	10.3	-16.3	0	0	0	110.9	H833 D892 Y895	H833-P883 VanDerWaalsContact CD2-CD 3.47Å; H833-P883 WeakPolarHBondContact CD2-CD 3.44Å; H833-P883 VanDerWaalsContact CD2-CG 3.49Å; H833-P883 WeakPolarHBondContact CD2-CG 3.48Å; H833-P883 WeakPolarHBondContact NE2-CD 3.48Å; P883-D892 VanDerWaalsContact CB-OD2 3.29Å; P883-D892 WeakPolarHBondContact CB-OD2 3.15Å; P883-D892 WeakPolarHBondContact CD-OD2 3.3Å; P883-D892 VanDerWaalsContact CG-OD2 3.22Å; P883-D892 WeakPolarHBondContact CG-OD2 3.38Å; P883-Y895 HydrophobicContact CB-CD1 4.45Å; P883-Y895 HydrophobicContact CB-CD2 3.8Å; P883-Y895 HydrophobicContact CB-CE2 3.77Å; P883-Y895 HydrophobicContact CB-CG 4.37Å; P883-Y895 HydrophobicContact CG-CD1 4.22Å; P883-Y895 HydrophobicContact CG-CD2 3.68Å; P883-Y895 HydrophobicContact CG-CE2 3.97Å; P883-Y895 HydrophobicContact CG-CG 4.07Å; P883-Y895 PolarHBondContact O-OH 3.48Å
884	T	59.3	Low	59.4	Low	73.25 Å²	73.25	57.5 Å²	57.5	45%	0.449	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-82.1	148.5	173.9	56.4	0	0	0	0	109.7	L882 N886 N887	L882-T884 PolarHBondContact O-N 3.22Å; L882-T884 VanDerWaalsContact O-N 3.14Å; T884-N886 PolarHBondContact O-N 3.07Å; T884-N887 PolarHBondContact O-N 3.06Å; T884-N887 VanDerWaalsContact O-N 3.11Å; T884-N887 VanDerWaalsContact O-O 3.13Å; T884-N887 WeakPolarHBondContact OG1-CB 3.44Å; T884-N887 PolarHBondContact OG1-ND2 2.84Å
885	L	61.8	Low	60.8	Low	75 Å²	75	56.3 Å²	56.3	39%	0.393	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.5	-32.3	-174	-140.1	105.6	0	0	0	114.1	H897 T914	L885-H897 HydrophobicContact CD1-CB 3.73Å; L885-H897 VanDerWaalsContact CD1-CD2 3.45Å; L885-H897 WeakPolarHBondContact CD1-CD2 3.33Å; L885-T914 HydrophobicContact CD1-CG2 3.8Å; L885-T914 HydrophobicContact CD2-CG2 3.82Å; L885-T914 HydrophobicContact CG-CG2 4.2Å
886	N	66.3	Low	62.2	Low	105.75 Å²	105.75	53.1 Å²	53.1	57%	0.566	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	-1.4	-173.9	-59.9	-1.7	0	0	0	113.7	T884 A1064 I1065	T884-N886 PolarHBondContact O-N 3.07Å; N886-A1064 CarbonylContact O-C 3.49Å; N886-A1064 WeakPolarHBondContact O-CA 3.42Å; N886-I1065 WeakPolarHBondContact O-CB 3.32Å; N886-I1065 PolarHBondContact O-N 3.3Å
887	N	68.7	Low	63.5	Low	50.75 Å²	50.75	51.5 Å²	51.5	27%	0.271	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	128.3	-176.3	-68.5	-28.6	0	0	0	111.1	T884 P1062 Y1063	T884-N887 PolarHBondContact O-N 3.06Å; T884-N887 VanDerWaalsContact O-N 3.11Å; T884-N887 VanDerWaalsContact O-O 3.13Å; T884-N887 WeakPolarHBondContact OG1-CB 3.44Å; T884-N887 PolarHBondContact OG1-ND2 2.84Å; N887-P1062 HydrophobicContact CB-CB 4.14Å; N887-Y1063 CarbonylContact C-O 3.44Å; N887-Y1063 WeakPolarHBondContact CA-O 3.35Å
888	H	74.5	Confident	64.7	Low	0.25 Å²	0.25	47.5 Å²	47.5	0%	0.001	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	126.4	166.7	-179.1	60.1	0	0	0	109.6	W890 Q916 E918 F984 P1062 Y1063 I1065	H888-W890 AromaticContact CD2-CE3 3.97Å; H888-W890 AromaticContact CD2-CZ3 3.96Å; H888-W890 AromaticContact NE2-CE3 3.87Å; H888-W890 AromaticContact NE2-CZ3 3.95Å; H888-Q916 PolarHBondContact ND1-OE1 2.87Å; H888-Q916 VanDerWaalsContact ND1-OE1 3.13Å; H888-E918 IonicContact CE1-OE2 3.63Å; H888-E918 IonicContact NE2-OE2 3.04Å; H888-E918 PolarHBondContact NE2-OE2 3.1Å; H888-F984 HydrophobicContact CB-CD2 4.43Å; H888-F984 HydrophobicContact CB-CE1 4.42Å; H888-F984 HydrophobicContact CB-CE2 3.66Å; H888-F984 HydrophobicContact CB-CZ 3.67Å; H888-F984 AromaticContact CD2-CD1 3.97Å; H888-F984 AromaticContact CD2-CD2 3.57Å; H888-F984 VanDerWaalsContact CD2-CD2 3.42Å; H888-F984 WeakPolarHBondContact CD2-CD2 3.36Å; H888-F984 AromaticContact CD2-CE2 3.65Å; H888-F984 VanDerWaalsContact CD2-CE2 3.44Å; H888-F984 WeakPolarHBondContact CD2-CE2 3.46Å; H888-F984 AromaticContact CD2-CG 3.74Å; H888-F984 AromaticContact CD2-CZ 3.82Å; H888-F984 AromaticContact CE1-CD2 3.79Å; H888-F984 AromaticContact CE1-CE2 4Å; H888-F984 AromaticContact CG-CD2 3.71Å; H888-F984 AromaticContact CG-CE2 3.37Å; H888-F984 VanDerWaalsContact CG-CE2 3.45Å; H888-F984 AromaticContact CG-CZ 3.8Å; H888-F984 AromaticContact ND1-CD2 3.82Å; H888-F984 AromaticContact ND1-CE2 3.67Å; H888-F984 WeakPolarHBondContact ND1-CE2 3.3Å; H888-F984 AromaticContact NE2-CD2 3.61Å; H888-F984 WeakPolarHBondContact NE2-CD2 3.42Å; H888-F984 AromaticContact NE2-CE2 3.94Å; H888-F984 AromaticContact NE2-CG 3.82Å; H888-P1062 CarbonylContact O-C 3.51Å; H888-P1062 VanDerWaalsContact O-CA 3.26Å; H888-P1062 WeakPolarHBondContact O-CA 3.37Å; H888-P1062 WeakPolarHBondContact O-CB 3.39Å; H888-Y1063 PolarHBondContact N-O 3.12Å; H888-Y1063 PolarHBondContact O-N 3.24Å; H888-I1065 HydrophobicContact CB-CD1 4.15Å; H888-I1065 HydrophobicContact CB-CG1 4.37Å
889	H	69.8	Low	66.1	Low	55.75 Å²	55.75	45.3 Å²	45.3	26%	0.258	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-97.8	132.9	169.8	-66.8	-101.3	0	0	0	108.8	D892	H889-D892 WeakPolarHBondContact O-CB 3.28Å; H889-D892 PolarHBondContact O-N 3.04Å
890	W	68.6	Low	67.2	Low	36 Å²	36	45.4 Å²	45.4	14%	0.136	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	147.5	-180	-61	102.9	0	0	0	111.4	H888 D892 E918 F984 I986 F989 I1033 P1060 C1061	H888-W890 AromaticContact CD2-CE3 3.97Å; H888-W890 AromaticContact CD2-CZ3 3.96Å; H888-W890 AromaticContact NE2-CE3 3.87Å; H888-W890 AromaticContact NE2-CZ3 3.95Å; W890-D892 VanDerWaalsContact C-N 3.29Å; W890-E918 WeakPolarHBondContact CA-OE2 3.43Å; W890-F984 HydrophobicContact CH2-CD1 4.34Å; W890-F984 HydrophobicContact CZ3-CB 4.29Å; W890-F984 HydrophobicContact CZ3-CD1 4.46Å; W890-I986 HydrophobicContact CE3-CD1 3.58Å; W890-I986 VanDerWaalsContact CE3-CD1 3.45Å; W890-I986 HydrophobicContact CE3-CG1 4.22Å; W890-I986 HydrophobicContact CZ3-CD1 3.68Å; W890-I986 VanDerWaalsContact CZ3-CD1 3.49Å; W890-I986 HydrophobicContact CZ3-CG1 3.8Å; W890-F989 HydrophobicContact CH2-CB 3.84Å; W890-F989 AromaticContact CH2-CD1 3.66Å; W890-F989 HydrophobicContact CH2-CD1 3.66Å; W890-F989 AromaticContact CH2-CD2 3.52Å; W890-F989 HydrophobicContact CH2-CD2 3.69Å; W890-F989 HydrophobicContact CH2-CE1 4.18Å; W890-F989 AromaticContact CH2-CE2 3.53Å; W890-F989 HydrophobicContact CH2-CE2 3.53Å; W890-F989 AromaticContact CH2-CG 3.66Å; W890-F989 HydrophobicContact CH2-CG 3.66Å; W890-F989 HydrophobicContact CZ2-CD1 4.07Å; W890-F989 AromaticContact CZ2-CD2 3.67Å; W890-F989 HydrophobicContact CZ2-CD2 4Å; W890-F989 HydrophobicContact CZ2-CE1 4.23Å; W890-F989 AromaticContact CZ2-CE2 3.73Å; W890-F989 HydrophobicContact CZ2-CE2 3.87Å; W890-F989 HydrophobicContact CZ2-CG 4.48Å; W890-F989 HydrophobicContact CZ3-CB 4.22Å; W890-F989 HydrophobicContact CZ3-CD2 4.43Å; W890-F989 HydrophobicContact CZ3-CG 4.49Å; W890-I1033 HydrophobicContact CD2-CD1 4.09Å; W890-I1033 HydrophobicContact CD2-CG1 4.46Å; W890-I1033 HydrophobicContact CE3-CD1 3.87Å; W890-I1033 HydrophobicContact CH2-CD1 4.04Å; W890-I1033 HydrophobicContact CH2-CG1 3.92Å; W890-I1033 HydrophobicContact CZ2-CD1 3.79Å; W890-I1033 HydrophobicContact CZ2-CG1 3.95Å; W890-I1033 HydrophobicContact CZ3-CD1 3.94Å; W890-I1033 HydrophobicContact CZ3-CG1 4.42Å; W890-P1060 HydrophobicContact CB-CG 3.81Å; W890-P1060 VanDerWaalsContact CD1-CB 3.46Å; W890-P1060 HydrophobicContact CG-CB 4.25Å; W890-P1060 HydrophobicContact CG-CG 3.79Å; W890-C1061 PolarHBondContact NE1-O 2.93Å; W890-C1061 VanDerWaalsContact NE1-O 3.1Å
891	D	68	Low	68.5	Low	45.75 Å²	45.75	43 Å²	43	25%	0.245	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.4	1.5	-170.5	-62.3	-58.4	0	0	0	115.7	L836 L893 E918 K923	L836-D891 HydrophobicContact CB-CB 4.27Å; L836-D891 PolarHBondContact N-O 3.15Å; D891-L893 PolarHBondContact O-N 3.13Å; D891-L893 VanDerWaalsContact O-N 3.08Å; D891-E918 WeakPolarHBondContact CA-OE1 3.26Å; D891-E918 WeakPolarHBondContact CA-OE2 3.37Å; D891-E918 PolarHBondContact N-OE1 3.28Å; D891-E918 PolarHBondContact N-OE2 3.03Å; D891-K923 HydrophobicContact CB-CD 4.03Å; D891-K923 VanDerWaalsContact CG-NZ 3.26Å; D891-K923 WeakPolarHBondContact OD1-CD 3.16Å; D891-K923 WeakPolarHBondContact OD1-CE 3.43Å; D891-K923 WeakPolarHBondContact OD1-CG 3.41Å; D891-K923 IonicContact OD1-NZ 3.09Å; D891-K923 WeakPolarHBondContact OD2-CE 3.46Å; D891-K923 IonicContact OD2-NZ 3.02Å; D891-K923 PolarHBondContact OD2-NZ 2.99Å
892	D	68.5	Low	69.7	Low	7.25 Å²	7.25	40.8 Å²	40.8	4%	0.039	21%	0.205	C	C	.	.			trans	-80.4	96.5	168.8	-77.8	-19.3	0	0	0	110.7	H833 C835 P883 H889 W890 F894 E918	H833-D892 IonicContact CD2-OD1 2.96Å; H833-D892 IonicContact CD2-OD2 3.34Å; H833-D892 IonicContact CE1-OD1 3.23Å; H833-D892 PolarHBondContact CE1-OD1 2.75Å; H833-D892 IonicContact CE1-OD2 2.72Å; H833-D892 VanDerWaalsContact NE2-CG 3.35Å; H833-D892 IonicContact NE2-OD1 3.74Å; H833-D892 PolarHBondContact NE2-OD1 2.97Å; H833-D892 IonicContact NE2-OD2 3.16Å; H833-D892 PolarHBondContact NE2-OD2 3.48Å; C835-D892 WeakPolarHBondContact CB-OD1 3.33Å; C835-D892 PolarHBondContact SG-OD1 3.05Å; P883-D892 VanDerWaalsContact CB-OD2 3.29Å; P883-D892 WeakPolarHBondContact CB-OD2 3.15Å; P883-D892 WeakPolarHBondContact CD-OD2 3.3Å; P883-D892 VanDerWaalsContact CG-OD2 3.22Å; P883-D892 WeakPolarHBondContact CG-OD2 3.38Å; H889-D892 WeakPolarHBondContact O-CB 3.28Å; H889-D892 PolarHBondContact O-N 3.04Å; W890-D892 VanDerWaalsContact C-N 3.29Å; D892-F894 VanDerWaalsContact C-N 3.3Å; D892-F894 PolarHBondContact O-N 3.02Å; D892-E918 VanDerWaalsContact O-CB 3.26Å; D892-E918 WeakPolarHBondContact O-CB 3.26Å
893	L	67.6	Low	70.6	Confident	14.5 Å²	14.5	39.5 Å²	39.5	8%	0.076	20%	0.199	C	C	.	.			trans	-57.8	-42.1	-177.9	-69.3	-177.5	0	0	0	114	V834 L836 D891 I917 E918 S921 M924	V834-L893 HydrophobicContact CB-CB 4.46Å; V834-L893 HydrophobicContact CG1-CB 4.48Å; V834-L893 HydrophobicContact CG1-CD1 4.22Å; V834-L893 WeakPolarHBondContact O-CB 3.48Å; V834-L893 PolarHBondContact O-N 3.24Å; L836-L893 HydrophobicContact CD1-CD1 3.57Å; L836-L893 VanDerWaalsContact CD1-CD1 3.45Å; L836-L893 HydrophobicContact CD1-CD2 3.84Å; L836-L893 HydrophobicContact CD1-CG 4.06Å; L836-L893 HydrophobicContact CD2-CD1 4.03Å; L836-L893 HydrophobicContact CG-CD1 3.73Å; L836-L893 HydrophobicContact CG-CD2 4.39Å; L836-L893 HydrophobicContact CG-CG 3.99Å; D891-L893 PolarHBondContact O-N 3.13Å; D891-L893 VanDerWaalsContact O-N 3.08Å; L893-I917 WeakPolarHBondContact O-CA 3.42Å; L893-E918 PolarHBondContact O-N 2.95Å; L893-S921 VanDerWaalsContact CD2-OG 3.27Å; L893-S921 WeakPolarHBondContact CD2-OG 3.45Å; L893-M924 HydrophobicContact CB-CE 4.32Å; L893-M924 HydrophobicContact CD1-CE 3.58Å; L893-M924 HydrophobicContact CD1-SD 4.39Å; L893-M924 HydrophobicContact CD2-CB 4.22Å; L893-M924 HydrophobicContact CD2-CE 4.05Å; L893-M924 HydrophobicContact CG-CE 4.28Å
894	F	72.8	Confident	71.2	Confident	67 Å²	67	43.8 Å²	43.8	29%	0.294	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	122	-172	-177.1	-94.5	0	0	0	111.1	I832 H833 V834 D892 V896 L915 Q916 I917	I832-F894 HydrophobicContact CG2-CD1 4.4Å; I832-F894 HydrophobicContact CG2-CE1 4.15Å; H833-F894 CarbonylContact C-O 3.49Å; H833-F894 VanDerWaalsContact CA-O 3.3Å; H833-F894 WeakPolarHBondContact CA-O 3.32Å; V834-F894 HydrophobicContact CB-CB 4.18Å; V834-F894 HydrophobicContact CG2-CB 4.18Å; V834-F894 HydrophobicContact CG2-CD1 4.09Å; V834-F894 PolarHBondContact N-O 3.22Å; V834-F894 PolarHBondContact O-N 2.9Å; D892-F894 VanDerWaalsContact C-N 3.3Å; D892-F894 PolarHBondContact O-N 3.02Å; F894-V896 HydrophobicContact CD1-CG2 4.26Å; F894-V896 HydrophobicContact CE1-CB 4.39Å; F894-V896 HydrophobicContact CE1-CG2 3.43Å; F894-V896 VanDerWaalsContact CE1-CG2 3.48Å; F894-V896 HydrophobicContact CE2-CG2 4.11Å; F894-V896 HydrophobicContact CZ-CG2 3.34Å; F894-V896 VanDerWaalsContact CZ-CG2 3.41Å; F894-L915 HydrophobicContact CD2-CD1 4.28Å; F894-L915 HydrophobicContact CE2-CD1 3.75Å; F894-L915 HydrophobicContact CE2-CG 4.47Å; F894-L915 HydrophobicContact CZ-CD1 4.15Å; F894-Q916 WeakPolarHBondContact CA-O 3.26Å; F894-I917 HydrophobicContact CD2-CG1 4.08Å; F894-I917 HydrophobicContact CE2-CD1 4.5Å; F894-I917 HydrophobicContact CE2-CG1 4.4Å
895	Y	73.9	Confident	71.7	Confident	5.25 Å²	5.25	45.7 Å²	45.7	2%	0.021	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	134	175	170.4	-100.4	0	0	0	110.8	N831 I832 H833 P883 H897 Q916	N831-Y895 HydrophobicContact CB-CE2 4.27Å; N831-Y895 PolarHBondContact OD1-OH 2.86Å; I832-Y895 CarbonylContact O-C 3.59Å; I832-Y895 VanDerWaalsContact O-CA 3.32Å; I832-Y895 WeakPolarHBondContact O-CA 3.14Å; I832-Y895 WeakPolarHBondContact O-CD2 3.38Å; H833-Y895 HydrophobicContact CB-CD2 4.2Å; H833-Y895 AromaticContact CD2-CD2 3.83Å; P883-Y895 HydrophobicContact CB-CD1 4.45Å; P883-Y895 HydrophobicContact CB-CD2 3.8Å; P883-Y895 HydrophobicContact CB-CE2 3.77Å; P883-Y895 HydrophobicContact CB-CG 4.37Å; P883-Y895 HydrophobicContact CG-CD1 4.22Å; P883-Y895 HydrophobicContact CG-CD2 3.68Å; P883-Y895 HydrophobicContact CG-CE2 3.97Å; P883-Y895 HydrophobicContact CG-CG 4.07Å; P883-Y895 PolarHBondContact O-OH 3.48Å; Y895-H897 HydrophobicContact CE1-CB 4.2Å; Y895-H897 PolarHBondContact OH-ND1 2.81Å; Y895-Q916 HydrophobicContact CD1-CB 4.39Å; Y895-Q916 HydrophobicContact CD1-CG 4.12Å; Y895-Q916 PolarHBondContact N-O 3.24Å; Y895-Q916 PolarHBondContact O-N 3.18Å
896	V	74.1	Confident	72	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.006	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	123.3	177.3	177.6	0	0	0	0	110.1	N831 I832 F894 G898 I899 F912 T914 L915	N831-V896 CarbonylContact C-O 3.52Å; N831-V896 VanDerWaalsContact CA-O 3.28Å; N831-V896 WeakPolarHBondContact CA-O 3.36Å; N831-V896 PolarHBondContact N-O 3.23Å; I832-V896 HydrophobicContact CB-CB 4.41Å; I832-V896 PolarHBondContact N-O 3.19Å; I832-V896 PolarHBondContact O-N 2.88Å; F894-V896 HydrophobicContact CD1-CG2 4.26Å; F894-V896 HydrophobicContact CE1-CB 4.39Å; F894-V896 HydrophobicContact CE1-CG2 3.43Å; F894-V896 VanDerWaalsContact CE1-CG2 3.48Å; F894-V896 HydrophobicContact CE2-CG2 4.11Å; F894-V896 HydrophobicContact CZ-CG2 3.34Å; F894-V896 VanDerWaalsContact CZ-CG2 3.41Å; V896-G898 PolarHBondContact O-N 2.81Å; V896-I899 HydrophobicContact CB-CD1 4.17Å; V896-I899 HydrophobicContact CB-CG1 4.4Å; V896-I899 HydrophobicContact CG1-CD1 3.89Å; V896-I899 HydrophobicContact CG1-CG1 3.49Å; V896-I899 VanDerWaalsContact CG1-CG1 3.45Å; V896-F912 HydrophobicContact CG1-CB 4.25Å; V896-F912 HydrophobicContact CG1-CD1 3.83Å; V896-F912 VanDerWaalsContact CG1-CD1 3.49Å; V896-F912 HydrophobicContact CG1-CD2 4.24Å; V896-F912 HydrophobicContact CG1-CE1 4.13Å; V896-F912 HydrophobicContact CG1-CG 4.22Å; V896-F912 HydrophobicContact CG2-CD1 4.48Å; V896-T914 VanDerWaalsContact CA-O 3.31Å; V896-T914 WeakPolarHBondContact CA-O 3.36Å; V896-L915 HydrophobicContact CG2-CB 4.41Å; V896-L915 HydrophobicContact CG2-CD1 3.73Å; V896-L915 HydrophobicContact CG2-CG 4.34Å
897	H	73.6	Confident	72.3	Confident	56.75 Å²	56.75	44.7 Å²	44.7	26%	0.263	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	-134	177.3	-178.8	61.9	0	0	0	111.9	S830 N831 L885 Y895 T913 T914	S830-H897 CarbonylContact C-O 3.51Å; S830-H897 WeakPolarHBondContact CA-O 3.37Å; S830-H897 WeakPolarHBondContact CB-O 3.25Å; S830-H897 CarbonylContact O-C 3.58Å; S830-H897 WeakPolarHBondContact O-CA 3.37Å; S830-H897 PolarHBondContact O-ND1 3.14Å; S830-H897 VanDerWaalsContact O-ND1 3.16Å; N831-H897 PolarHBondContact N-O 3.18Å; N831-H897 PolarHBondContact OD1-CE1 3.03Å; N831-H897 PolarHBondContact OD1-ND1 3.05Å; L885-H897 HydrophobicContact CD1-CB 3.73Å; L885-H897 VanDerWaalsContact CD1-CD2 3.45Å; L885-H897 WeakPolarHBondContact CD1-CD2 3.33Å; Y895-H897 HydrophobicContact CE1-CB 4.2Å; Y895-H897 PolarHBondContact OH-ND1 2.81Å; H897-T913 PolarHBondContact CD2-OG1 2.82Å; H897-T913 VanDerWaalsContact CD2-OG1 3.24Å; H897-T913 PolarHBondContact O-N 2.99Å; H897-T913 VanDerWaalsContact O-N 3.1Å; H897-T913 PolarHBondContact O-OG1 3.04Å; H897-T914 HydrophobicContact CB-CG2 4.08Å; H897-T914 WeakPolarHBondContact CB-OG1 3.32Å; H897-T914 PolarHBondContact N-O 3.34Å; H897-T914 VanDerWaalsContact N-O 3.09Å; H897-T914 PolarHBondContact N-OG1 2.82Å; H897-T914 PolarHBondContact O-N 3.11Å
898	G	72.2	Confident	72.7	Confident	11.25 Å²	11.25	44.8 Å²	44.8	12%	0.116	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	128.9	107.2	177.4	0	0	0	0	0	113	L829 S830 V896 K911 F912 T913	L829-G898 CarbonylContact O-C 3.52Å; L829-G898 VanDerWaalsContact O-CA 3.3Å; L829-G898 WeakPolarHBondContact O-CA 3.36Å; S830-G898 PolarHBondContact O-N 3.42Å; V896-G898 PolarHBondContact O-N 2.81Å; G898-K911 VanDerWaalsContact O-O 3.08Å; G898-F912 WeakPolarHBondContact O-CA 3.32Å; G898-T913 VanDerWaalsContact CA-OG1 3.31Å; G898-T913 WeakPolarHBondContact CA-OG1 3.34Å; G898-T913 PolarHBondContact N-OG1 3.13Å; G898-T913 VanDerWaalsContact N-OG1 3.12Å; G898-T913 PolarHBondContact O-N 3.36Å; G898-T913 VanDerWaalsContact O-N 3.13Å; G898-T913 PolarHBondContact O-OG1 3.18Å
899	I	76.1	Confident	72.9	Confident	16.75 Å²	16.75	45.9 Å²	45.9	9%	0.086	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	112.1	172.8	-51.6	-179	0	0	0	108.3	K828 L829 I832 V896 I901 L910 K911 F912	K828-I899 CarbonylContact C-O 3.54Å; K828-I899 VanDerWaalsContact CA-O 3.29Å; K828-I899 WeakPolarHBondContact CA-O 3.24Å; L829-I899 HydrophobicContact CB-CB 4.3Å; L829-I899 HydrophobicContact CD2-CD1 4.18Å; L829-I899 PolarHBondContact N-O 2.98Å; L829-I899 PolarHBondContact O-N 2.82Å; I832-I899 HydrophobicContact CB-CD1 4.24Å; I832-I899 HydrophobicContact CD1-CD1 3.35Å; I832-I899 HydrophobicContact CD1-CG1 4.1Å; I832-I899 HydrophobicContact CG1-CD1 3.53Å; I832-I899 VanDerWaalsContact CG1-CD1 3.5Å; V896-I899 HydrophobicContact CB-CD1 4.17Å; V896-I899 HydrophobicContact CB-CG1 4.4Å; V896-I899 HydrophobicContact CG1-CD1 3.89Å; V896-I899 HydrophobicContact CG1-CG1 3.49Å; V896-I899 VanDerWaalsContact CG1-CG1 3.45Å; I899-I901 HydrophobicContact CG2-CD1 4.2Å; I899-I901 HydrophobicContact CG2-CG1 3.88Å; I899-L910 HydrophobicContact CG2-CD2 4.26Å; I899-K911 WeakPolarHBondContact CA-O 3.31Å; I899-F912 HydrophobicContact CB-CD1 4.29Å; I899-F912 HydrophobicContact CB-CE1 4.25Å; I899-F912 HydrophobicContact CD1-CD1 4.27Å; I899-F912 HydrophobicContact CD1-CE1 3.91Å; I899-F912 HydrophobicContact CD1-CZ 4.47Å; I899-F912 HydrophobicContact CG1-CD1 3.78Å; I899-F912 HydrophobicContact CG1-CE1 3.74Å; I899-F912 HydrophobicContact CG2-CD1 4.23Å; I899-F912 HydrophobicContact CG2-CE1 3.87Å; I899-F912 HydrophobicContact CG2-CZ 4.46Å
900	D	77.6	Confident	73.4	Confident	37.25 Å²	37.25	44.4 Å²	44.4	20%	0.199	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	118	168.6	-75.4	-14.5	0	0	0	108.5	L827 K828 W902 L910 K911	L827-D900 CarbonylContact O-C 3.57Å; L827-D900 WeakPolarHBondContact O-CA 3.36Å; K828-D900 WeakPolarHBondContact CB-OD1 3.45Å; K828-D900 VanDerWaalsContact CD-OD1 3.27Å; K828-D900 WeakPolarHBondContact CD-OD1 3.44Å; K828-D900 WeakPolarHBondContact CE-OD1 3.33Å; K828-D900 VanDerWaalsContact CG-OD1 3.24Å; K828-D900 WeakPolarHBondContact CG-OD1 3.37Å; K828-D900 IonicContact NZ-OD1 3.49Å; K828-D900 PolarHBondContact NZ-OD1 3.08Å; K828-D900 IonicContact NZ-OD2 3.01Å; K828-D900 PolarHBondContact NZ-OD2 2.92Å; D900-W902 HydrophobicContact CB-CE3 4.18Å; D900-W902 HydrophobicContact CB-CH2 4.27Å; D900-W902 HydrophobicContact CB-CZ2 3.69Å; D900-W902 VanDerWaalsContact CB-CZ2 3.45Å; D900-W902 HydrophobicContact CB-CZ3 4.03Å; D900-W902 PolarHBondContact O-NE1 2.92Å; D900-L910 CarbonylContact O-C 3.53Å; D900-L910 WeakPolarHBondContact O-CA 3.31Å; D900-K911 HydrophobicContact CB-CB 4.34Å; D900-K911 PolarHBondContact N-O 2.85Å; D900-K911 PolarHBondContact O-N 3.02Å
901	I	77.9	Confident	74.1	Confident	47 Å²	47	45.4 Å²	45.4	24%	0.241	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	121	172.4	-51.5	-175	0	0	0	107.8	N826 L827 I899 S909 L910	N826-I901 CarbonylContact C-O 3.55Å; N826-I901 VanDerWaalsContact CA-O 3.3Å; N826-I901 WeakPolarHBondContact CA-O 3.43Å; L827-I901 HydrophobicContact CB-CB 4.31Å; L827-I901 HydrophobicContact CD2-CB 4.19Å; L827-I901 HydrophobicContact CD2-CD1 4.03Å; L827-I901 HydrophobicContact CD2-CG1 4.09Å; L827-I901 PolarHBondContact N-O 3.11Å; L827-I901 PolarHBondContact O-N 3.13Å; I899-I901 HydrophobicContact CG2-CD1 4.2Å; I899-I901 HydrophobicContact CG2-CG1 3.88Å; I901-S909 WeakPolarHBondContact CA-O 3.48Å; I901-L910 HydrophobicContact CD1-CD1 3.96Å; I901-L910 HydrophobicContact CG1-CB 4.4Å; I901-L910 HydrophobicContact CG1-CD1 4.03Å; I901-L910 HydrophobicContact CG1-CG 4.24Å
902	W	78.8	Confident	74.6	Confident	98.75 Å²	98.75	44.9 Å²	44.9	37%	0.374	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	131.8	176.3	13.9	57.4	0	0	0	109.6	L825 N826 D900 I908 S909 K911	L825-W902 CarbonylContact O-C 3.48Å; L825-W902 WeakPolarHBondContact O-CA 3.33Å; N826-W902 WeakPolarHBondContact OD1-CB 3.5Å; N826-W902 VanDerWaalsContact OD1-CD1 3.25Å; N826-W902 PolarHBondContact OD1-NE1 2.9Å; D900-W902 HydrophobicContact CB-CE3 4.18Å; D900-W902 HydrophobicContact CB-CH2 4.27Å; D900-W902 HydrophobicContact CB-CZ2 3.69Å; D900-W902 VanDerWaalsContact CB-CZ2 3.45Å; D900-W902 HydrophobicContact CB-CZ3 4.03Å; D900-W902 PolarHBondContact O-NE1 2.92Å; W902-I908 CarbonylContact O-C 3.51Å; W902-I908 WeakPolarHBondContact O-CA 3.41Å; W902-S909 WeakPolarHBondContact CB-OG 3.36Å; W902-S909 VanDerWaalsContact CD1-OG 3.23Å; W902-S909 VanDerWaalsContact CE2-CB 3.48Å; W902-S909 PolarHBondContact N-O 3.16Å; W902-S909 PolarHBondContact NE1-OG 3.18Å; W902-S909 VanDerWaalsContact NE1-OG 3.16Å; W902-S909 PolarHBondContact O-N 3.01Å; W902-S909 VanDerWaalsContact O-O 3.04Å; W902-K911 HydrophobicContact CH2-CB 4.01Å; W902-K911 HydrophobicContact CH2-CD 3.99Å; W902-K911 HydrophobicContact CH2-CG 4.46Å; W902-K911 HydrophobicContact CZ2-CB 4.43Å; W902-K911 HydrophobicContact CZ3-CB 4.02Å
903	N	73.9	Confident	75.2	Confident	19.25 Å²	19.25	46.2 Å²	46.2	10%	0.103	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	125.9	169.1	-177.2	28.1	0	0	0	108.1	L820 T823 D824 L825 K905 Q907 I908	L820-N903 PolarHBondContact O-ND2 3.15Å; T823-N903 PolarHBondContact O-ND2 3.25Å; D824-N903 VanDerWaalsContact CA-O 3.32Å; D824-N903 WeakPolarHBondContact CA-O 3.42Å; L825-N903 HydrophobicContact CB-CB 4.22Å; L825-N903 PolarHBondContact N-O 2.9Å; L825-N903 VanDerWaalsContact N-O 3.14Å; L825-N903 PolarHBondContact O-N 3.14Å; N903-K905 PolarHBondContact ND2-O 3Å; N903-K905 PolarHBondContact OD1-O 3.32Å; N903-K905 VanDerWaalsContact OD1-O 3.07Å; N903-Q907 WeakPolarHBondContact CA-O 3.39Å; N903-Q907 PolarHBondContact OD1-O 2.87Å; N903-I908 HydrophobicContact CB-CG1 4.4Å; N903-I908 VanDerWaalsContact OD1-CG1 3.22Å; N903-I908 WeakPolarHBondContact OD1-CG1 3.12Å
904	H	71.3	Confident	75.7	Confident	94.25 Å²	94.25	45.8 Å²	45.8	44%	0.436	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	106.6	170.3	177.6	-17	0	0	0	109.1	D824 Y906 Q907	D824-H904 VanDerWaalsContact CG-ND1 3.32Å; D824-H904 WeakPolarHBondContact OD1-CA 3.3Å; D824-H904 IonicContact OD1-CD2 3.3Å; D824-H904 PolarHBondContact OD1-CD2 3.39Å; D824-H904 VanDerWaalsContact OD1-CD2 3.27Å; D824-H904 IonicContact OD1-CE1 3.17Å; D824-H904 IonicContact OD1-CG 3.04Å; D824-H904 IonicContact OD1-ND1 3.4Å; D824-H904 PolarHBondContact OD1-ND1 2.91Å; D824-H904 IonicContact OD2-CD2 3.19Å; D824-H904 PolarHBondContact OD2-CD2 3.38Å; D824-H904 IonicContact OD2-CE1 3.29Å; D824-H904 PolarHBondContact OD2-CE1 2.94Å; D824-H904 IonicContact OD2-ND1 3.57Å; D824-H904 PolarHBondContact OD2-ND1 3.43Å; H904-Y906 PolarHBondContact O-N 3.02Å; H904-Y906 VanDerWaalsContact O-N 3.15Å; H904-Q907 PolarHBondContact N-O 2.99Å; H904-Q907 PolarHBondContact O-N 3.25Å
905	K	68.9	Low	76	Confident	113.5 Å²	113.5	43.2 Å²	43.2	49%	0.493	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.8	-9.9	175.4	-58.7	176.1	-176.5	173.9	0	113.6	N821 N903 Q907	N821-K905 CarbonylContact C-O 3.57Å; N821-K905 CarbonylContact O-C 3.54Å; N821-K905 WeakPolarHBondContact O-CA 3.34Å; N903-K905 PolarHBondContact ND2-O 3Å; N903-K905 PolarHBondContact OD1-O 3.32Å; N903-K905 VanDerWaalsContact OD1-O 3.07Å; K905-Q907 VanDerWaalsContact C-N 3.31Å; K905-Q907 PolarHBondContact O-N 2.9Å
906	Y	68	Low	76.3	Confident	65.25 Å²	65.25	43 Å²	43	26%	0.256	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	152.2	6.6	-179.2	-52.2	-79.8	0	0	0	115.3	N821 H904 L968 N970 I972 Q973	N821-Y906 HydrophobicContact CB-CD1 4.29Å; N821-Y906 HydrophobicContact CB-CE1 3.92Å; H904-Y906 PolarHBondContact O-N 3.02Å; H904-Y906 VanDerWaalsContact O-N 3.15Å; Y906-L968 HydrophobicContact CE1-CD2 3.85Å; Y906-L968 WeakPolarHBondContact OH-CD2 3.36Å; Y906-N970 HydrophobicContact CD1-CB 4.16Å; Y906-N970 HydrophobicContact CE1-CB 4.13Å; Y906-N970 WeakPolarHBondContact CE2-ND2 3.46Å; Y906-N970 HydrophobicContact CG-CB 4.41Å; Y906-I972 HydrophobicContact CD1-CG1 4.32Å; Y906-I972 CarbonylContact O-C 3.44Å; Y906-I972 VanDerWaalsContact O-CA 3.31Å; Y906-I972 WeakPolarHBondContact O-CA 3.45Å; Y906-I972 WeakPolarHBondContact O-CG2 3.5Å; Y906-Q973 PolarHBondContact O-N 3.17Å
907	Q	73.3	Confident	76.6	Confident	95 Å²	95	44.9 Å²	44.9	44%	0.444	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	111.8	170.9	-87.1	-175.5	-24.6	0	0	110.2	N903 H904 K905 Q973	N903-Q907 WeakPolarHBondContact CA-O 3.39Å; N903-Q907 PolarHBondContact OD1-O 2.87Å; H904-Q907 PolarHBondContact N-O 2.99Å; H904-Q907 PolarHBondContact O-N 3.25Å; K905-Q907 VanDerWaalsContact C-N 3.31Å; K905-Q907 PolarHBondContact O-N 2.9Å; Q907-Q973 CarbonylContact C-O 3.46Å; Q907-Q973 WeakPolarHBondContact CA-O 3.35Å; Q907-Q973 HydrophobicContact CG-CB 4.28Å
908	I	76.5	Confident	76.7	Confident	54 Å²	54	42.2 Å²	42.2	28%	0.277	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	120	171.8	-60.1	170.6	0	0	0	107.4	W902 N903 I972 Q973 F974 D975	W902-I908 CarbonylContact O-C 3.51Å; W902-I908 WeakPolarHBondContact O-CA 3.41Å; N903-I908 HydrophobicContact CB-CG1 4.4Å; N903-I908 VanDerWaalsContact OD1-CG1 3.22Å; N903-I908 WeakPolarHBondContact OD1-CG1 3.12Å; I908-I972 HydrophobicContact CD1-CG2 4.07Å; I908-I972 HydrophobicContact CG1-CG2 4.17Å; I908-Q973 PolarHBondContact N-O 3.14Å; I908-F974 HydrophobicContact CB-CD2 4.02Å; I908-F974 HydrophobicContact CB-CE2 4.49Å; I908-F974 HydrophobicContact CG2-CD2 3.83Å; I908-F974 HydrophobicContact CG2-CE2 3.93Å; I908-F974 CarbonylContact O-C 3.57Å; I908-F974 VanDerWaalsContact O-CA 3.28Å; I908-F974 WeakPolarHBondContact O-CA 3.33Å; I908-F974 WeakPolarHBondContact O-CD2 3.37Å; I908-D975 PolarHBondContact O-N 3.35Å; I908-D975 VanDerWaalsContact O-N 3.13Å
909	S	79.9	Confident	76.6	Confident	22.75 Å²	22.75	44 Å²	44	16%	0.159	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	146.5	170.8	-27	0	0	0	0	111.5	I901 W902 D975	I901-S909 WeakPolarHBondContact CA-O 3.48Å; W902-S909 WeakPolarHBondContact CB-OG 3.36Å; W902-S909 VanDerWaalsContact CD1-OG 3.23Å; W902-S909 VanDerWaalsContact CE2-CB 3.48Å; W902-S909 PolarHBondContact N-O 3.16Å; W902-S909 PolarHBondContact NE1-OG 3.18Å; W902-S909 VanDerWaalsContact NE1-OG 3.16Å; W902-S909 PolarHBondContact O-N 3.01Å; W902-S909 VanDerWaalsContact O-O 3.04Å; S909-D975 CarbonylContact C-O 3.55Å; S909-D975 VanDerWaalsContact CA-O 3.22Å; S909-D975 WeakPolarHBondContact CA-O 3.39Å; S909-D975 VanDerWaalsContact CB-O 3.31Å; S909-D975 WeakPolarHBondContact CB-O 3.39Å
910	L	80.1	Confident	76.1	Confident	24.75 Å²	24.75	43.6 Å²	43.6	13%	0.13	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	122.7	-172.5	-179.8	153.6	0	0	0	109.6	I899 D900 I901 F912 F974 D975 G976 F977 L978 F999	I899-L910 HydrophobicContact CG2-CD2 4.26Å; D900-L910 CarbonylContact O-C 3.53Å; D900-L910 WeakPolarHBondContact O-CA 3.31Å; I901-L910 HydrophobicContact CD1-CD1 3.96Å; I901-L910 HydrophobicContact CG1-CB 4.4Å; I901-L910 HydrophobicContact CG1-CD1 4.03Å; I901-L910 HydrophobicContact CG1-CG 4.24Å; L910-F912 HydrophobicContact CD1-CE1 3.73Å; L910-F912 HydrophobicContact CD1-CE2 3.86Å; L910-F912 HydrophobicContact CD1-CZ 3.84Å; L910-F912 HydrophobicContact CD2-CD1 3.93Å; L910-F912 HydrophobicContact CD2-CD2 3.64Å; L910-F912 HydrophobicContact CD2-CE1 4.03Å; L910-F912 HydrophobicContact CD2-CE2 3.41Å; L910-F912 HydrophobicContact CD2-CG 4.22Å; L910-F912 HydrophobicContact CD2-CZ 3.87Å; L910-F912 HydrophobicContact CG-CD1 4.2Å; L910-F912 HydrophobicContact CG-CD2 4.28Å; L910-F912 HydrophobicContact CG-CE1 3.65Å; L910-F912 HydrophobicContact CG-CE2 4.12Å; L910-F912 HydrophobicContact CG-CZ 4.11Å; L910-F974 HydrophobicContact CB-CE2 4.42Å; L910-F974 HydrophobicContact CB-CZ 4.24Å; L910-D975 PolarHBondContact N-O 3.31Å; L910-D975 VanDerWaalsContact N-O 3.12Å; L910-G976 CarbonylContact O-C 3.57Å; L910-G976 VanDerWaalsContact O-CA 3.24Å; L910-G976 WeakPolarHBondContact O-CA 3.41Å; L910-F977 PolarHBondContact O-N 3.01Å; L910-L978 HydrophobicContact CD2-CD1 4.27Å; L910-L978 HydrophobicContact CD2-CD2 4.35Å; L910-F999 HydrophobicContact CD2-CZ 4.09Å
911	K	82.6	Confident	75.6	Confident	56.5 Å²	56.5	41.9 Å²	41.9	25%	0.246	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	127.7	176.3	-175.8	173.9	-178.7	174.5	0	111.1	G898 I899 D900 W902 F977 E979	G898-K911 VanDerWaalsContact O-O 3.08Å; I899-K911 WeakPolarHBondContact CA-O 3.31Å; D900-K911 HydrophobicContact CB-CB 4.34Å; D900-K911 PolarHBondContact N-O 2.85Å; D900-K911 PolarHBondContact O-N 3.02Å; W902-K911 HydrophobicContact CH2-CB 4.01Å; W902-K911 HydrophobicContact CH2-CD 3.99Å; W902-K911 HydrophobicContact CH2-CG 4.46Å; W902-K911 HydrophobicContact CZ2-CB 4.43Å; W902-K911 HydrophobicContact CZ3-CB 4.02Å; K911-F977 CarbonylContact C-O 3.53Å; K911-F977 VanDerWaalsContact CA-O 3.28Å; K911-F977 WeakPolarHBondContact CA-O 3.35Å; K911-F977 HydrophobicContact CD-CD1 4.28Å; K911-F977 HydrophobicContact CG-CB 4.47Å; K911-F977 HydrophobicContact CG-CD1 4.32Å; K911-E979 VanDerWaalsContact CE-OE1 3.23Å; K911-E979 WeakPolarHBondContact CE-OE1 3.42Å; K911-E979 WeakPolarHBondContact CE-OE2 3.43Å; K911-E979 IonicContact NZ-OE1 3.17Å; K911-E979 PolarHBondContact NZ-OE1 3.29Å; K911-E979 IonicContact NZ-OE2 3.03Å; K911-E979 PolarHBondContact NZ-OE2 2.91Å
912	F	79.7	Confident	75	Confident	35.5 Å²	35.5	46.8 Å²	46.8	16%	0.156	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	131.3	166.5	-65.8	-62.5	0	0	0	109.3	V896 G898 I899 L910 F977 L978 E979	V896-F912 HydrophobicContact CG1-CB 4.25Å; V896-F912 HydrophobicContact CG1-CD1 3.83Å; V896-F912 VanDerWaalsContact CG1-CD1 3.49Å; V896-F912 HydrophobicContact CG1-CD2 4.24Å; V896-F912 HydrophobicContact CG1-CE1 4.13Å; V896-F912 HydrophobicContact CG1-CG 4.22Å; V896-F912 HydrophobicContact CG2-CD1 4.48Å; G898-F912 WeakPolarHBondContact O-CA 3.32Å; I899-F912 HydrophobicContact CB-CD1 4.29Å; I899-F912 HydrophobicContact CB-CE1 4.25Å; I899-F912 HydrophobicContact CD1-CD1 4.27Å; I899-F912 HydrophobicContact CD1-CE1 3.91Å; I899-F912 HydrophobicContact CD1-CZ 4.47Å; I899-F912 HydrophobicContact CG1-CD1 3.78Å; I899-F912 HydrophobicContact CG1-CE1 3.74Å; I899-F912 HydrophobicContact CG2-CD1 4.23Å; I899-F912 HydrophobicContact CG2-CE1 3.87Å; I899-F912 HydrophobicContact CG2-CZ 4.46Å; L910-F912 HydrophobicContact CD1-CE1 3.73Å; L910-F912 HydrophobicContact CD1-CE2 3.86Å; L910-F912 HydrophobicContact CD1-CZ 3.84Å; L910-F912 HydrophobicContact CD2-CD1 3.93Å; L910-F912 HydrophobicContact CD2-CD2 3.64Å; L910-F912 HydrophobicContact CD2-CE1 4.03Å; L910-F912 HydrophobicContact CD2-CE2 3.41Å; L910-F912 HydrophobicContact CD2-CG 4.22Å; L910-F912 HydrophobicContact CD2-CZ 3.87Å; L910-F912 HydrophobicContact CG-CD1 4.2Å; L910-F912 HydrophobicContact CG-CD2 4.28Å; L910-F912 HydrophobicContact CG-CE1 3.65Å; L910-F912 HydrophobicContact CG-CE2 4.12Å; L910-F912 HydrophobicContact CG-CZ 4.11Å; F912-F977 PolarHBondContact N-O 3.17Å; F912-L978 HydrophobicContact CB-CB 4.48Å; F912-L978 HydrophobicContact CB-CD2 3.82Å; F912-L978 HydrophobicContact CB-CG 4.28Å; F912-L978 HydrophobicContact CD2-CD1 3.74Å; F912-L978 HydrophobicContact CD2-CD2 3.3Å; F912-L978 VanDerWaalsContact CD2-CD2 3.47Å; F912-L978 HydrophobicContact CD2-CG 3.88Å; F912-L978 HydrophobicContact CE2-CD2 4Å; F912-L978 HydrophobicContact CG-CD2 3.77Å; F912-L978 HydrophobicContact CG-CG 4.48Å; F912-E979 PolarHBondContact O-N 2.97Å
913	T	79.8	Confident	74.3	Confident	34.5 Å²	34.5	43.2 Å²	43.2	21%	0.212	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	-29.8	-177.4	57.9	0	0	0	0	114.2	H897 G898 E979 N980	H897-T913 PolarHBondContact CD2-OG1 2.82Å; H897-T913 VanDerWaalsContact CD2-OG1 3.24Å; H897-T913 PolarHBondContact O-N 2.99Å; H897-T913 VanDerWaalsContact O-N 3.1Å; H897-T913 PolarHBondContact O-OG1 3.04Å; G898-T913 VanDerWaalsContact CA-OG1 3.31Å; G898-T913 WeakPolarHBondContact CA-OG1 3.34Å; G898-T913 PolarHBondContact N-OG1 3.13Å; G898-T913 VanDerWaalsContact N-OG1 3.12Å; G898-T913 PolarHBondContact O-N 3.36Å; G898-T913 VanDerWaalsContact O-N 3.13Å; G898-T913 PolarHBondContact O-OG1 3.18Å; T913-E979 CarbonylContact C-O 3.49Å; T913-E979 CarbonylContact O-C 3.52Å; T913-E979 WeakPolarHBondContact O-CB 3.38Å; T913-N980 VanDerWaalsContact O-CB 3.29Å; T913-N980 WeakPolarHBondContact O-CB 3.27Å; T913-N980 PolarHBondContact O-ND2 3.15Å; T913-N980 VanDerWaalsContact O-ND2 3.08Å
914	T	79	Confident	73.9	Confident	6.5 Å²	6.5	43.7 Å²	43.7	4%	0.04	20%	0.204	C	C	.	.			trans	-149.5	141.2	168.8	10.7	0	0	0	0	109.7	L885 V896 H897 Q916 E979 N980	L885-T914 HydrophobicContact CD1-CG2 3.8Å; L885-T914 HydrophobicContact CD2-CG2 3.82Å; L885-T914 HydrophobicContact CG-CG2 4.2Å; V896-T914 VanDerWaalsContact CA-O 3.31Å; V896-T914 WeakPolarHBondContact CA-O 3.36Å; H897-T914 HydrophobicContact CB-CG2 4.08Å; H897-T914 WeakPolarHBondContact CB-OG1 3.32Å; H897-T914 PolarHBondContact N-O 3.34Å; H897-T914 VanDerWaalsContact N-O 3.09Å; H897-T914 PolarHBondContact N-OG1 2.82Å; H897-T914 PolarHBondContact O-N 3.11Å; T914-Q916 HydrophobicContact CG2-CG 4.3Å; T914-E979 WeakPolarHBondContact CA-O 3.33Å; T914-E979 PolarHBondContact N-O 3.42Å; T914-N980 HydrophobicContact CG2-CB 4.02Å; T914-N980 WeakPolarHBondContact CG2-ND2 3.35Å; T914-N980 PolarHBondContact OG1-ND2 3.21Å
915	L	80.1	Confident	73.7	Confident	11.75 Å²	11.75	41.9 Å²	41.9	6%	0.062	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	121.3	176.4	174	79.7	0	0	0	109.2	F894 V896 I917 L978 N980 I981 N982 L1104	F894-L915 HydrophobicContact CD2-CD1 4.28Å; F894-L915 HydrophobicContact CE2-CD1 3.75Å; F894-L915 HydrophobicContact CE2-CG 4.47Å; F894-L915 HydrophobicContact CZ-CD1 4.15Å; V896-L915 HydrophobicContact CG2-CB 4.41Å; V896-L915 HydrophobicContact CG2-CD1 3.73Å; V896-L915 HydrophobicContact CG2-CG 4.34Å; L915-I917 HydrophobicContact CD1-CD1 4.09Å; L915-I917 HydrophobicContact CD1-CG1 3.89Å; L915-I917 HydrophobicContact CD2-CD1 4.06Å; L915-I917 HydrophobicContact CD2-CG1 3.84Å; L915-I917 HydrophobicContact CG-CD1 4.18Å; L915-I917 HydrophobicContact CG-CG1 4.2Å; L915-L978 HydrophobicContact CB-CD2 4.5Å; L915-L978 HydrophobicContact CD1-CD2 3.96Å; L915-L978 HydrophobicContact CD2-CD2 3.89Å; L915-N980 PolarHBondContact N-O 3.13Å; L915-N980 VanDerWaalsContact N-O 3.11Å; L915-I981 HydrophobicContact CB-CG1 4.4Å; L915-I981 HydrophobicContact CB-CG2 4.38Å; L915-I981 HydrophobicContact CD2-CG1 4.42Å; L915-I981 HydrophobicContact CD2-CG2 3.95Å; L915-I981 HydrophobicContact CG-CG2 4.25Å; L915-I981 CarbonylContact O-C 3.54Å; L915-I981 VanDerWaalsContact O-CA 3.29Å; L915-I981 WeakPolarHBondContact O-CA 3.36Å; L915-N982 PolarHBondContact O-N 3.18Å; L915-L1104 HydrophobicContact CD1-CD1 4.3Å; L915-L1104 HydrophobicContact CD2-CD1 3.6Å; L915-L1104 HydrophobicContact CD2-CD2 3.52Å; L915-L1104 HydrophobicContact CD2-CG 4.2Å
916	Q	80	Confident	73.6	Confident	1.75 Å²	1.75	39.2 Å²	39.2	1%	0.008	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	131.1	173.6	-56.3	178.5	20	0	0	109.1	H888 F894 Y895 T914 N982 I1065	H888-Q916 PolarHBondContact ND1-OE1 2.87Å; H888-Q916 VanDerWaalsContact ND1-OE1 3.13Å; F894-Q916 WeakPolarHBondContact CA-O 3.26Å; Y895-Q916 HydrophobicContact CD1-CB 4.39Å; Y895-Q916 HydrophobicContact CD1-CG 4.12Å; Y895-Q916 PolarHBondContact N-O 3.24Å; Y895-Q916 PolarHBondContact O-N 3.18Å; T914-Q916 HydrophobicContact CG2-CG 4.3Å; Q916-N982 CarbonylContact C-O 3.56Å; Q916-N982 VanDerWaalsContact CA-O 3.28Å; Q916-N982 WeakPolarHBondContact CA-O 3.24Å; Q916-N982 HydrophobicContact CG-CB 4.38Å; Q916-I1065 VanDerWaalsContact CD-CD1 3.5Å; Q916-I1065 HydrophobicContact CG-CD1 4.18Å; Q916-I1065 VanDerWaalsContact NE2-CD1 3.26Å
917	I	79.4	Confident	73.4	Confident	39.75 Å²	39.75	37.4 Å²	37.4	20%	0.204	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	132	178.6	-58.4	-179.9	0	0	0	108.8	L893 F894 L915 N982 I983 F984	L893-I917 WeakPolarHBondContact O-CA 3.42Å; F894-I917 HydrophobicContact CD2-CG1 4.08Å; F894-I917 HydrophobicContact CE2-CD1 4.5Å; F894-I917 HydrophobicContact CE2-CG1 4.4Å; L915-I917 HydrophobicContact CD1-CD1 4.09Å; L915-I917 HydrophobicContact CD1-CG1 3.89Å; L915-I917 HydrophobicContact CD2-CD1 4.06Å; L915-I917 HydrophobicContact CD2-CG1 3.84Å; L915-I917 HydrophobicContact CG-CD1 4.18Å; L915-I917 HydrophobicContact CG-CG1 4.2Å; I917-N982 PolarHBondContact N-O 3.17Å; I917-I983 HydrophobicContact CB-CG1 4.44Å; I917-I983 HydrophobicContact CB-CG2 4.4Å; I917-I983 HydrophobicContact CG2-CG2 4.35Å; I917-I983 CarbonylContact O-C 3.54Å; I917-I983 WeakPolarHBondContact O-CA 3.36Å; I917-F984 PolarHBondContact O-N 3.25Å
918	E	75.3	Confident	72.9	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	122.2	174.8	-167.2	-169.7	98.9	0	0	110.6	H888 W890 D891 D892 L893 S921 F984 I986	H888-E918 IonicContact CE1-OE2 3.63Å; H888-E918 IonicContact NE2-OE2 3.04Å; H888-E918 PolarHBondContact NE2-OE2 3.1Å; W890-E918 WeakPolarHBondContact CA-OE2 3.43Å; D891-E918 WeakPolarHBondContact CA-OE1 3.26Å; D891-E918 WeakPolarHBondContact CA-OE2 3.37Å; D891-E918 PolarHBondContact N-OE1 3.28Å; D891-E918 PolarHBondContact N-OE2 3.03Å; D892-E918 VanDerWaalsContact O-CB 3.26Å; D892-E918 WeakPolarHBondContact O-CB 3.26Å; L893-E918 PolarHBondContact O-N 2.95Å; E918-S921 WeakPolarHBondContact OE1-CB 3.38Å; E918-F984 CarbonylContact C-O 3.57Å; E918-F984 WeakPolarHBondContact CA-O 3.44Å; E918-F984 HydrophobicContact CG-CB 4.45Å; E918-I986 HydrophobicContact CG-CD1 3.34Å; E918-I986 HydrophobicContact CG-CG1 4.02Å; E918-I986 WeakPolarHBondContact OE1-CD1 3.33Å; E918-I986 WeakPolarHBondContact OE2-CD1 3.38Å
919	W	70.8	Confident	72.4	Confident	48.5 Å²	48.5	36 Å²	36	18%	0.184	18%	0.177	C	C	.	.			trans	-156.8	128	-175.9	-175.8	-90.8	0	0	0	115.7	M924 F984 L985 W1142 F1145	W919-M924 HydrophobicContact CE3-CE 4.22Å; W919-M924 HydrophobicContact CE3-CG 3.99Å; W919-M924 HydrophobicContact CE3-SD 4.44Å; W919-M924 HydrophobicContact CH2-CG 4.37Å; W919-M924 HydrophobicContact CZ3-CE 4.26Å; W919-M924 HydrophobicContact CZ3-CG 3.83Å; W919-M924 VanDerWaalsContact CZ3-CG 3.43Å; W919-M924 HydrophobicContact CZ3-SD 4.15Å; W919-F984 PolarHBondContact N-O 3.12Å; W919-L985 HydrophobicContact CB-CD2 4.3Å; W919-L985 WeakPolarHBondContact O-CA 3.38Å; W919-L985 WeakPolarHBondContact O-CB 3.44Å; W919-L985 WeakPolarHBondContact O-CD2 3.23Å; W919-W1142 AromaticContact CE2-CZ3 3.87Å; W919-W1142 HydrophobicContact CZ2-CE3 4.25Å; W919-W1142 AromaticContact CZ2-CZ3 4Å; W919-W1142 HydrophobicContact CZ2-CZ3 4.13Å; W919-W1142 AromaticContact NE1-CE3 3.46Å; W919-W1142 AromaticContact NE1-CZ3 3.31Å; W919-W1142 VanDerWaalsContact NE1-CZ3 3.31Å; W919-F1145 HydrophobicContact CH2-CB 4.39Å; W919-F1145 AromaticContact CH2-CD1 3.84Å; W919-F1145 HydrophobicContact CH2-CD1 4.11Å; W919-F1145 AromaticContact CH2-CD2 3.56Å; W919-F1145 HydrophobicContact CH2-CD2 3.87Å; W919-F1145 AromaticContact CH2-CE1 3.75Å; W919-F1145 HydrophobicContact CH2-CE1 3.75Å; W919-F1145 AromaticContact CH2-CE2 3.7Å; W919-F1145 HydrophobicContact CH2-CE2 3.7Å; W919-F1145 AromaticContact CH2-CG 3.67Å; W919-F1145 HydrophobicContact CH2-CG 3.67Å; W919-F1145 AromaticContact CH2-CZ 3.52Å; W919-F1145 HydrophobicContact CH2-CZ 3.52Å; W919-F1145 HydrophobicContact CZ2-CB 4.1Å; W919-F1145 AromaticContact CZ2-CD1 3.81Å; W919-F1145 HydrophobicContact CZ2-CD1 3.81Å; W919-F1145 HydrophobicContact CZ2-CD2 4.25Å; W919-F1145 AromaticContact CZ2-CE1 3.43Å; W919-F1145 HydrophobicContact CZ2-CE1 3.82Å; W919-F1145 VanDerWaalsContact CZ2-CE1 3.45Å; W919-F1145 HydrophobicContact CZ2-CE2 4.19Å; W919-F1145 AromaticContact CZ2-CG 3.77Å; W919-F1145 HydrophobicContact CZ2-CG 4Å; W919-F1145 AromaticContact CZ2-CZ 3.6Å; W919-F1145 HydrophobicContact CZ2-CZ 3.89Å; W919-F1145 HydrophobicContact CZ3-CE2 4.31Å; W919-F1145 HydrophobicContact CZ3-CZ 4.27Å
920	P	65.1	Low	71.4	Confident	7.75 Å²	7.75	38.1 Å²	38.1	5%	0.05	18%	0.181	C	C	.	.	S	Bend	cis	-88.2	136.1	-8.5	33.5	-31	0	0	0	110.5
921	S	66.6	Low	70.5	Confident	2.25 Å²	2.25	40.1 Å²	40.1	2%	0.016	19%	0.191	C	C	.	.			trans	-85.4	152	167.1	98.6	0	0	0	0	110.9	L836 L893 E918 K923 M924 N925	L836-S921 WeakPolarHBondContact CD1-OG 3.41Å; L893-S921 VanDerWaalsContact CD2-OG 3.27Å; L893-S921 WeakPolarHBondContact CD2-OG 3.45Å; E918-S921 WeakPolarHBondContact OE1-CB 3.38Å; S921-K923 VanDerWaalsContact C-N 3.31Å; S921-K923 PolarHBondContact O-N 2.93Å; S921-K923 PolarHBondContact OG-N 2.89Å; S921-M924 WeakPolarHBondContact O-CB 3.37Å; S921-M924 PolarHBondContact O-N 2.81Å; S921-M924 VanDerWaalsContact OG-CB 3.27Å; S921-M924 WeakPolarHBondContact OG-CB 3.4Å; S921-M924 PolarHBondContact OG-N 3.2Å; S921-N925 PolarHBondContact O-N 3.11Å; S921-N925 PolarHBondContact O-ND2 2.87Å
922	F	65.4	Low	69.3	Low	149 Å²	149	41.7 Å²	41.7	65%	0.654	20%	0.2	S	C	*	.	H	α-helix	trans	-60.4	-42	173.3	179.4	-95	0	0	0	110.7	M924 N925 E926	F922-M924 VanDerWaalsContact C-N 3.32Å; F922-M924 PolarHBondContact O-N 3.14Å; F922-N925 WeakPolarHBondContact O-CB 3.42Å; F922-N925 PolarHBondContact O-N 2.95Å; F922-E926 HydrophobicContact CD1-CG 4.33Å; F922-E926 HydrophobicContact CE1-CG 3.93Å; F922-E926 WeakPolarHBondContact CE1-OE1 3.48Å; F922-E926 HydrophobicContact CZ-CG 4.35Å; F922-E926 PolarHBondContact O-N 2.95Å
923	K	64.7	Low	68	Low	24.5 Å²	24.5	47.2 Å²	47.2	11%	0.107	22%	0.22	C	C	.	.	H	α-helix	trans	-63	-36.2	177.9	-58.9	-175.6	-177.4	179.9	0	112.6	L836 D838 D891 S921 N925 E926 L927	L836-K923 HydrophobicContact CB-CB 4.34Å; L836-K923 HydrophobicContact CB-CD 4.12Å; L836-K923 HydrophobicContact CD1-CB 3.8Å; L836-K923 HydrophobicContact CD2-CB 3.46Å; L836-K923 VanDerWaalsContact CD2-CB 3.46Å; L836-K923 HydrophobicContact CG-CB 4.45Å; L836-K923 PolarHBondContact O-NZ 3.02Å; D838-K923 WeakPolarHBondContact OD1-CE 3.36Å; D838-K923 IonicContact OD1-NZ 3.03Å; D838-K923 PolarHBondContact OD1-NZ 3.18Å; D838-K923 IonicContact OD2-NZ 3.22Å; D838-K923 PolarHBondContact OD2-NZ 3.13Å; D891-K923 HydrophobicContact CB-CD 4.03Å; D891-K923 VanDerWaalsContact CG-NZ 3.26Å; D891-K923 WeakPolarHBondContact OD1-CD 3.16Å; D891-K923 WeakPolarHBondContact OD1-CE 3.43Å; D891-K923 WeakPolarHBondContact OD1-CG 3.41Å; D891-K923 IonicContact OD1-NZ 3.09Å; D891-K923 WeakPolarHBondContact OD2-CE 3.46Å; D891-K923 IonicContact OD2-NZ 3.02Å; D891-K923 PolarHBondContact OD2-NZ 2.99Å; S921-K923 VanDerWaalsContact C-N 3.31Å; S921-K923 PolarHBondContact O-N 2.93Å; S921-K923 PolarHBondContact OG-N 2.89Å; K923-N925 VanDerWaalsContact C-N 3.31Å; K923-N925 PolarHBondContact O-N 3.12Å; K923-E926 WeakPolarHBondContact O-CB 3.35Å; K923-E926 PolarHBondContact O-N 3.03Å; K923-E926 VanDerWaalsContact O-N 3.17Å; K923-L927 WeakPolarHBondContact O-CB 3.31Å; K923-L927 PolarHBondContact O-N 3.11Å
924	M	66.1	Low	66.5	Low	29.75 Å²	29.75	49.4 Å²	49.4	15%	0.147	23%	0.23	C	C	.	.	H	α-helix	trans	-63.6	-37.8	173.9	-176.6	64	90.2	0	0	111.9	L836 L893 W919 S921 F922 E926 L927 M928	L836-M924 HydrophobicContact CD1-CB 4.15Å; L893-M924 HydrophobicContact CB-CE 4.32Å; L893-M924 HydrophobicContact CD1-CE 3.58Å; L893-M924 HydrophobicContact CD1-SD 4.39Å; L893-M924 HydrophobicContact CD2-CB 4.22Å; L893-M924 HydrophobicContact CD2-CE 4.05Å; L893-M924 HydrophobicContact CG-CE 4.28Å; W919-M924 HydrophobicContact CE3-CE 4.22Å; W919-M924 HydrophobicContact CE3-CG 3.99Å; W919-M924 HydrophobicContact CE3-SD 4.44Å; W919-M924 HydrophobicContact CH2-CG 4.37Å; W919-M924 HydrophobicContact CZ3-CE 4.26Å; W919-M924 HydrophobicContact CZ3-CG 3.83Å; W919-M924 VanDerWaalsContact CZ3-CG 3.43Å; W919-M924 HydrophobicContact CZ3-SD 4.15Å; S921-M924 WeakPolarHBondContact O-CB 3.37Å; S921-M924 PolarHBondContact O-N 2.81Å; S921-M924 VanDerWaalsContact OG-CB 3.27Å; S921-M924 WeakPolarHBondContact OG-CB 3.4Å; S921-M924 PolarHBondContact OG-N 3.2Å; F922-M924 VanDerWaalsContact C-N 3.32Å; F922-M924 PolarHBondContact O-N 3.14Å; M924-E926 VanDerWaalsContact C-N 3.33Å; M924-E926 PolarHBondContact O-N 2.9Å; M924-L927 PolarHBondContact O-N 3.13Å; M924-L927 HydrophobicContact SD-CD2 4.12Å; M924-M928 WeakPolarHBondContact O-CB 3.35Å; M924-M928 VanDerWaalsContact O-CG 3.26Å; M924-M928 WeakPolarHBondContact O-CG 3.44Å; M924-M928 PolarHBondContact O-N 3Å; M924-M928 HydrophobicContact SD-CE 3.88Å; M924-M928 HydrophobicContact SD-CG 4.39Å
925	N	66.8	Low	65	Low	56 Å²	56	54.8 Å²	54.8	30%	0.299	25%	0.251	S	S	.	.	H	α-helix	trans	-67.5	-36.5	174.3	-80.5	-52.3	0	0	0	112.3	S921 F922 K923 M928 N929 F1145	S921-N925 PolarHBondContact O-N 3.11Å; S921-N925 PolarHBondContact O-ND2 2.87Å; F922-N925 WeakPolarHBondContact O-CB 3.42Å; F922-N925 PolarHBondContact O-N 2.95Å; K923-N925 VanDerWaalsContact C-N 3.31Å; K923-N925 PolarHBondContact O-N 3.12Å; N925-M928 PolarHBondContact O-N 2.81Å; N925-N929 WeakPolarHBondContact O-CB 2.97Å; N925-N929 VanDerWaalsContact O-CG 3.26Å; N925-N929 PolarHBondContact O-N 2.88Å; N925-N929 VanDerWaalsContact O-N 3.08Å; N925-N929 PolarHBondContact O-ND2 3.26Å; N925-N929 VanDerWaalsContact O-ND2 3.14Å; N925-N929 PolarHBondContact O-OD1 2.96Å; N925-F1145 WeakPolarHBondContact OD1-CD2 3.24Å
926	E	66	Low	63.4	Low	55.5 Å²	55.5	57.5 Å²	57.5	26%	0.259	27%	0.27	S	S	.	.	H	α-helix	trans	-64.1	-49.9	171.6	-70.7	-159.6	142.1	0	0	111.7	K839 F922 K923 M924 M928 N929 Y930	K839-E926 WeakPolarHBondContact CE-OE2 3.29Å; K839-E926 IonicContact NZ-OE1 2.96Å; K839-E926 PolarHBondContact NZ-OE1 3.19Å; K839-E926 IonicContact NZ-OE2 2.88Å; K839-E926 PolarHBondContact NZ-OE2 3.26Å; F922-E926 HydrophobicContact CD1-CG 4.33Å; F922-E926 HydrophobicContact CE1-CG 3.93Å; F922-E926 WeakPolarHBondContact CE1-OE1 3.48Å; F922-E926 HydrophobicContact CZ-CG 4.35Å; F922-E926 PolarHBondContact O-N 2.95Å; K923-E926 WeakPolarHBondContact O-CB 3.35Å; K923-E926 PolarHBondContact O-N 3.03Å; K923-E926 VanDerWaalsContact O-N 3.17Å; M924-E926 VanDerWaalsContact C-N 3.33Å; M924-E926 PolarHBondContact O-N 2.9Å; E926-M928 VanDerWaalsContact C-N 3.3Å; E926-M928 PolarHBondContact O-N 3.07Å; E926-N929 WeakPolarHBondContact O-CA 3.49Å; E926-N929 WeakPolarHBondContact O-CB 3.44Å; E926-N929 PolarHBondContact O-N 3.31Å; E926-N929 VanDerWaalsContact O-N 3.11Å; E926-Y930 VanDerWaalsContact O-CD2 3.27Å; E926-Y930 WeakPolarHBondContact O-CD2 3.35Å; E926-Y930 PolarHBondContact O-N 3.32Å; E926-Y930 VanDerWaalsContact O-N 3.09Å
927	L	64	Low	61.6	Low	27.5 Å²	27.5	61.1 Å²	61.1	14%	0.144	29%	0.289	C	S	.	.	H	α-helix	trans	-54.1	-44.8	177.1	-178.6	87.9	0	0	0	111.4	P791 L793 L836 K923 M924 N929 Y930 I931	P791-L927 HydrophobicContact CG-CB 4.28Å; P791-L927 HydrophobicContact CG-CD1 4.31Å; L793-L927 HydrophobicContact CD1-CD1 4.48Å; L836-L927 HydrophobicContact CD1-CB 4.08Å; L836-L927 HydrophobicContact CD1-CD1 4Å; L836-L927 HydrophobicContact CD1-CD2 4.35Å; L836-L927 HydrophobicContact CD2-CB 4.37Å; L836-L927 HydrophobicContact CD2-CD1 4.19Å; L836-L927 HydrophobicContact CD2-CD2 4.33Å; K923-L927 WeakPolarHBondContact O-CB 3.31Å; K923-L927 PolarHBondContact O-N 3.11Å; M924-L927 PolarHBondContact O-N 3.13Å; M924-L927 HydrophobicContact SD-CD2 4.12Å; L927-N929 VanDerWaalsContact C-N 3.33Å; L927-N929 PolarHBondContact O-N 3.34Å; L927-Y930 WeakPolarHBondContact O-CB 3.42Å; L927-Y930 PolarHBondContact O-N 3.18Å; L927-I931 HydrophobicContact CD1-CD1 4.4Å; L927-I931 HydrophobicContact CD2-CD1 4.09Å; L927-I931 HydrophobicContact CG-CD1 4.07Å; L927-I931 HydrophobicContact CG-CG1 4.5Å; L927-I931 WeakPolarHBondContact O-CG1 3.29Å; L927-I931 PolarHBondContact O-N 3.28Å
928	M	63	Low	59.7	Low	42.5 Å²	42.5	65.7 Å²	65.7	21%	0.209	31%	0.31	C	S	.	.	H	α-helix	trans	-68.6	-30.8	178	-73	-62.3	-120.6	0	0	113.5	M924 N925 E926 Y930 I931 H932 F1145 L1149	M924-M928 WeakPolarHBondContact O-CB 3.35Å; M924-M928 VanDerWaalsContact O-CG 3.26Å; M924-M928 WeakPolarHBondContact O-CG 3.44Å; M924-M928 PolarHBondContact O-N 3Å; M924-M928 HydrophobicContact SD-CE 3.88Å; M924-M928 HydrophobicContact SD-CG 4.39Å; N925-M928 PolarHBondContact O-N 2.81Å; E926-M928 VanDerWaalsContact C-N 3.3Å; E926-M928 PolarHBondContact O-N 3.07Å; M928-Y930 VanDerWaalsContact C-N 3.35Å; M928-Y930 PolarHBondContact O-N 2.86Å; M928-I931 PolarHBondContact O-N 2.85Å; M928-I931 HydrophobicContact SD-CD1 4.1Å; M928-H932 VanDerWaalsContact O-CB 3.28Å; M928-H932 WeakPolarHBondContact O-CB 3.37Å; M928-H932 PolarHBondContact O-N 3.16Å; M928-H932 VanDerWaalsContact O-N 3.13Å; M928-F1145 HydrophobicContact CE-CE2 4.05Å; M928-F1145 HydrophobicContact CE-CZ 4.29Å; M928-F1145 HydrophobicContact CG-CD2 4.27Å; M928-F1145 HydrophobicContact CG-CE2 4.1Å; M928-F1145 HydrophobicContact SD-CE2 3.85Å; M928-L1149 HydrophobicContact CE-CD1 4.27Å; M928-L1149 HydrophobicContact CE-CD2 3.72Å; M928-L1149 HydrophobicContact CE-CG 3.91Å
929	N	65.7	Low	58.1	Low	78.75 Å²	78.75	72.1 Å²	72.1	42%	0.421	34%	0.344	S	S	.	.	H	α-helix	trans	-68.9	-37.3	172	-68.4	-26.6	0	0	0	111.3	N925 E926 L927 H932 W933 K1148	N925-N929 WeakPolarHBondContact O-CB 2.97Å; N925-N929 VanDerWaalsContact O-CG 3.26Å; N925-N929 PolarHBondContact O-N 2.88Å; N925-N929 VanDerWaalsContact O-N 3.08Å; N925-N929 PolarHBondContact O-ND2 3.26Å; N925-N929 VanDerWaalsContact O-ND2 3.14Å; N925-N929 PolarHBondContact O-OD1 2.96Å; E926-N929 WeakPolarHBondContact O-CA 3.49Å; E926-N929 WeakPolarHBondContact O-CB 3.44Å; E926-N929 PolarHBondContact O-N 3.31Å; E926-N929 VanDerWaalsContact O-N 3.11Å; L927-N929 VanDerWaalsContact C-N 3.33Å; L927-N929 PolarHBondContact O-N 3.34Å; N929-H932 PolarHBondContact O-N 2.98Å; N929-W933 WeakPolarHBondContact O-CB 3.36Å; N929-W933 PolarHBondContact O-N 3.06Å; N929-K1148 PolarHBondContact OD1-NZ 3.03Å
930	Y	60.3	Low	56.6	Low	66.25 Å²	66.25	74.2 Å²	74.2	26%	0.26	36%	0.362	S	S	.	.	H	α-helix	trans	-65.8	-47.3	174.2	-98.6	-80.5	0	0	0	112.1	D787 K789 E926 L927 M928 H932 W933 D934	D787-Y930 PolarHBondContact OD2-OH 3.02Å; K789-Y930 PolarHBondContact O-OH 3.04Å; E926-Y930 VanDerWaalsContact O-CD2 3.27Å; E926-Y930 WeakPolarHBondContact O-CD2 3.35Å; E926-Y930 PolarHBondContact O-N 3.32Å; E926-Y930 VanDerWaalsContact O-N 3.09Å; L927-Y930 WeakPolarHBondContact O-CB 3.42Å; L927-Y930 PolarHBondContact O-N 3.18Å; M928-Y930 VanDerWaalsContact C-N 3.35Å; M928-Y930 PolarHBondContact O-N 2.86Å; Y930-H932 VanDerWaalsContact C-N 3.29Å; Y930-H932 PolarHBondContact O-N 3.25Å; Y930-W933 HydrophobicContact CD1-CE3 4.45Å; Y930-W933 WeakPolarHBondContact O-CA 3.34Å; Y930-W933 WeakPolarHBondContact O-CB 3.36Å; Y930-W933 PolarHBondContact O-N 2.94Å; Y930-W933 VanDerWaalsContact O-N 3.13Å; Y930-D934 PolarHBondContact O-N 3.13Å; Y930-D934 VanDerWaalsContact O-N 3.07Å
931	I	59.4	Low	55.4	Low	66.25 Å²	66.25	79.1 Å²	79.1	34%	0.34	38%	0.381	S	S	.	.	H	α-helix	trans	-57.4	-42.5	175.1	-67.4	167.4	0	0	0	110.3	L927 M928 W933 D934 Y935	L927-I931 HydrophobicContact CD1-CD1 4.4Å; L927-I931 HydrophobicContact CD2-CD1 4.09Å; L927-I931 HydrophobicContact CG-CD1 4.07Å; L927-I931 HydrophobicContact CG-CG1 4.5Å; L927-I931 WeakPolarHBondContact O-CG1 3.29Å; L927-I931 PolarHBondContact O-N 3.28Å; M928-I931 PolarHBondContact O-N 2.85Å; M928-I931 HydrophobicContact SD-CD1 4.1Å; I931-W933 VanDerWaalsContact C-N 3.32Å; I931-W933 PolarHBondContact O-N 3.01Å; I931-D934 PolarHBondContact O-N 3.42Å; I931-Y935 HydrophobicContact CG2-CD2 4.1Å; I931-Y935 HydrophobicContact CG2-CE2 4.16Å; I931-Y935 VanDerWaalsContact O-CD2 3.3Å; I931-Y935 WeakPolarHBondContact O-CD2 3.3Å; I931-Y935 PolarHBondContact O-N 3.24Å; I931-Y935 VanDerWaalsContact O-N 3.1Å
932	H	58.1	Low	53.9	Low	91.25 Å²	91.25	85.2 Å²	85.2	42%	0.422	41%	0.409	S	S	.	.	H	α-helix	trans	-68.4	-32.4	176.8	-165.9	-61.5	0	0	0	112.9	M928 N929 Y930 Y935 S936 Q1152	M928-H932 VanDerWaalsContact O-CB 3.28Å; M928-H932 WeakPolarHBondContact O-CB 3.37Å; M928-H932 PolarHBondContact O-N 3.16Å; M928-H932 VanDerWaalsContact O-N 3.13Å; N929-H932 PolarHBondContact O-N 2.98Å; Y930-H932 VanDerWaalsContact C-N 3.29Å; Y930-H932 PolarHBondContact O-N 3.25Å; H932-Y935 PolarHBondContact O-N 3.08Å; H932-S936 VanDerWaalsContact O-CB 3.31Å; H932-S936 WeakPolarHBondContact O-CB 3.37Å; H932-S936 PolarHBondContact O-N 3.06Å; H932-S936 VanDerWaalsContact O-N 3.07Å; H932-S936 PolarHBondContact O-OG 2.99Å; H932-Q1152 PolarHBondContact CE1-NE2 2.76Å
933	W	53.3	Low	52.5	Low	150.25 Å²	150.25	82.3 Å²	82.3	57%	0.569	41%	0.406	S	S	*	.	H	α-helix	trans	-66.6	-47.3	176.7	-179	44.4	0	0	0	111.5	N929 Y930 I931 Y935 S936 N937	N929-W933 WeakPolarHBondContact O-CB 3.36Å; N929-W933 PolarHBondContact O-N 3.06Å; Y930-W933 HydrophobicContact CD1-CE3 4.45Å; Y930-W933 WeakPolarHBondContact O-CA 3.34Å; Y930-W933 WeakPolarHBondContact O-CB 3.36Å; Y930-W933 PolarHBondContact O-N 2.94Å; Y930-W933 VanDerWaalsContact O-N 3.13Å; I931-W933 VanDerWaalsContact C-N 3.32Å; I931-W933 PolarHBondContact O-N 3.01Å; W933-Y935 VanDerWaalsContact C-N 3.28Å; W933-Y935 PolarHBondContact O-N 3.06Å; W933-S936 WeakPolarHBondContact CA-OG 3.31Å; W933-S936 WeakPolarHBondContact O-CA 3.22Å; W933-S936 PolarHBondContact O-N 2.97Å; W933-S936 VanDerWaalsContact O-N 3.13Å; W933-S936 PolarHBondContact O-OG 3.32Å; W933-N937 VanDerWaalsContact CE2-ND2 3.3Å; W933-N937 WeakPolarHBondContact CZ2-ND2 3.3Å; W933-N937 PolarHBondContact O-N 2.94Å; W933-N937 VanDerWaalsContact O-N 3.11Å
934	D	48.3	Very low	51.1	Low	80 Å²	80	87.8 Å²	87.8	43%	0.428	43%	0.427	S	S	.	.	H	α-helix	trans	-61.3	-38	176	-83.4	-19.2	0	0	0	112.3	Y930 I931 S936 N937	Y930-D934 PolarHBondContact O-N 3.13Å; Y930-D934 VanDerWaalsContact O-N 3.07Å; I931-D934 PolarHBondContact O-N 3.42Å; D934-S936 VanDerWaalsContact C-N 3.28Å; D934-S936 PolarHBondContact O-N 3.16Å; D934-N937 PolarHBondContact O-N 2.87Å
935	Y	47.5	Very low	49.7	Very low	121.5 Å²	121.5	90.6 Å²	90.6	48%	0.476	44%	0.443	S	S	.	.	H	α-helix	trans	-70.2	-23.9	174.2	-91.6	-76.4	0	0	0	113.8	M609 I931 H932 W933 N937 Y941	M609-Y935 HydrophobicContact CE-CE2 4.08Å; I931-Y935 HydrophobicContact CG2-CD2 4.1Å; I931-Y935 HydrophobicContact CG2-CE2 4.16Å; I931-Y935 VanDerWaalsContact O-CD2 3.3Å; I931-Y935 WeakPolarHBondContact O-CD2 3.3Å; I931-Y935 PolarHBondContact O-N 3.24Å; I931-Y935 VanDerWaalsContact O-N 3.1Å; H932-Y935 PolarHBondContact O-N 3.08Å; W933-Y935 VanDerWaalsContact C-N 3.28Å; W933-Y935 PolarHBondContact O-N 3.06Å; Y935-N937 VanDerWaalsContact C-N 3.3Å; Y935-Y941 AromaticContact CD1-CD2 3.86Å; Y935-Y941 HydrophobicContact CD1-CD2 3.86Å; Y935-Y941 AromaticContact CD1-CE2 3.63Å; Y935-Y941 HydrophobicContact CD1-CE2 3.82Å; Y935-Y941 HydrophobicContact CE1-CD2 4.4Å; Y935-Y941 AromaticContact CE1-CE2 3.79Å; Y935-Y941 HydrophobicContact CE1-CE2 4Å; Y935-Y941 VanDerWaalsContact CE1-OH 3.26Å; Y935-Y941 WeakPolarHBondContact CE1-OH 3.38Å; Y935-Y941 HydrophobicContact CG-CE2 4.41Å; Y935-Y941 WeakPolarHBondContact O-CD2 3.47Å; Y935-Y941 VanDerWaalsContact O-CE2 3.26Å; Y935-Y941 WeakPolarHBondContact O-CE2 3.49Å
936	S	45.4	Very low	48.2	Very low	66.75 Å²	66.75	92.9 Å²	92.9	47%	0.467	46%	0.455	S	S	.	.	H	α-helix	trans	-83.3	-14.3	179	58	0	0	0	0	114.1	H932 W933 D934 E938	H932-S936 VanDerWaalsContact O-CB 3.31Å; H932-S936 WeakPolarHBondContact O-CB 3.37Å; H932-S936 PolarHBondContact O-N 3.06Å; H932-S936 VanDerWaalsContact O-N 3.07Å; H932-S936 PolarHBondContact O-OG 2.99Å; W933-S936 WeakPolarHBondContact CA-OG 3.31Å; W933-S936 WeakPolarHBondContact O-CA 3.22Å; W933-S936 PolarHBondContact O-N 2.97Å; W933-S936 VanDerWaalsContact O-N 3.13Å; W933-S936 PolarHBondContact O-OG 3.32Å; D934-S936 VanDerWaalsContact C-N 3.28Å; D934-S936 PolarHBondContact O-N 3.16Å; S936-E938 VanDerWaalsContact C-N 3.32Å; S936-E938 PolarHBondContact O-N 3.23Å; S936-E938 VanDerWaalsContact O-N 3.1Å
937	N	42.9	Very low	46.8	Very low	78 Å²	78	97 Å²	97	42%	0.417	47%	0.474	S	S	.	.			trans	-75.2	81.8	170.2	-82.7	-33.3	0	0	0	110.5	W933 D934 Y935 N939 V940	W933-N937 VanDerWaalsContact CE2-ND2 3.3Å; W933-N937 WeakPolarHBondContact CZ2-ND2 3.3Å; W933-N937 PolarHBondContact O-N 2.94Å; W933-N937 VanDerWaalsContact O-N 3.11Å; D934-N937 PolarHBondContact O-N 2.87Å; Y935-N937 VanDerWaalsContact C-N 3.3Å; N937-N939 PolarHBondContact O-N 3.11Å; N937-V940 PolarHBondContact O-N 3.27Å; N937-V940 VanDerWaalsContact O-N 3.12Å
938	E	39.9	Very low	45.4	Very low	136.75 Å²	136.75	99.7 Å²	99.7	64%	0.639	49%	0.488	S	S	*	.	H	α-helix	trans	-57.4	-16.9	-171.6	-83.3	-171.7	159.9	0	0	114.9	S936 V940 Y941 Q942	S936-E938 VanDerWaalsContact C-N 3.32Å; S936-E938 PolarHBondContact O-N 3.23Å; S936-E938 VanDerWaalsContact O-N 3.1Å; E938-V940 VanDerWaalsContact C-N 3.26Å; E938-V940 PolarHBondContact O-N 3.05Å; E938-V940 VanDerWaalsContact O-N 3.09Å; E938-Y941 PolarHBondContact O-N 3.17Å; E938-Y941 VanDerWaalsContact O-N 3.08Å; E938-Q942 PolarHBondContact O-N 3.17Å
939	N	40.1	Very low	44	Very low	135.75 Å²	135.75	102.5 Å²	102.5	73%	0.726	50%	0.503	S	S	*	.	H	α-helix	trans	-63.4	-24.2	179.6	-72.4	-17.5	0	0	0	114.2	N937	N937-N939 PolarHBondContact O-N 3.11Å
940	V	40.5	Very low	42.4	Very low	91.75 Å²	91.75	106.8 Å²	106.8	56%	0.556	52%	0.518	S	S	*	.	H	α-helix	trans	-82	-30.3	178.3	-175.3	0	0	0	0	111.7	M609 N937 E938 Q942 C943 Y944	M609-V940 HydrophobicContact CE-CG1 4.33Å; N937-V940 PolarHBondContact O-N 3.27Å; N937-V940 VanDerWaalsContact O-N 3.12Å; E938-V940 VanDerWaalsContact C-N 3.26Å; E938-V940 PolarHBondContact O-N 3.05Å; E938-V940 VanDerWaalsContact O-N 3.09Å; V940-Q942 VanDerWaalsContact C-N 3.34Å; V940-Q942 PolarHBondContact O-N 2.85Å; V940-C943 PolarHBondContact O-N 2.9Å; V940-Y944 PolarHBondContact O-N 3.03Å
941	Y	38.5	Very low	41.1	Very low	111.25 Å²	111.25	110.6 Å²	110.6	44%	0.436	54%	0.542	S	S	.	.	H	α-helix	trans	-74.7	-30.3	-177.2	-98.4	-76.8	0	0	0	113.6	Y935 E938 C943 Y944 N945	Y935-Y941 AromaticContact CD1-CD2 3.86Å; Y935-Y941 HydrophobicContact CD1-CD2 3.86Å; Y935-Y941 AromaticContact CD1-CE2 3.63Å; Y935-Y941 HydrophobicContact CD1-CE2 3.82Å; Y935-Y941 HydrophobicContact CE1-CD2 4.4Å; Y935-Y941 AromaticContact CE1-CE2 3.79Å; Y935-Y941 HydrophobicContact CE1-CE2 4Å; Y935-Y941 VanDerWaalsContact CE1-OH 3.26Å; Y935-Y941 WeakPolarHBondContact CE1-OH 3.38Å; Y935-Y941 HydrophobicContact CG-CE2 4.41Å; Y935-Y941 WeakPolarHBondContact O-CD2 3.47Å; Y935-Y941 VanDerWaalsContact O-CE2 3.26Å; Y935-Y941 WeakPolarHBondContact O-CE2 3.49Å; E938-Y941 PolarHBondContact O-N 3.17Å; E938-Y941 VanDerWaalsContact O-N 3.08Å; Y941-C943 VanDerWaalsContact C-N 3.31Å; Y941-C943 PolarHBondContact O-N 3.17Å; Y941-Y944 HydrophobicContact CD1-CD1 4.27Å; Y941-Y944 HydrophobicContact CE1-CD1 4.09Å; Y941-Y944 WeakPolarHBondContact O-CA 3.41Å; Y941-Y944 VanDerWaalsContact O-CB 3.29Å; Y941-Y944 WeakPolarHBondContact O-CB 3.27Å; Y941-Y944 PolarHBondContact O-N 3.2Å; Y941-N945 WeakPolarHBondContact O-CB 3.41Å; Y941-N945 PolarHBondContact O-N 3.17Å; Y941-N945 VanDerWaalsContact O-N 3.1Å
942	Q	36.5	Very low	39.7	Very low	129 Å²	129	111.5 Å²	111.5	60%	0.603	55%	0.554	S	S	*	*	H	α-helix	trans	-63	-35.1	176.8	-70.4	-166.1	0.2	0	0	112.7	E938 V940 Y944 N945 N946	E938-Q942 PolarHBondContact O-N 3.17Å; V940-Q942 VanDerWaalsContact C-N 3.34Å; V940-Q942 PolarHBondContact O-N 2.85Å; Q942-Y944 VanDerWaalsContact C-N 3.29Å; Q942-Y944 PolarHBondContact O-N 3.02Å; Q942-N945 PolarHBondContact O-N 3.21Å; Q942-N946 WeakPolarHBondContact O-CB 3.41Å; Q942-N946 VanDerWaalsContact O-CG 3.29Å; Q942-N946 PolarHBondContact O-N 3.12Å; Q942-N946 VanDerWaalsContact O-N 3.16Å; Q942-N946 PolarHBondContact O-ND2 2.92Å
943	C	35.4	Very low	38.2	Very low	88.75 Å²	88.75	111.9 Å²	111.9	60%	0.6	56%	0.563	S	S	*	*	H	α-helix	trans	-66.1	-32.9	175.7	-71.4	0	0	0	0	112.9	V940 Y941 H947	V940-C943 PolarHBondContact O-N 2.9Å; Y941-C943 VanDerWaalsContact C-N 3.31Å; Y941-C943 PolarHBondContact O-N 3.17Å; C943-H947 PolarHBondContact O-CD2 2.86Å; C943-H947 PolarHBondContact O-N 3.43Å
944	Y	36.1	Very low	37	Very low	140.75 Å²	140.75	111.3 Å²	111.3	55%	0.552	57%	0.572	S	S	*	*	H	α-helix	trans	-75.5	-45.1	-179.4	-155	-96.7	0	0	0	112.3	V940 Y941 Q942 N946 H947 I948	V940-Y944 PolarHBondContact O-N 3.03Å; Y941-Y944 HydrophobicContact CD1-CD1 4.27Å; Y941-Y944 HydrophobicContact CE1-CD1 4.09Å; Y941-Y944 WeakPolarHBondContact O-CA 3.41Å; Y941-Y944 VanDerWaalsContact O-CB 3.29Å; Y941-Y944 WeakPolarHBondContact O-CB 3.27Å; Y941-Y944 PolarHBondContact O-N 3.2Å; Q942-Y944 VanDerWaalsContact C-N 3.29Å; Q942-Y944 PolarHBondContact O-N 3.02Å; Y944-N946 VanDerWaalsContact C-N 3.33Å; Y944-N946 PolarHBondContact O-N 3.16Å; Y944-H947 PolarHBondContact O-N 3.22Å; Y944-I948 HydrophobicContact CD1-CD1 4Å; Y944-I948 HydrophobicContact CD1-CG1 4.38Å; Y944-I948 HydrophobicContact CE1-CD1 3.81Å; Y944-I948 HydrophobicContact CE1-CG1 4.21Å; Y944-I948 HydrophobicContact CE2-CD1 4.26Å; Y944-I948 PolarHBondContact O-N 3.21Å; Y944-I948 VanDerWaalsContact O-N 3.12Å
945	N	35.8	Very low	36.1	Very low	88 Å²	88	118.6 Å²	118.6	47%	0.471	59%	0.593	S	S	.	*	H	α-helix	trans	-68.3	-34.1	178.5	-84.4	-13	0	0	0	112.8	Y941 Q942 H947 I948 N949	Y941-N945 WeakPolarHBondContact O-CB 3.41Å; Y941-N945 PolarHBondContact O-N 3.17Å; Y941-N945 VanDerWaalsContact O-N 3.1Å; Q942-N945 PolarHBondContact O-N 3.21Å; N945-H947 VanDerWaalsContact C-N 3.3Å; N945-H947 PolarHBondContact O-N 3.25Å; N945-I948 PolarHBondContact O-N 3.29Å; N945-I948 VanDerWaalsContact O-N 3.13Å; N945-N949 VanDerWaalsContact O-CB 3.27Å; N945-N949 WeakPolarHBondContact O-CB 3.32Å; N945-N949 PolarHBondContact O-N 2.97Å; N945-N949 VanDerWaalsContact O-N 3.11Å
946	N	36.1	Very low	34.9	Very low	105.25 Å²	105.25	118.5 Å²	118.5	56%	0.563	61%	0.61	S	S	*	*	H	α-helix	trans	-66.9	-26	175.8	-78.2	-20.8	0	0	0	113.2	Q942 Y944 K950	Q942-N946 WeakPolarHBondContact O-CB 3.41Å; Q942-N946 VanDerWaalsContact O-CG 3.29Å; Q942-N946 PolarHBondContact O-N 3.12Å; Q942-N946 VanDerWaalsContact O-N 3.16Å; Q942-N946 PolarHBondContact O-ND2 2.92Å; Y944-N946 VanDerWaalsContact C-N 3.33Å; Y944-N946 PolarHBondContact O-N 3.16Å; N946-K950 WeakPolarHBondContact O-CB 3.49Å; N946-K950 PolarHBondContact O-N 3.43Å
947	H	35.5	Very low	34	Very low	140.25 Å²	140.25	120.2 Å²	120.2	65%	0.649	62%	0.622	S	S	*	*	H	α-helix	trans	-80	-35.1	173.6	-97.7	-73.3	0	0	0	113.5	C943 Y944 N945 K950 L951	C943-H947 PolarHBondContact O-CD2 2.86Å; C943-H947 PolarHBondContact O-N 3.43Å; Y944-H947 PolarHBondContact O-N 3.22Å; N945-H947 VanDerWaalsContact C-N 3.3Å; N945-H947 PolarHBondContact O-N 3.25Å; H947-K950 PolarHBondContact O-N 2.84Å; H947-L951 PolarHBondContact O-N 3.23Å
948	I	35.2	Very low	33.2	Very low	84.75 Å²	84.75	121.7 Å²	121.7	44%	0.435	64%	0.639	S	S	.	*	H	α-helix	trans	-73	-41.7	177.1	-66.3	178.7	0	0	0	111	Y944 N945 K950 L951 S952	Y944-I948 HydrophobicContact CD1-CD1 4Å; Y944-I948 HydrophobicContact CD1-CG1 4.38Å; Y944-I948 HydrophobicContact CE1-CD1 3.81Å; Y944-I948 HydrophobicContact CE1-CG1 4.21Å; Y944-I948 HydrophobicContact CE2-CD1 4.26Å; Y944-I948 PolarHBondContact O-N 3.21Å; Y944-I948 VanDerWaalsContact O-N 3.12Å; N945-I948 PolarHBondContact O-N 3.29Å; N945-I948 VanDerWaalsContact O-N 3.13Å; I948-K950 VanDerWaalsContact C-N 3.29Å; I948-K950 PolarHBondContact O-N 3.29Å; I948-L951 WeakPolarHBondContact O-CA 3.37Å; I948-L951 PolarHBondContact O-N 3Å; I948-S952 PolarHBondContact O-N 3.06Å; I948-S952 VanDerWaalsContact O-N 3.14Å; I948-S952 PolarHBondContact O-OG 3.27Å
949	N	32.8	Very low	32.6	Very low	100.25 Å²	100.25	122.6 Å²	122.6	54%	0.536	65%	0.646	S	S	.	*	H	α-helix	trans	-69	-20.6	178.8	-73.4	-12.4	0	0	0	113.6	N945 L951 S952 T953	N945-N949 VanDerWaalsContact O-CB 3.27Å; N945-N949 WeakPolarHBondContact O-CB 3.32Å; N945-N949 PolarHBondContact O-N 2.97Å; N945-N949 VanDerWaalsContact O-N 3.11Å; N949-L951 PolarHBondContact O-N 3.27Å; N949-S952 WeakPolarHBondContact CA-OG 3.24Å; N949-S952 PolarHBondContact O-OG 2.98Å; N949-T953 PolarHBondContact O-OG1 2.82Å
950	K	32.9	Very low	31.7	Very low	171 Å²	171	124.4 Å²	124.4	74%	0.743	65%	0.65	S	S	*	*	H	α-helix	trans	-81	-13.3	169.7	-87.2	-176	174.7	178.5	0	114.1	N946 H947 I948	N946-K950 WeakPolarHBondContact O-CB 3.49Å; N946-K950 PolarHBondContact O-N 3.43Å; H947-K950 PolarHBondContact O-N 2.84Å; I948-K950 VanDerWaalsContact C-N 3.29Å; I948-K950 PolarHBondContact O-N 3.29Å
951	L	32.6	Very low	31	Very low	145 Å²	145	125 Å²	125	76%	0.759	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	-18.3	177.4	-95.2	141.2	0	0	0	113.3	H947 I948 N949 T953	H947-L951 PolarHBondContact O-N 3.23Å; I948-L951 WeakPolarHBondContact O-CA 3.37Å; I948-L951 PolarHBondContact O-N 3Å; N949-L951 PolarHBondContact O-N 3.27Å; L951-T953 PolarHBondContact O-N 2.87Å
952	S	29.5	Very low	30.2	Very low	84.75 Å²	84.75	129.5 Å²	129.5	59%	0.593	67%	0.674	S	S	*	*	S	Bend	trans	-89.1	-9.1	-176.1	55.2	0	0	0	0	115.4	I948 N949 N954	I948-S952 PolarHBondContact O-N 3.06Å; I948-S952 VanDerWaalsContact O-N 3.14Å; I948-S952 PolarHBondContact O-OG 3.27Å; N949-S952 WeakPolarHBondContact CA-OG 3.24Å; N949-S952 PolarHBondContact O-OG 2.98Å; S952-N954 PolarHBondContact O-N 2.9Å; S952-N954 VanDerWaalsContact O-N 3.16Å
953	T	28.2	Very low	29.8	Very low	99.5 Å²	99.5	132.2 Å²	132.2	61%	0.61	69%	0.685	S	S	*	*	S	Bend	trans	-96.6	12.5	-177.4	50.2	0	0	0	0	114.2	N949 L951	N949-T953 PolarHBondContact O-OG1 2.82Å; L951-T953 PolarHBondContact O-N 2.87Å
954	N	27.7	Very low	29.3	Very low	139 Å²	139	135.5 Å²	135.5	74%	0.743	69%	0.693	S	S	*	*	S	Bend	trans	-145.4	76.5	177	-84.5	-30.6	0	0	0	112.1	S952	S952-N954 PolarHBondContact O-N 2.9Å; S952-N954 VanDerWaalsContact O-N 3.16Å
955	R	28.2	Very low	28.7	Very low	233.25 Å²	233.25	136.2 Å²	136.2	88%	0.88	70%	0.702	S	S	*	*			trans	179.8	66.5	160.2	-104	164	-169.5	-164.4	3.3	113.5	S957	R955-S957 PolarHBondContact O-N 3.29Å
956	S	24.1	Very low	28.3	Very low	119 Å²	119	139.2 Å²	139.2	83%	0.832	72%	0.718	S	S	*	*			trans	-113.3	75	170.3	52.9	0	0	0	0	110.8
957	S	25.7	Very low	28.3	Very low	101.25 Å²	101.25	140.7 Å²	140.7	71%	0.708	72%	0.717	S	S	*	*			trans	-164.3	129.4	161.5	54.7	0	0	0	0	112	R955 I959	R955-S957 PolarHBondContact O-N 3.29Å; S957-I959 PolarHBondContact O-N 3.36Å
958	S	25.7	Very low	28.6	Very low	110.75 Å²	110.75	137.3 Å²	137.3	77%	0.774	70%	0.703	S	S	*	*			trans	28.8	93.8	160.2	60.2	0	0	0	0	117.7
959	I	27.1	Very low	29.2	Very low	156 Å²	156	140 Å²	140	80%	0.8	72%	0.718	S	S	*	*			trans	-128.8	100.3	142.6	-67.1	171.8	0	0	0	107.2	S957 C961	S957-I959 PolarHBondContact O-N 3.36Å; I959-C961 HydrophobicContact CG2-CB 4.46Å; I959-C961 VanDerWaalsContact CG2-SG 3.55Å; I959-C961 PolarHBondContact O-N 3.03Å
960	Q	22.4	Very low	30.2	Very low	173.5 Å²	173.5	139.6 Å²	139.6	81%	0.811	72%	0.716	S	S	*	*			trans	-89	105.2	174.5	-150.7	163.1	-21.4	0	0	108.8	Y962	Q960-Y962 PolarHBondContact O-N 2.92Å; Q960-Y962 VanDerWaalsContact O-N 3.16Å
961	C	24.9	Very low	31.6	Very low	102.75 Å²	102.75	133.9 Å²	133.9	69%	0.694	70%	0.696	S	S	*	*			trans	-71.7	111.6	173.1	-72.7	0	0	0	0	113.2	I959 F963	I959-C961 HydrophobicContact CG2-CB 4.46Å; I959-C961 VanDerWaalsContact CG2-SG 3.55Å; I959-C961 PolarHBondContact O-N 3.03Å; C961-F963 HydrophobicContact CB-CD2 3.81Å; C961-F963 HydrophobicContact CB-CE2 3.93Å; C961-F963 PolarHBondContact O-N 3.43Å
962	Y	22.7	Very low	33.2	Very low	205.75 Å²	205.75	128.2 Å²	128.2	81%	0.807	67%	0.666	S	S	*	*			trans	-91	126.8	151.7	-77.7	-87.3	0	0	0	109.6	Q960	Q960-Y962 PolarHBondContact O-N 2.92Å; Q960-Y962 VanDerWaalsContact O-N 3.16Å
963	F	26.1	Very low	35.2	Very low	185.75 Å²	185.75	127.4 Å²	127.4	82%	0.815	65%	0.653	S	S	*	*			trans	-169.9	106.8	159.1	-79.9	-66.9	0	0	0	111.1	C961	C961-F963 HydrophobicContact CB-CD2 3.81Å; C961-F963 HydrophobicContact CB-CE2 3.93Å; C961-F963 PolarHBondContact O-N 3.43Å
964	M	24.9	Very low	37.5	Very low	158 Å²	158	124.7 Å²	124.7	78%	0.778	63%	0.633	S	S	*	*			trans	-100	123.6	175	-109.9	-50.6	161.6	0	0	111.2	P1008	M964-P1008 HydrophobicContact CE-CG 4.36Å
965	E	24.7	Very low	40	Very low	156.25 Å²	156.25	119.6 Å²	119.6	73%	0.73	61%	0.606	S	S	*	*			trans	-150.1	139.9	158.8	-77.9	172	172.4	0	0	113.4	Y967	E965-Y967 WeakPolarHBondContact O-CD2 3.34Å; E965-Y967 PolarHBondContact O-N 3.26Å
966	N	27.9	Very low	42.5	Very low	151.75 Å²	151.75	108.5 Å²	108.5	81%	0.811	56%	0.564	S	S	*	*			trans	56.9	71.9	163.3	-55	-26.8	0	0	0	119.4
967	Y	35.7	Very low	45.3	Very low	136.75 Å²	136.75	105.8 Å²	105.8	54%	0.536	54%	0.537	S	S	.	.			trans	-122.9	138	166.6	-75	-84.7	0	0	0	113.4	E965 N1007 P1008 I1009	E965-Y967 WeakPolarHBondContact O-CD2 3.34Å; E965-Y967 PolarHBondContact O-N 3.26Å; Y967-N1007 WeakPolarHBondContact CB-OD1 3.47Å; Y967-N1007 WeakPolarHBondContact CD2-OD1 3.28Å; Y967-N1007 VanDerWaalsContact CG-OD1 3.26Å; Y967-P1008 VanDerWaalsContact CB-CD 3.49Å; Y967-P1008 HydrophobicContact CD1-CG 3.19Å; Y967-P1008 HydrophobicContact CE1-CG 3.78Å; Y967-P1008 VanDerWaalsContact CG-CD 3.44Å; Y967-P1008 HydrophobicContact CG-CG 3.89Å; Y967-I1009 HydrophobicContact CE2-CD1 4.47Å; Y967-I1009 WeakPolarHBondContact OH-CD1 3.18Å
968	L	42	Very low	47.9	Very low	68.25 Å²	68.25	101.6 Å²	101.6	36%	0.357	51%	0.507	S	S	.	.			trans	40.8	96.4	173.9	-67.6	147.5	0	0	0	117.9	Y906	Y906-L968 HydrophobicContact CE1-CD2 3.85Å; Y906-L968 WeakPolarHBondContact OH-CD2 3.36Å
969	N	46.7	Very low	50.6	Low	142.5 Å²	142.5	98.7 Å²	98.7	76%	0.762	48%	0.481	S	S	*	.			trans	-91	-3.4	169.2	-83.3	-15.5	0	0	0	114.9	R1004	N969-R1004 PolarHBondContact O-NE 2.85Å
970	N	53.8	Low	53.2	Low	90.5 Å²	90.5	93.6 Å²	93.6	48%	0.484	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-84.1	129.4	-171.3	-68	-1.4	0	0	0	111.8	Y906	Y906-N970 HydrophobicContact CD1-CB 4.16Å; Y906-N970 HydrophobicContact CE1-CB 4.13Å; Y906-N970 WeakPolarHBondContact CE2-ND2 3.46Å; Y906-N970 HydrophobicContact CG-CB 4.41Å
971	P	62.1	Low	56	Low	52 Å²	52	85.5 Å²	85.5	34%	0.338	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-71.4	139.7	172.4	29.6	-32.8	0	0	0	111.2	F1003 R1004	P971-F1003 CarbonylContact C-O 3.57Å; P971-F1003 VanDerWaalsContact CA-O 3.28Å; P971-F1003 WeakPolarHBondContact CA-O 3.34Å; P971-R1004 HydrophobicContact CB-CG 3.99Å
972	I	65.9	Low	58.7	Low	25.25 Å²	25.25	80.7 Å²	80.7	13%	0.129	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	120.8	168.8	-60.9	169.9	0	0	0	107.6	Y906 I908 Q1002 F1003 L1013	Y906-I972 HydrophobicContact CD1-CG1 4.32Å; Y906-I972 CarbonylContact O-C 3.44Å; Y906-I972 VanDerWaalsContact O-CA 3.31Å; Y906-I972 WeakPolarHBondContact O-CA 3.45Å; Y906-I972 WeakPolarHBondContact O-CG2 3.5Å; I908-I972 HydrophobicContact CD1-CG2 4.07Å; I908-I972 HydrophobicContact CG1-CG2 4.17Å; I972-Q1002 CarbonylContact O-C 3.6Å; I972-Q1002 WeakPolarHBondContact O-CA 3.35Å; I972-F1003 HydrophobicContact CB-CB 4.46Å; I972-F1003 PolarHBondContact N-O 2.98Å; I972-F1003 PolarHBondContact O-N 2.93Å; I972-L1013 HydrophobicContact CB-CD2 4.38Å; I972-L1013 HydrophobicContact CD1-CD2 4.08Å
973	Q	72	Confident	61.5	Low	67 Å²	67	72.7 Å²	72.7	31%	0.313	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	132.1	174.7	-176	176.8	-2.3	0	0	109.6	Y906 Q907 I908 Q1002	Y906-Q973 PolarHBondContact O-N 3.17Å; Q907-Q973 CarbonylContact C-O 3.46Å; Q907-Q973 WeakPolarHBondContact CA-O 3.35Å; Q907-Q973 HydrophobicContact CG-CB 4.28Å; I908-Q973 PolarHBondContact N-O 3.14Å; Q973-Q1002 HydrophobicContact CG-CG 4.45Å
974	F	76.2	Confident	64.1	Low	43 Å²	43	63.8 Å²	63.8	19%	0.189	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	124.7	176.5	-175.5	-112.8	0	0	0	109.1	I908 L910 F999 I1000 A1001 F1003	I908-F974 HydrophobicContact CB-CD2 4.02Å; I908-F974 HydrophobicContact CB-CE2 4.49Å; I908-F974 HydrophobicContact CG2-CD2 3.83Å; I908-F974 HydrophobicContact CG2-CE2 3.93Å; I908-F974 CarbonylContact O-C 3.57Å; I908-F974 VanDerWaalsContact O-CA 3.28Å; I908-F974 WeakPolarHBondContact O-CA 3.33Å; I908-F974 WeakPolarHBondContact O-CD2 3.37Å; L910-F974 HydrophobicContact CB-CE2 4.42Å; L910-F974 HydrophobicContact CB-CZ 4.24Å; F974-F999 HydrophobicContact CD1-CD2 4.18Å; F974-F999 AromaticContact CD1-CE2 3.77Å; F974-F999 HydrophobicContact CD1-CE2 3.97Å; F974-F999 AromaticContact CE1-CD2 3.88Å; F974-F999 HydrophobicContact CE1-CD2 3.88Å; F974-F999 AromaticContact CE1-CE2 3.27Å; F974-F999 HydrophobicContact CE1-CE2 3.27Å; F974-F999 AromaticContact CE1-CZ 3.87Å; F974-F999 HydrophobicContact CE1-CZ 4Å; F974-F999 AromaticContact CZ-CE2 3.82Å; F974-F999 HydrophobicContact CZ-CE2 3.82Å; F974-F999 HydrophobicContact CZ-CZ 4.34Å; F974-I1000 CarbonylContact O-C 3.5Å; F974-I1000 WeakPolarHBondContact O-CA 3.4Å; F974-A1001 HydrophobicContact CB-CB 4.35Å; F974-A1001 HydrophobicContact CD1-CB 4.43Å; F974-A1001 PolarHBondContact N-O 3.07Å; F974-A1001 PolarHBondContact O-N 2.88Å; F974-F1003 HydrophobicContact CB-CD2 4.19Å; F974-F1003 HydrophobicContact CB-CE2 3.79Å; F974-F1003 HydrophobicContact CD1-CE2 4.38Å; F974-F1003 HydrophobicContact CD2-CE2 4.33Å; F974-F1003 HydrophobicContact CG-CE2 4.28Å
975	D	80.2	Confident	66.4	Low	32.75 Å²	32.75	58 Å²	58	18%	0.175	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	115.3	176.4	-172.8	9.4	0	0	0	108.8	I908 S909 L910 R998 F999 I1000	I908-D975 PolarHBondContact O-N 3.35Å; I908-D975 VanDerWaalsContact O-N 3.13Å; S909-D975 CarbonylContact C-O 3.55Å; S909-D975 VanDerWaalsContact CA-O 3.22Å; S909-D975 WeakPolarHBondContact CA-O 3.39Å; S909-D975 VanDerWaalsContact CB-O 3.31Å; S909-D975 WeakPolarHBondContact CB-O 3.39Å; L910-D975 PolarHBondContact N-O 3.31Å; L910-D975 VanDerWaalsContact N-O 3.12Å; D975-R998 IonicContact OD1-CZ 3.51Å; D975-R998 IonicContact OD1-NE 3.34Å; D975-R998 PolarHBondContact OD1-NE 3.14Å; D975-R998 IonicContact OD1-NH2 2.96Å; D975-R998 PolarHBondContact OD1-NH2 3.36Å; D975-R998 IonicContact OD2-CZ 3.13Å; D975-R998 IonicContact OD2-NE 3.2Å; D975-R998 PolarHBondContact OD2-NE 2.88Å; D975-R998 IonicContact OD2-NH2 3.04Å; D975-R998 PolarHBondContact OD2-NH2 3.01Å; D975-F999 WeakPolarHBondContact CA-O 3.41Å; D975-I1000 WeakPolarHBondContact OD1-CG1 3.31Å
976	G	81.3	Confident	68.4	Low	0.25 Å²	0.25	52.8 Å²	52.8	0%	0.003	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	138.7	179.9	0	0	0	0	0	112.3	L910 R998 F999	L910-G976 CarbonylContact O-C 3.57Å; L910-G976 VanDerWaalsContact O-CA 3.24Å; L910-G976 WeakPolarHBondContact O-CA 3.41Å; G976-R998 CarbonylContact O-C 3.56Å; G976-R998 VanDerWaalsContact O-CA 3.25Å; G976-R998 WeakPolarHBondContact O-CA 3.29Å; G976-R998 WeakPolarHBondContact O-CG 3.36Å; G976-F999 VanDerWaalsContact CA-CE1 3.46Å; G976-F999 VanDerWaalsContact CA-CE2 3.45Å; G976-F999 VanDerWaalsContact CA-CZ 3.45Å; G976-F999 PolarHBondContact N-O 3.03Å; G976-F999 VanDerWaalsContact O-CD1 3.24Å; G976-F999 WeakPolarHBondContact O-CD1 3.38Å; G976-F999 PolarHBondContact O-N 3.09Å
977	F	82.8	Confident	69.9	Low	62 Å²	62	49.5 Å²	49.5	27%	0.272	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	120.1	-175.6	-167.5	-114.8	0	0	0	110.1	L910 K911 F912 E979 Q997 R998	L910-F977 PolarHBondContact O-N 3.01Å; K911-F977 CarbonylContact C-O 3.53Å; K911-F977 VanDerWaalsContact CA-O 3.28Å; K911-F977 WeakPolarHBondContact CA-O 3.35Å; K911-F977 HydrophobicContact CD-CD1 4.28Å; K911-F977 HydrophobicContact CG-CB 4.47Å; K911-F977 HydrophobicContact CG-CD1 4.32Å; F912-F977 PolarHBondContact N-O 3.17Å; F977-E979 HydrophobicContact CD1-CG 3.95Å; F977-E979 HydrophobicContact CE1-CG 3.43Å; F977-E979 VanDerWaalsContact CE1-CG 3.5Å; F977-E979 VanDerWaalsContact CE1-OE1 3.29Å; F977-E979 WeakPolarHBondContact CE1-OE1 3.35Å; F977-E979 HydrophobicContact CZ-CG 4.12Å; F977-Q997 WeakPolarHBondContact CA-O 3.44Å; F977-R998 HydrophobicContact CD2-CB 3.9Å; F977-R998 HydrophobicContact CD2-CG 4.11Å; F977-R998 HydrophobicContact CE2-CB 4.23Å
978	L	81	Confident	71	Confident	12 Å²	12	44.5 Å²	44.5	6%	0.063	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	124.2	177.1	-67.3	124.8	0	0	0	108.1	L910 F912 L915 I981 S996 Q997 F999 L1104	L910-L978 HydrophobicContact CD2-CD1 4.27Å; L910-L978 HydrophobicContact CD2-CD2 4.35Å; F912-L978 HydrophobicContact CB-CB 4.48Å; F912-L978 HydrophobicContact CB-CD2 3.82Å; F912-L978 HydrophobicContact CB-CG 4.28Å; F912-L978 HydrophobicContact CD2-CD1 3.74Å; F912-L978 HydrophobicContact CD2-CD2 3.3Å; F912-L978 VanDerWaalsContact CD2-CD2 3.47Å; F912-L978 HydrophobicContact CD2-CG 3.88Å; F912-L978 HydrophobicContact CE2-CD2 4Å; F912-L978 HydrophobicContact CG-CD2 3.77Å; F912-L978 HydrophobicContact CG-CG 4.48Å; L915-L978 HydrophobicContact CB-CD2 4.5Å; L915-L978 HydrophobicContact CD1-CD2 3.96Å; L915-L978 HydrophobicContact CD2-CD2 3.89Å; L978-I981 HydrophobicContact CB-CD1 3.71Å; L978-I981 HydrophobicContact CB-CG1 3.99Å; L978-I981 HydrophobicContact CD1-CD1 4.14Å; L978-I981 HydrophobicContact CD2-CD1 4.16Å; L978-I981 HydrophobicContact CD2-CG1 4.3Å; L978-I981 HydrophobicContact CG-CD1 4.38Å; L978-S996 CarbonylContact O-C 3.53Å; L978-S996 WeakPolarHBondContact O-CA 3.3Å; L978-S996 WeakPolarHBondContact O-CB 3.49Å; L978-Q997 HydrophobicContact CB-CB 4.35Å; L978-Q997 HydrophobicContact CD1-CB 4.31Å; L978-Q997 HydrophobicContact CD1-CG 4.35Å; L978-Q997 PolarHBondContact N-O 2.95Å; L978-Q997 PolarHBondContact O-N 3.08Å; L978-F999 HydrophobicContact CD1-CD1 4.24Å; L978-F999 HydrophobicContact CD1-CE1 3.6Å; L978-F999 VanDerWaalsContact CD1-CE1 3.42Å; L978-F999 HydrophobicContact CD1-CZ 4.1Å; L978-F999 HydrophobicContact CG-CE1 4.23Å; L978-L1104 HydrophobicContact CD2-CD2 4.44Å
979	E	82.6	Confident	72.3	Confident	50.75 Å²	50.75	41.5 Å²	41.5	24%	0.237	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	152.6	169.4	-64.1	167.4	165	0	0	109.6	K911 F912 T913 T914 F977 I981 D995	K911-E979 VanDerWaalsContact CE-OE1 3.23Å; K911-E979 WeakPolarHBondContact CE-OE1 3.42Å; K911-E979 WeakPolarHBondContact CE-OE2 3.43Å; K911-E979 IonicContact NZ-OE1 3.17Å; K911-E979 PolarHBondContact NZ-OE1 3.29Å; K911-E979 IonicContact NZ-OE2 3.03Å; K911-E979 PolarHBondContact NZ-OE2 2.91Å; F912-E979 PolarHBondContact O-N 2.97Å; T913-E979 CarbonylContact C-O 3.49Å; T913-E979 CarbonylContact O-C 3.52Å; T913-E979 WeakPolarHBondContact O-CB 3.38Å; T914-E979 WeakPolarHBondContact CA-O 3.33Å; T914-E979 PolarHBondContact N-O 3.42Å; F977-E979 HydrophobicContact CD1-CG 3.95Å; F977-E979 HydrophobicContact CE1-CG 3.43Å; F977-E979 VanDerWaalsContact CE1-CG 3.5Å; F977-E979 VanDerWaalsContact CE1-OE1 3.29Å; F977-E979 WeakPolarHBondContact CE1-OE1 3.35Å; F977-E979 HydrophobicContact CZ-CG 4.12Å; E979-I981 PolarHBondContact O-N 3.03Å; E979-D995 CarbonylContact C-O 3.54Å; E979-D995 WeakPolarHBondContact CA-O 3.36Å
980	N	81.1	Confident	73.8	Confident	48 Å²	48	34.9 Å²	34.9	26%	0.257	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	52.4	57.1	168.7	-75.9	-47.4	0	0	0	114.2	T913 T914 L915 N982 R993 D995	T913-N980 VanDerWaalsContact O-CB 3.29Å; T913-N980 WeakPolarHBondContact O-CB 3.27Å; T913-N980 PolarHBondContact O-ND2 3.15Å; T913-N980 VanDerWaalsContact O-ND2 3.08Å; T914-N980 HydrophobicContact CG2-CB 4.02Å; T914-N980 WeakPolarHBondContact CG2-ND2 3.35Å; T914-N980 PolarHBondContact OG1-ND2 3.21Å; L915-N980 PolarHBondContact N-O 3.13Å; L915-N980 VanDerWaalsContact N-O 3.11Å; N980-N982 PolarHBondContact O-ND2 3.02Å; N980-R993 PolarHBondContact OD1-NH1 2.89Å; N980-R993 PolarHBondContact OD1-NH2 2.88Å; N980-D995 PolarHBondContact N-O 2.83Å
981	I	81	Confident	75.1	Confident	3.75 Å²	3.75	30.7 Å²	30.7	2%	0.019	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	127.6	176.1	-50.2	170.5	0	0	0	109.5	L915 L978 E979 I983 R993 I994 Q997	L915-I981 HydrophobicContact CB-CG1 4.4Å; L915-I981 HydrophobicContact CB-CG2 4.38Å; L915-I981 HydrophobicContact CD2-CG1 4.42Å; L915-I981 HydrophobicContact CD2-CG2 3.95Å; L915-I981 HydrophobicContact CG-CG2 4.25Å; L915-I981 CarbonylContact O-C 3.54Å; L915-I981 VanDerWaalsContact O-CA 3.29Å; L915-I981 WeakPolarHBondContact O-CA 3.36Å; L978-I981 HydrophobicContact CB-CD1 3.71Å; L978-I981 HydrophobicContact CB-CG1 3.99Å; L978-I981 HydrophobicContact CD1-CD1 4.14Å; L978-I981 HydrophobicContact CD2-CD1 4.16Å; L978-I981 HydrophobicContact CD2-CG1 4.3Å; L978-I981 HydrophobicContact CG-CD1 4.38Å; E979-I981 PolarHBondContact O-N 3.03Å; I981-I983 HydrophobicContact CG2-CD1 4.38Å; I981-I983 HydrophobicContact CG2-CG1 4.05Å; I981-R993 CarbonylContact O-C 3.55Å; I981-R993 WeakPolarHBondContact O-CA 3.41Å; I981-I994 HydrophobicContact CB-CB 4.13Å; I981-I994 HydrophobicContact CD1-CB 4.37Å; I981-I994 HydrophobicContact CD1-CD1 4.37Å; I981-I994 HydrophobicContact CD1-CG2 4.41Å; I981-I994 PolarHBondContact N-O 2.87Å; I981-I994 PolarHBondContact O-N 3.02Å; I981-Q997 HydrophobicContact CD1-CB 3.94Å
982	N	82.3	Confident	76	Confident	1.75 Å²	1.75	30.7 Å²	30.7	1%	0.009	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	120.2	173	-51.9	-65.1	0	0	0	108.9	L915 Q916 I917 N980 F984 M991 L992 R993 I1065	L915-N982 PolarHBondContact O-N 3.18Å; Q916-N982 CarbonylContact C-O 3.56Å; Q916-N982 VanDerWaalsContact CA-O 3.28Å; Q916-N982 WeakPolarHBondContact CA-O 3.24Å; Q916-N982 HydrophobicContact CG-CB 4.38Å; I917-N982 PolarHBondContact N-O 3.17Å; N980-N982 PolarHBondContact O-ND2 3.02Å; N982-F984 HydrophobicContact CB-CD2 4.41Å; N982-F984 HydrophobicContact CB-CE2 3.67Å; N982-F984 HydrophobicContact CB-CZ 3.99Å; N982-M991 HydrophobicContact CB-CE 3.97Å; N982-M991 WeakPolarHBondContact OD1-CE 3.28Å; N982-L992 CarbonylContact C-O 3.56Å; N982-L992 WeakPolarHBondContact CA-O 3.4Å; N982-R993 PolarHBondContact ND2-NH1 3.1Å; N982-R993 WeakPolarHBondContact OD1-CD 3.4Å; N982-R993 PolarHBondContact OD1-NH1 3.17Å; N982-I1065 VanDerWaalsContact ND2-CD1 3.3Å; N982-I1065 WeakPolarHBondContact ND2-CD1 3.38Å; N982-I1065 WeakPolarHBondContact ND2-CG1 3.47Å; N982-I1065 VanDerWaalsContact ND2-CG2 3.3Å; N982-I1065 WeakPolarHBondContact ND2-CG2 3.36Å; N982-I1065 WeakPolarHBondContact OD1-CG2 3.37Å
983	I	82.2	Confident	76.8	Confident	37.5 Å²	37.5	29.9 Å²	29.9	19%	0.192	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	114	173.9	-51	-177.5	0	0	0	108.2	I917 I981 L985 M991 L992	I917-I983 HydrophobicContact CB-CG1 4.44Å; I917-I983 HydrophobicContact CB-CG2 4.4Å; I917-I983 HydrophobicContact CG2-CG2 4.35Å; I917-I983 CarbonylContact O-C 3.54Å; I917-I983 WeakPolarHBondContact O-CA 3.36Å; I981-I983 HydrophobicContact CG2-CD1 4.38Å; I981-I983 HydrophobicContact CG2-CG1 4.05Å; I983-L985 HydrophobicContact CG2-CD2 4.01Å; I983-L985 HydrophobicContact CG2-CG 4.37Å; I983-M991 CarbonylContact O-C 3.57Å; I983-M991 VanDerWaalsContact O-CA 3.31Å; I983-M991 WeakPolarHBondContact O-CA 3.32Å; I983-L992 HydrophobicContact CB-CB 4.28Å; I983-L992 HydrophobicContact CD1-CD2 4.28Å; I983-L992 HydrophobicContact CG1-CD2 4.35Å; I983-L992 PolarHBondContact N-O 3.06Å; I983-L992 PolarHBondContact O-N 2.97Å
984	F	79.6	Confident	77.2	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	126.5	179.6	-61.3	-82.4	0	0	0	110.1	H888 W890 I917 E918 W919 N982 F989 I990 M991 Y1063 I1065	H888-F984 HydrophobicContact CB-CD2 4.43Å; H888-F984 HydrophobicContact CB-CE1 4.42Å; H888-F984 HydrophobicContact CB-CE2 3.66Å; H888-F984 HydrophobicContact CB-CZ 3.67Å; H888-F984 AromaticContact CD2-CD1 3.97Å; H888-F984 AromaticContact CD2-CD2 3.57Å; H888-F984 VanDerWaalsContact CD2-CD2 3.42Å; H888-F984 WeakPolarHBondContact CD2-CD2 3.36Å; H888-F984 AromaticContact CD2-CE2 3.65Å; H888-F984 VanDerWaalsContact CD2-CE2 3.44Å; H888-F984 WeakPolarHBondContact CD2-CE2 3.46Å; H888-F984 AromaticContact CD2-CG 3.74Å; H888-F984 AromaticContact CD2-CZ 3.82Å; H888-F984 AromaticContact CE1-CD2 3.79Å; H888-F984 AromaticContact CE1-CE2 4Å; H888-F984 AromaticContact CG-CD2 3.71Å; H888-F984 AromaticContact CG-CE2 3.37Å; H888-F984 VanDerWaalsContact CG-CE2 3.45Å; H888-F984 AromaticContact CG-CZ 3.8Å; H888-F984 AromaticContact ND1-CD2 3.82Å; H888-F984 AromaticContact ND1-CE2 3.67Å; H888-F984 WeakPolarHBondContact ND1-CE2 3.3Å; H888-F984 AromaticContact NE2-CD2 3.61Å; H888-F984 WeakPolarHBondContact NE2-CD2 3.42Å; H888-F984 AromaticContact NE2-CE2 3.94Å; H888-F984 AromaticContact NE2-CG 3.82Å; W890-F984 HydrophobicContact CH2-CD1 4.34Å; W890-F984 HydrophobicContact CZ3-CB 4.29Å; W890-F984 HydrophobicContact CZ3-CD1 4.46Å; I917-F984 PolarHBondContact O-N 3.25Å; E918-F984 CarbonylContact C-O 3.57Å; E918-F984 WeakPolarHBondContact CA-O 3.44Å; E918-F984 HydrophobicContact CG-CB 4.45Å; W919-F984 PolarHBondContact N-O 3.12Å; N982-F984 HydrophobicContact CB-CD2 4.41Å; N982-F984 HydrophobicContact CB-CE2 3.67Å; N982-F984 HydrophobicContact CB-CZ 3.99Å; F984-F989 HydrophobicContact CD1-CD2 4.32Å; F984-F989 AromaticContact CD1-CE2 3.89Å; F984-F989 HydrophobicContact CD1-CE2 3.99Å; F984-F989 HydrophobicContact CD1-CZ 4.26Å; F984-F989 HydrophobicContact CE1-CE2 4.36Å; F984-F989 HydrophobicContact CE1-CZ 4.29Å; F984-I990 CarbonylContact C-O 3.52Å; F984-M991 HydrophobicContact CD1-CB 4.09Å; F984-M991 HydrophobicContact CD1-CG 3.93Å; F984-M991 HydrophobicContact CD1-SD 4.39Å; F984-M991 HydrophobicContact CE1-CB 4.19Å; F984-M991 HydrophobicContact CE1-CE 4.1Å; F984-M991 HydrophobicContact CE1-CG 3.66Å; F984-M991 HydrophobicContact CE1-SD 3.77Å; F984-M991 VanDerWaalsContact CE1-SD 3.58Å; F984-M991 HydrophobicContact CZ-CE 4.14Å; F984-M991 HydrophobicContact CZ-CG 4.24Å; F984-M991 HydrophobicContact CZ-SD 4.11Å; F984-Y1063 AromaticContact CE1-CD1 3.8Å; F984-Y1063 HydrophobicContact CE1-CD1 3.8Å; F984-Y1063 HydrophobicContact CE1-CE1 4.15Å; F984-Y1063 HydrophobicContact CE1-CG 4.41Å; F984-Y1063 HydrophobicContact CZ-CD1 4.14Å; F984-Y1063 HydrophobicContact CZ-CE1 4.49Å; F984-I1065 HydrophobicContact CZ-CD1 4.45Å; F984-I1065 HydrophobicContact CZ-CG1 4.39Å
985	L	74.2	Confident	77.6	Confident	35.25 Å²	35.25	27 Å²	27	19%	0.185	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	113.4	-179.3	-47.9	162.8	0	0	0	110.5	W919 I983 T988 F989 I990 L1138	W919-L985 HydrophobicContact CB-CD2 4.3Å; W919-L985 WeakPolarHBondContact O-CA 3.38Å; W919-L985 WeakPolarHBondContact O-CB 3.44Å; W919-L985 WeakPolarHBondContact O-CD2 3.23Å; I983-L985 HydrophobicContact CG2-CD2 4.01Å; I983-L985 HydrophobicContact CG2-CG 4.37Å; L985-T988 CarbonylContact O-C 3.51Å; L985-T988 VanDerWaalsContact O-O 3.1Å; L985-F989 VanDerWaalsContact O-CA 3.29Å; L985-F989 WeakPolarHBondContact O-CA 3.31Å; L985-I990 HydrophobicContact CB-CB 4.25Å; L985-I990 HydrophobicContact CD1-CB 4Å; L985-I990 HydrophobicContact CD1-CG2 4Å; L985-I990 HydrophobicContact CG-CB 4.35Å; L985-I990 HydrophobicContact CG-CG2 4.42Å; L985-I990 PolarHBondContact N-O 3.02Å; L985-I990 PolarHBondContact O-N 2.98Å; L985-I990 VanDerWaalsContact O-N 3.11Å; L985-L1138 HydrophobicContact CB-CD1 3.8Å; L985-L1138 VanDerWaalsContact CB-CD1 3.46Å; L985-L1138 HydrophobicContact CB-CD2 4.06Å; L985-L1138 HydrophobicContact CD1-CD1 3.76Å; L985-L1138 HydrophobicContact CD1-CD2 4.3Å; L985-L1138 HydrophobicContact CD2-CD1 4.23Å; L985-L1138 HydrophobicContact CD2-CD2 4.41Å; L985-L1138 HydrophobicContact CG-CD1 4.14Å
986	I	66.2	Low	77.7	Confident	48.25 Å²	48.25	26.5 Å²	26.5	25%	0.247	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-16.4	-158.7	-69.7	-175.2	0	0	0	115.6	W890 E918 T988	W890-I986 HydrophobicContact CE3-CD1 3.58Å; W890-I986 VanDerWaalsContact CE3-CD1 3.45Å; W890-I986 HydrophobicContact CE3-CG1 4.22Å; W890-I986 HydrophobicContact CZ3-CD1 3.68Å; W890-I986 VanDerWaalsContact CZ3-CD1 3.49Å; W890-I986 HydrophobicContact CZ3-CG1 3.8Å; E918-I986 HydrophobicContact CG-CD1 3.34Å; E918-I986 HydrophobicContact CG-CG1 4.02Å; E918-I986 WeakPolarHBondContact OE1-CD1 3.33Å; E918-I986 WeakPolarHBondContact OE2-CD1 3.38Å; I986-T988 CarbonylContact O-C 3.53Å; I986-T988 VanDerWaalsContact O-CA 3.27Å; I986-T988 WeakPolarHBondContact O-CA 3.35Å; I986-T988 PolarHBondContact O-N 2.84Å
987	N	59.2	Low	77.7	Confident	82 Å²	82	28.1 Å²	28.1	44%	0.439	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-43.3	174.9	-86.2	-5.9	0	0	0	111.1	S1141	N987-S1141 WeakPolarHBondContact ND2-CB 3.49Å; N987-S1141 PolarHBondContact ND2-OG 3.14Å
988	T	59.7	Low	77.6	Confident	30.75 Å²	30.75	30.1 Å²	30.1	19%	0.189	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-135.5	135.8	146.8	41.3	0	0	0	0	106.7	L985 I986 I990 Y1030 C1134 P1624 W1625	L985-T988 CarbonylContact O-C 3.51Å; L985-T988 VanDerWaalsContact O-O 3.1Å; I986-T988 CarbonylContact O-C 3.53Å; I986-T988 VanDerWaalsContact O-CA 3.27Å; I986-T988 WeakPolarHBondContact O-CA 3.35Å; I986-T988 PolarHBondContact O-N 2.84Å; T988-I990 PolarHBondContact O-N 2.88Å; T988-I990 VanDerWaalsContact O-N 3.09Å; T988-Y1030 HydrophobicContact CG2-CE2 4.4Å; T988-C1134 WeakPolarHBondContact CB-SG 3.32Å; T988-C1134 PolarHBondContact O-SG 2.91Å; T988-C1134 VanDerWaalsContact O-SG 3.36Å; T988-C1134 VanDerWaalsContact OG1-CA 3.29Å; T988-C1134 WeakPolarHBondContact OG1-CA 3.38Å; T988-C1134 VanDerWaalsContact OG1-CB 3.26Å; T988-C1134 WeakPolarHBondContact OG1-CB 3.29Å; T988-C1134 PolarHBondContact OG1-SG 3.14Å; T988-P1624 VanDerWaalsContact CG2-CD 3.49Å; T988-P1624 HydrophobicContact CG2-CG 3.12Å; T988-W1625 HydrophobicContact CG2-CZ2 4.27Å
989	F	69	Low	77.6	Confident	6.75 Å²	6.75	31.5 Å²	31.5	3%	0.03	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	113.7	-169.1	162	-84.4	0	0	0	112.9	W890 F984 L985 M991 V1029 Y1030 S1031 I1033 Y1063	W890-F989 HydrophobicContact CH2-CB 3.84Å; W890-F989 AromaticContact CH2-CD1 3.66Å; W890-F989 HydrophobicContact CH2-CD1 3.66Å; W890-F989 AromaticContact CH2-CD2 3.52Å; W890-F989 HydrophobicContact CH2-CD2 3.69Å; W890-F989 HydrophobicContact CH2-CE1 4.18Å; W890-F989 AromaticContact CH2-CE2 3.53Å; W890-F989 HydrophobicContact CH2-CE2 3.53Å; W890-F989 AromaticContact CH2-CG 3.66Å; W890-F989 HydrophobicContact CH2-CG 3.66Å; W890-F989 HydrophobicContact CZ2-CD1 4.07Å; W890-F989 AromaticContact CZ2-CD2 3.67Å; W890-F989 HydrophobicContact CZ2-CD2 4Å; W890-F989 HydrophobicContact CZ2-CE1 4.23Å; W890-F989 AromaticContact CZ2-CE2 3.73Å; W890-F989 HydrophobicContact CZ2-CE2 3.87Å; W890-F989 HydrophobicContact CZ2-CG 4.48Å; W890-F989 HydrophobicContact CZ3-CB 4.22Å; W890-F989 HydrophobicContact CZ3-CD2 4.43Å; W890-F989 HydrophobicContact CZ3-CG 4.49Å; F984-F989 HydrophobicContact CD1-CD2 4.32Å; F984-F989 AromaticContact CD1-CE2 3.89Å; F984-F989 HydrophobicContact CD1-CE2 3.99Å; F984-F989 HydrophobicContact CD1-CZ 4.26Å; F984-F989 HydrophobicContact CE1-CE2 4.36Å; F984-F989 HydrophobicContact CE1-CZ 4.29Å; L985-F989 VanDerWaalsContact O-CA 3.29Å; L985-F989 WeakPolarHBondContact O-CA 3.31Å; F989-M991 HydrophobicContact CD2-CB 4.19Å; F989-M991 HydrophobicContact CE1-CB 3.82Å; F989-M991 HydrophobicContact CE2-CB 4.25Å; F989-M991 HydrophobicContact CZ-CB 3.83Å; F989-M991 HydrophobicContact CZ-SD 4.39Å; F989-V1029 HydrophobicContact CE1-CG1 4.3Å; F989-Y1030 WeakPolarHBondContact O-CA 3.47Å; F989-Y1030 WeakPolarHBondContact O-CD2 3.45Å; F989-S1031 WeakPolarHBondContact CB-O 3.22Å; F989-S1031 WeakPolarHBondContact CD1-OG 3.45Å; F989-S1031 WeakPolarHBondContact CE1-OG 3.43Å; F989-S1031 WeakPolarHBondContact CG-OG 3.27Å; F989-S1031 VanDerWaalsContact CZ-CB 3.47Å; F989-S1031 PolarHBondContact N-O 3.44Å; F989-S1031 VanDerWaalsContact N-O 3.08Å; F989-S1031 PolarHBondContact O-N 3.11Å; F989-S1031 VanDerWaalsContact O-N 3.09Å; F989-S1031 VanDerWaalsContact O-O 3.11Å; F989-I1033 HydrophobicContact CB-CD1 3.97Å; F989-I1033 HydrophobicContact CB-CG1 4.04Å; F989-I1033 HydrophobicContact CD1-CG1 3.9Å; F989-I1033 HydrophobicContact CD2-CD1 3.81Å; F989-I1033 HydrophobicContact CD2-CG1 4.37Å; F989-I1033 HydrophobicContact CG-CD1 4.04Å; F989-I1033 HydrophobicContact CG-CG1 4.21Å; F989-Y1063 HydrophobicContact CE1-CE2 4.3Å; F989-Y1063 AromaticContact CE2-CD2 3.85Å; F989-Y1063 HydrophobicContact CE2-CD2 4.07Å; F989-Y1063 AromaticContact CE2-CE2 3.94Å; F989-Y1063 HydrophobicContact CE2-CE2 4.04Å; F989-Y1063 HydrophobicContact CE2-CG 4.33Å; F989-Y1063 HydrophobicContact CZ-CD1 4.48Å; F989-Y1063 AromaticContact CZ-CD2 3.86Å; F989-Y1063 HydrophobicContact CZ-CD2 3.86Å; F989-Y1063 HydrophobicContact CZ-CE1 4.25Å; F989-Y1063 AromaticContact CZ-CE2 3.5Å; F989-Y1063 HydrophobicContact CZ-CE2 3.5Å; F989-Y1063 VanDerWaalsContact CZ-CE2 3.49Å; F989-Y1063 HydrophobicContact CZ-CG 4.32Å; F989-Y1063 AromaticContact CZ-CZ 3.7Å
990	I	76.9	Confident	77.2	Confident	4.25 Å²	4.25	30.7 Å²	30.7	2%	0.022	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	126.6	160.5	-68.5	173.5	0	0	0	107.1	F984 L985 T988 L1028 V1029 Y1030 F1131 C1134 L1138	F984-I990 CarbonylContact C-O 3.52Å; L985-I990 HydrophobicContact CB-CB 4.25Å; L985-I990 HydrophobicContact CD1-CB 4Å; L985-I990 HydrophobicContact CD1-CG2 4Å; L985-I990 HydrophobicContact CG-CB 4.35Å; L985-I990 HydrophobicContact CG-CG2 4.42Å; L985-I990 PolarHBondContact N-O 3.02Å; L985-I990 PolarHBondContact O-N 2.98Å; L985-I990 VanDerWaalsContact O-N 3.11Å; T988-I990 PolarHBondContact O-N 2.88Å; T988-I990 VanDerWaalsContact O-N 3.09Å; I990-L1028 HydrophobicContact CG2-CD1 3.5Å; I990-L1028 VanDerWaalsContact CG2-CD1 3.44Å; I990-L1028 HydrophobicContact CG2-CD2 4.43Å; I990-L1028 HydrophobicContact CG2-CG 3.97Å; I990-V1029 CarbonylContact C-O 3.56Å; I990-V1029 VanDerWaalsContact CA-O 3.27Å; I990-V1029 WeakPolarHBondContact CA-O 3.41Å; I990-Y1030 HydrophobicContact CD1-CD2 4.33Å; I990-Y1030 HydrophobicContact CG1-CD2 3.89Å; I990-Y1030 HydrophobicContact CG1-CG 4.44Å; I990-F1131 HydrophobicContact CD1-CD2 4.02Å; I990-F1131 HydrophobicContact CD1-CE2 3.78Å; I990-F1131 HydrophobicContact CG1-CD2 4.48Å; I990-F1131 HydrophobicContact CG1-CE2 4.38Å; I990-C1134 HydrophobicContact CD1-CB 4.11Å; I990-C1134 WeakPolarHBondContact CD1-SG 3.4Å; I990-C1134 VanDerWaalsContact CG1-SG 3.57Å; I990-C1134 WeakPolarHBondContact CG1-SG 3.5Å; I990-L1138 HydrophobicContact CD1-CD1 4.15Å
991	M	80.8	Confident	76.8	Confident	1.75 Å²	1.75	28.7 Å²	28.7	1%	0.009	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	122.8	170.8	-179.3	-165.7	110.3	0	0	109.1	N982 I983 F984 F989 R993 L1028 V1029 Y1063 I1065 I1071	N982-M991 HydrophobicContact CB-CE 3.97Å; N982-M991 WeakPolarHBondContact OD1-CE 3.28Å; I983-M991 CarbonylContact O-C 3.57Å; I983-M991 VanDerWaalsContact O-CA 3.31Å; I983-M991 WeakPolarHBondContact O-CA 3.32Å; F984-M991 HydrophobicContact CD1-CB 4.09Å; F984-M991 HydrophobicContact CD1-CG 3.93Å; F984-M991 HydrophobicContact CD1-SD 4.39Å; F984-M991 HydrophobicContact CE1-CB 4.19Å; F984-M991 HydrophobicContact CE1-CE 4.1Å; F984-M991 HydrophobicContact CE1-CG 3.66Å; F984-M991 HydrophobicContact CE1-SD 3.77Å; F984-M991 VanDerWaalsContact CE1-SD 3.58Å; F984-M991 HydrophobicContact CZ-CE 4.14Å; F984-M991 HydrophobicContact CZ-CG 4.24Å; F984-M991 HydrophobicContact CZ-SD 4.11Å; F989-M991 HydrophobicContact CD2-CB 4.19Å; F989-M991 HydrophobicContact CE1-CB 3.82Å; F989-M991 HydrophobicContact CE2-CB 4.25Å; F989-M991 HydrophobicContact CZ-CB 3.83Å; F989-M991 HydrophobicContact CZ-SD 4.39Å; M991-R993 HydrophobicContact CE-CB 3.82Å; M991-R993 VanDerWaalsContact CE-CB 3.42Å; M991-R993 HydrophobicContact CE-CG 4.33Å; M991-R993 HydrophobicContact SD-CB 4.28Å; M991-L1028 CarbonylContact O-C 3.49Å; M991-L1028 WeakPolarHBondContact O-CA 3.29Å; M991-V1029 HydrophobicContact CB-CB 4.38Å; M991-V1029 HydrophobicContact CE-CB 4.12Å; M991-V1029 HydrophobicContact CE-CG2 3.71Å; M991-V1029 PolarHBondContact N-O 3.06Å; M991-V1029 PolarHBondContact O-N 3.03Å; M991-Y1063 HydrophobicContact CE-CE1 4.39Å; M991-Y1063 HydrophobicContact SD-CD1 4.27Å; M991-Y1063 HydrophobicContact SD-CE1 3.71Å; M991-Y1063 WeakPolarHBondContact SD-CE1 3.42Å; M991-I1065 HydrophobicContact CE-CG2 4.41Å; M991-I1071 HydrophobicContact CE-CD1 3.86Å
992	L	81.8	Confident	76.1	Confident	50.75 Å²	50.75	32 Å²	32	27%	0.266	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	113.6	163.1	178.2	69.4	0	0	0	108.6	N982 I983 I994 L1028	N982-L992 CarbonylContact C-O 3.56Å; N982-L992 WeakPolarHBondContact CA-O 3.4Å; I983-L992 HydrophobicContact CB-CB 4.28Å; I983-L992 HydrophobicContact CD1-CD2 4.28Å; I983-L992 HydrophobicContact CG1-CD2 4.35Å; I983-L992 PolarHBondContact N-O 3.06Å; I983-L992 PolarHBondContact O-N 2.97Å; L992-I994 HydrophobicContact CD1-CG1 4.37Å; L992-I994 HydrophobicContact CD2-CD1 4.16Å; L992-I994 HydrophobicContact CD2-CG1 4.47Å; L992-I994 HydrophobicContact CG-CD1 4.39Å; L992-I994 HydrophobicContact CG-CG1 4.27Å; L992-L1028 HydrophobicContact CB-CD1 3.94Å; L992-L1028 HydrophobicContact CD1-CD1 3.97Å; L992-L1028 HydrophobicContact CG-CD1 4.41Å
993	R	82.8	Confident	75.1	Confident	8.5 Å²	8.5	33.8 Å²	33.8	3%	0.032	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	130.8	172.5	171.8	62.7	-170	-172.7	-0.2	109.3	N980 I981 N982 M991 D995 A1026 K1027 I1071	N980-R993 PolarHBondContact OD1-NH1 2.89Å; N980-R993 PolarHBondContact OD1-NH2 2.88Å; I981-R993 CarbonylContact O-C 3.55Å; I981-R993 WeakPolarHBondContact O-CA 3.41Å; N982-R993 PolarHBondContact ND2-NH1 3.1Å; N982-R993 WeakPolarHBondContact OD1-CD 3.4Å; N982-R993 PolarHBondContact OD1-NH1 3.17Å; M991-R993 HydrophobicContact CE-CB 3.82Å; M991-R993 VanDerWaalsContact CE-CB 3.42Å; M991-R993 HydrophobicContact CE-CG 4.33Å; M991-R993 HydrophobicContact SD-CB 4.28Å; R993-D995 IonicContact CZ-OD1 2.97Å; R993-D995 VanDerWaalsContact CZ-OD1 3.27Å; R993-D995 IonicContact NE-OD1 3.08Å; R993-D995 PolarHBondContact NE-OD1 2.99Å; R993-D995 VanDerWaalsContact NE-OD1 3.13Å; R993-D995 IonicContact NH2-OD1 3.49Å; R993-D995 PolarHBondContact NH2-OD1 3.08Å; R993-A1026 CarbonylContact O-C 3.52Å; R993-A1026 VanDerWaalsContact O-CA 3.25Å; R993-A1026 WeakPolarHBondContact O-CA 3.33Å; R993-K1027 HydrophobicContact CB-CB 4.33Å; R993-K1027 WeakPolarHBondContact CB-O 3.49Å; R993-K1027 PolarHBondContact N-O 2.97Å; R993-K1027 PolarHBondContact O-N 2.93Å; R993-K1027 VanDerWaalsContact O-O 3.06Å; R993-I1071 HydrophobicContact CB-CD1 4.33Å; R993-I1071 HydrophobicContact CG-CD1 4.24Å
994	I	81.3	Confident	73.7	Confident	12.75 Å²	12.75	37.6 Å²	37.6	7%	0.065	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	125.2	169.2	-56.3	169	0	0	0	107.7	I981 L992 S996 Q997 I1023 G1025 A1026	I981-I994 HydrophobicContact CB-CB 4.13Å; I981-I994 HydrophobicContact CD1-CB 4.37Å; I981-I994 HydrophobicContact CD1-CD1 4.37Å; I981-I994 HydrophobicContact CD1-CG2 4.41Å; I981-I994 PolarHBondContact N-O 2.87Å; I981-I994 PolarHBondContact O-N 3.02Å; L992-I994 HydrophobicContact CD1-CG1 4.37Å; L992-I994 HydrophobicContact CD2-CD1 4.16Å; L992-I994 HydrophobicContact CD2-CG1 4.47Å; L992-I994 HydrophobicContact CG-CD1 4.39Å; L992-I994 HydrophobicContact CG-CG1 4.27Å; I994-S996 VanDerWaalsContact CG2-O 3.26Å; I994-S996 WeakPolarHBondContact CG2-O 3.4Å; I994-Q997 HydrophobicContact CG2-CB 4.48Å; I994-I1023 HydrophobicContact CD1-CG2 4.28Å; I994-I1023 HydrophobicContact CG1-CG2 4.33Å; I994-I1023 HydrophobicContact CG2-CG2 3.64Å; I994-G1025 WeakPolarHBondContact CA-O 3.35Å; I994-A1026 HydrophobicContact CG1-CB 4.19Å
995	D	82.6	Confident	72.3	Confident	37 Å²	37	39.3 Å²	39.3	20%	0.198	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	-43	179.8	-67.9	-31.5	0	0	0	112.2	E979 N980 R993 T1024 G1025 S1068	E979-D995 CarbonylContact C-O 3.54Å; E979-D995 WeakPolarHBondContact CA-O 3.36Å; N980-D995 PolarHBondContact N-O 2.83Å; R993-D995 IonicContact CZ-OD1 2.97Å; R993-D995 VanDerWaalsContact CZ-OD1 3.27Å; R993-D995 IonicContact NE-OD1 3.08Å; R993-D995 PolarHBondContact NE-OD1 2.99Å; R993-D995 VanDerWaalsContact NE-OD1 3.13Å; R993-D995 IonicContact NH2-OD1 3.49Å; R993-D995 PolarHBondContact NH2-OD1 3.08Å; D995-T1024 PolarHBondContact N-O 3.04Å; D995-T1024 VanDerWaalsContact N-O 3.14Å; D995-G1025 PolarHBondContact N-O 3.02Å; D995-G1025 VanDerWaalsContact N-O 3.12Å; D995-S1068 WeakPolarHBondContact OD1-CB 3.34Å; D995-S1068 PolarHBondContact OD1-N 3.01Å; D995-S1068 VanDerWaalsContact OD1-N 3.16Å; D995-S1068 WeakPolarHBondContact OD2-CB 3.36Å; D995-S1068 PolarHBondContact OD2-OG 3.19Å
996	S	82.4	Confident	70.7	Confident	22.25 Å²	22.25	41.6 Å²	41.6	16%	0.156	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	150.7	166.6	74.6	0	0	0	0	114.5	L978 I994 T1024	L978-S996 CarbonylContact O-C 3.53Å; L978-S996 WeakPolarHBondContact O-CA 3.3Å; L978-S996 WeakPolarHBondContact O-CB 3.49Å; I994-S996 VanDerWaalsContact CG2-O 3.26Å; I994-S996 WeakPolarHBondContact CG2-O 3.4Å; S996-T1024 PolarHBondContact N-O 2.87Å; S996-T1024 VanDerWaalsContact N-O 3.16Å; S996-T1024 PolarHBondContact N-OG1 3Å; S996-T1024 PolarHBondContact O-N 3.07Å; S996-T1024 PolarHBondContact O-OG1 3.11Å; S996-T1024 PolarHBondContact OG-OG1 3.15Å
997	Q	82.9	Confident	69.3	Low	34 Å²	34	44.6 Å²	44.6	16%	0.159	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	124.2	171.9	175.4	178.9	1.1	0	0	109.4	F977 L978 I981 I994 I1021 T1022 I1023	F977-Q997 WeakPolarHBondContact CA-O 3.44Å; L978-Q997 HydrophobicContact CB-CB 4.35Å; L978-Q997 HydrophobicContact CD1-CB 4.31Å; L978-Q997 HydrophobicContact CD1-CG 4.35Å; L978-Q997 PolarHBondContact N-O 2.95Å; L978-Q997 PolarHBondContact O-N 3.08Å; I981-Q997 HydrophobicContact CD1-CB 3.94Å; I994-Q997 HydrophobicContact CG2-CB 4.48Å; Q997-I1021 HydrophobicContact CG-CG2 4.25Å; Q997-T1022 CarbonylContact C-O 3.52Å; Q997-T1022 VanDerWaalsContact CA-O 3.27Å; Q997-T1022 WeakPolarHBondContact CA-O 3.38Å; Q997-I1023 HydrophobicContact CB-CG1 4.46Å; Q997-I1023 HydrophobicContact CG-CG1 4.09Å
998	R	80.7	Confident	68.4	Low	103.25 Å²	103.25	44.5 Å²	44.5	39%	0.39	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	142	169.7	-165.6	179.2	-178.8	178.1	1.1	110.2	D975 G976 F977 I1000 I1021 T1022	D975-R998 IonicContact OD1-CZ 3.51Å; D975-R998 IonicContact OD1-NE 3.34Å; D975-R998 PolarHBondContact OD1-NE 3.14Å; D975-R998 IonicContact OD1-NH2 2.96Å; D975-R998 PolarHBondContact OD1-NH2 3.36Å; D975-R998 IonicContact OD2-CZ 3.13Å; D975-R998 IonicContact OD2-NE 3.2Å; D975-R998 PolarHBondContact OD2-NE 2.88Å; D975-R998 IonicContact OD2-NH2 3.04Å; D975-R998 PolarHBondContact OD2-NH2 3.01Å; G976-R998 CarbonylContact O-C 3.56Å; G976-R998 VanDerWaalsContact O-CA 3.25Å; G976-R998 WeakPolarHBondContact O-CA 3.29Å; G976-R998 WeakPolarHBondContact O-CG 3.36Å; F977-R998 HydrophobicContact CD2-CB 3.9Å; F977-R998 HydrophobicContact CD2-CG 4.11Å; F977-R998 HydrophobicContact CE2-CB 4.23Å; R998-I1000 HydrophobicContact CG-CG1 4.5Å; R998-I1021 CarbonylContact O-C 3.55Å; R998-I1021 WeakPolarHBondContact O-CA 3.42Å; R998-I1021 WeakPolarHBondContact O-CG2 3.41Å; R998-T1022 WeakPolarHBondContact CB-OG1 3.26Å; R998-T1022 PolarHBondContact N-O 3.14Å; R998-T1022 PolarHBondContact O-N 3.16Å
999	F	79.4	Confident	67.2	Low	41.75 Å²	41.75	48.6 Å²	48.6	18%	0.183	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	131.3	171.7	51.5	-92.4	0	0	0	110.2	L910 F974 D975 G976 L978 Q1020 I1021	L910-F999 HydrophobicContact CD2-CZ 4.09Å; F974-F999 HydrophobicContact CD1-CD2 4.18Å; F974-F999 AromaticContact CD1-CE2 3.77Å; F974-F999 HydrophobicContact CD1-CE2 3.97Å; F974-F999 AromaticContact CE1-CD2 3.88Å; F974-F999 HydrophobicContact CE1-CD2 3.88Å; F974-F999 AromaticContact CE1-CE2 3.27Å; F974-F999 HydrophobicContact CE1-CE2 3.27Å; F974-F999 AromaticContact CE1-CZ 3.87Å; F974-F999 HydrophobicContact CE1-CZ 4Å; F974-F999 AromaticContact CZ-CE2 3.82Å; F974-F999 HydrophobicContact CZ-CE2 3.82Å; F974-F999 HydrophobicContact CZ-CZ 4.34Å; D975-F999 WeakPolarHBondContact CA-O 3.41Å; G976-F999 VanDerWaalsContact CA-CE1 3.46Å; G976-F999 VanDerWaalsContact CA-CE2 3.45Å; G976-F999 VanDerWaalsContact CA-CZ 3.45Å; G976-F999 PolarHBondContact N-O 3.03Å; G976-F999 VanDerWaalsContact O-CD1 3.24Å; G976-F999 WeakPolarHBondContact O-CD1 3.38Å; G976-F999 PolarHBondContact O-N 3.09Å; L978-F999 HydrophobicContact CD1-CD1 4.24Å; L978-F999 HydrophobicContact CD1-CE1 3.6Å; L978-F999 VanDerWaalsContact CD1-CE1 3.42Å; L978-F999 HydrophobicContact CD1-CZ 4.1Å; L978-F999 HydrophobicContact CG-CE1 4.23Å; F999-Q1020 WeakPolarHBondContact CA-O 3.35Å; F999-I1021 HydrophobicContact CB-CG1 4.11Å; F999-I1021 HydrophobicContact CB-CG2 4.37Å
1000	I	75.1	Confident	65.8	Low	34.25 Å²	34.25	57.9 Å²	57.9	18%	0.176	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	130.8	176.7	-57.5	171.6	0	0	0	108.1	F974 D975 R998 S1019 Q1020	F974-I1000 CarbonylContact O-C 3.5Å; F974-I1000 WeakPolarHBondContact O-CA 3.4Å; D975-I1000 WeakPolarHBondContact OD1-CG1 3.31Å; R998-I1000 HydrophobicContact CG-CG1 4.5Å; I1000-S1019 WeakPolarHBondContact CB-O 3.44Å; I1000-S1019 WeakPolarHBondContact CB-OG 3.29Å; I1000-S1019 WeakPolarHBondContact CG2-OG 3.39Å; I1000-S1019 CarbonylContact O-C 3.55Å; I1000-S1019 WeakPolarHBondContact O-CA 3.48Å; I1000-S1019 PolarHBondContact O-N 2.93Å; I1000-S1019 PolarHBondContact O-OG 2.85Å; I1000-Q1020 PolarHBondContact N-O 3.2Å; I1000-Q1020 VanDerWaalsContact N-O 3.09Å; I1000-Q1020 PolarHBondContact O-N 2.73Å
1001	A	72.5	Confident	63.8	Low	6.8 Å²	6.8	62.7 Å²	62.7	6%	0.056	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	150.4	179.1	0	0	0	0	0	111	F974 F1003 L1015 S1017 L1018	F974-A1001 HydrophobicContact CB-CB 4.35Å; F974-A1001 HydrophobicContact CD1-CB 4.43Å; F974-A1001 PolarHBondContact N-O 3.07Å; F974-A1001 PolarHBondContact O-N 2.88Å; A1001-F1003 HydrophobicContact CB-CE2 3.96Å; A1001-F1003 HydrophobicContact CB-CZ 4.24Å; A1001-L1015 HydrophobicContact CB-CD1 3.96Å; A1001-S1017 CarbonylContact C-O 3.46Å; A1001-S1017 WeakPolarHBondContact CA-O 3.37Å; A1001-L1018 HydrophobicContact CB-CD1 4.02Å; A1001-L1018 HydrophobicContact CB-CG 4.29Å
1002	Q	66.8	Low	61.9	Low	73.4 Å²	73.4	65.1 Å²	65.1	34%	0.343	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	125.4	174.8	-65.2	-177.5	-5.3	0	0	110.3	I972 Q973 L1015 D1016 S1017	I972-Q1002 CarbonylContact O-C 3.6Å; I972-Q1002 WeakPolarHBondContact O-CA 3.35Å; Q973-Q1002 HydrophobicContact CG-CG 4.45Å; Q1002-L1015 WeakPolarHBondContact O-CD1 3.42Å; Q1002-D1016 PolarHBondContact O-N 3.05Å; Q1002-S1017 WeakPolarHBondContact CB-OG 3.46Å; Q1002-S1017 PolarHBondContact N-O 3.11Å; Q1002-S1017 PolarHBondContact O-N 2.86Å; Q1002-S1017 PolarHBondContact OE1-OG 2.79Å
1003	F	61	Low	60	Low	39.6 Å²	39.6	66.2 Å²	66.2	17%	0.174	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	136.8	-179.8	-58.9	-88.6	0	0	0	110.3	P971 I972 F974 A1001 L1013 K1014 L1015 F1096 L1099	P971-F1003 CarbonylContact C-O 3.57Å; P971-F1003 VanDerWaalsContact CA-O 3.28Å; P971-F1003 WeakPolarHBondContact CA-O 3.34Å; I972-F1003 HydrophobicContact CB-CB 4.46Å; I972-F1003 PolarHBondContact N-O 2.98Å; I972-F1003 PolarHBondContact O-N 2.93Å; F974-F1003 HydrophobicContact CB-CD2 4.19Å; F974-F1003 HydrophobicContact CB-CE2 3.79Å; F974-F1003 HydrophobicContact CD1-CE2 4.38Å; F974-F1003 HydrophobicContact CD2-CE2 4.33Å; F974-F1003 HydrophobicContact CG-CE2 4.28Å; A1001-F1003 HydrophobicContact CB-CE2 3.96Å; A1001-F1003 HydrophobicContact CB-CZ 4.24Å; F1003-L1013 HydrophobicContact CB-CB 4.12Å; F1003-L1013 HydrophobicContact CB-CD2 3.64Å; F1003-L1013 HydrophobicContact CB-CG 4.21Å; F1003-L1013 HydrophobicContact CD1-CB 4.27Å; F1003-L1013 HydrophobicContact CD1-CD2 4.47Å; F1003-L1013 HydrophobicContact CG-CB 4.29Å; F1003-L1013 HydrophobicContact CG-CD2 3.97Å; F1003-K1014 CarbonylContact C-O 3.54Å; F1003-K1014 VanDerWaalsContact CA-O 3.29Å; F1003-K1014 WeakPolarHBondContact CA-O 3.38Å; F1003-L1015 HydrophobicContact CD1-CB 4.22Å; F1003-L1015 HydrophobicContact CD1-CD1 3.87Å; F1003-L1015 HydrophobicContact CD2-CD1 4.34Å; F1003-L1015 HydrophobicContact CE1-CB 4.14Å; F1003-L1015 HydrophobicContact CE1-CD1 3.62Å; F1003-L1015 VanDerWaalsContact CE1-CD1 3.42Å; F1003-L1015 HydrophobicContact CE1-CG 4.32Å; F1003-L1015 HydrophobicContact CE2-CD1 4.35Å; F1003-L1015 HydrophobicContact CG-CD1 4.24Å; F1003-L1015 HydrophobicContact CZ-CD1 3.94Å; F1003-F1096 AromaticContact CD1-CE2 3.99Å; F1003-F1096 HydrophobicContact CD1-CE2 4.16Å; F1003-F1096 HydrophobicContact CD1-CZ 4.07Å; F1003-F1096 AromaticContact CE1-CE2 3.96Å; F1003-F1096 HydrophobicContact CE1-CE2 4Å; F1003-F1096 AromaticContact CE1-CZ 3.83Å; F1003-F1096 HydrophobicContact CE1-CZ 4.06Å; F1003-F1096 HydrophobicContact CZ-CE2 4.46Å; F1003-F1096 HydrophobicContact CZ-CZ 4.35Å; F1003-L1099 HydrophobicContact CE1-CD2 3.89Å; F1003-L1099 HydrophobicContact CZ-CD2 3.97Å
1004	R	53	Low	58.2	Low	116.6 Å²	116.6	68.5 Å²	68.5	44%	0.44	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	141.9	167.1	-91	-172.1	-179.4	146.4	-2.7	111.2	N969 P971 K1014 D1016	N969-R1004 PolarHBondContact O-NE 2.85Å; P971-R1004 HydrophobicContact CB-CG 3.99Å; R1004-K1014 PolarHBondContact N-O 2.92Å; R1004-K1014 PolarHBondContact O-N 3.07Å; R1004-D1016 HydrophobicContact CB-CB 4.41Å; R1004-D1016 WeakPolarHBondContact CB-OD2 3.36Å; R1004-D1016 VanDerWaalsContact CD-OD2 3.27Å; R1004-D1016 WeakPolarHBondContact CD-OD2 3.35Å; R1004-D1016 HydrophobicContact CG-CB 4.47Å; R1004-D1016 VanDerWaalsContact CG-OD2 3.29Å; R1004-D1016 WeakPolarHBondContact CG-OD2 3.4Å; R1004-D1016 IonicContact CZ-OD2 3.43Å; R1004-D1016 IonicContact NE-OD2 3.34Å; R1004-D1016 PolarHBondContact NE-OD2 2.87Å; R1004-D1016 IonicContact NH1-OD2 3.05Å; R1004-D1016 PolarHBondContact NH1-OD2 3.24Å
1005	S	49	Very low	56.6	Low	34.6 Å²	34.6	69.7 Å²	69.7	24%	0.242	34%	0.339	C	S	.	.			trans	-83.8	122.9	167.9	-178	0	0	0	0	109	N1007	S1005-N1007 PolarHBondContact O-N 3.39Å
1006	I	42	Very low	55	Low	85.2 Å²	85.2	70.1 Å²	70.1	44%	0.437	34%	0.341	S	S	.	.			trans	-111.4	114.6	168.6	-57.9	176.5	0	0	0	106.6	Q1011 K1014	I1006-Q1011 VanDerWaalsContact CB-OE1 3.28Å; I1006-Q1011 VanDerWaalsContact O-CB 3.24Å; I1006-Q1011 WeakPolarHBondContact O-CB 3.35Å; I1006-K1014 HydrophobicContact CD1-CB 4.31Å; I1006-K1014 HydrophobicContact CD1-CD 3.71Å; I1006-K1014 HydrophobicContact CD1-CG 4.44Å
1007	N	37.2	Very low	53.5	Low	111.2 Å²	111.2	71.1 Å²	71.1	60%	0.595	35%	0.348	S	S	*	.			trans	35	116.1	175	-92.1	-8.7	0	0	0	117.8	Y967 S1005 I1009 Y1010	Y967-N1007 WeakPolarHBondContact CB-OD1 3.47Å; Y967-N1007 WeakPolarHBondContact CD2-OD1 3.28Å; Y967-N1007 VanDerWaalsContact CG-OD1 3.26Å; S1005-N1007 PolarHBondContact O-N 3.39Å; N1007-I1009 VanDerWaalsContact C-N 3.27Å; N1007-I1009 PolarHBondContact O-N 3.31Å; N1007-Y1010 PolarHBondContact O-N 3.25Å
1008	P	38.8	Very low	52	Low	78.8 Å²	78.8	71.6 Å²	71.6	51%	0.512	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	31.7	-166.4	32.6	-36.7	0	0	0	115.7	F817 M964 Y967	F817-P1008 HydrophobicContact CD2-CB 4.3Å; M964-P1008 HydrophobicContact CE-CG 4.36Å; Y967-P1008 VanDerWaalsContact CB-CD 3.49Å; Y967-P1008 HydrophobicContact CD1-CG 3.19Å; Y967-P1008 HydrophobicContact CE1-CG 3.78Å; Y967-P1008 VanDerWaalsContact CG-CD 3.44Å; Y967-P1008 HydrophobicContact CG-CG 3.89Å
1009	I	35.8	Very low	51	Low	117 Å²	117	68.4 Å²	68.4	60%	0.6	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.4	50.1	174.8	-54	-177.7	0	0	0	110.6	Y967 N1007 Q1011	Y967-I1009 HydrophobicContact CE2-CD1 4.47Å; Y967-I1009 WeakPolarHBondContact OH-CD1 3.18Å; N1007-I1009 VanDerWaalsContact C-N 3.27Å; N1007-I1009 PolarHBondContact O-N 3.31Å; I1009-Q1011 VanDerWaalsContact C-N 3.35Å; I1009-Q1011 PolarHBondContact O-N 2.91Å
1010	Y	38.8	Very low	50.5	Low	201.4 Å²	201.4	70.5 Å²	70.5	79%	0.79	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.7	26.2	176.8	-64.5	-71.6	0	0	0	117.8	S633 N1007	S633-Y1010 WeakPolarHBondContact CB-O 3.17Å; S633-Y1010 PolarHBondContact OG-O 3.25Å; N1007-Y1010 PolarHBondContact O-N 3.25Å
1011	Q	34	Very low	50.3	Low	106.8 Å²	106.8	70.4 Å²	70.4	50%	0.499	36%	0.355	S	S	.	.			trans	-130.4	138.1	173.5	-92.7	172.8	0.1	0	0	112.6	I1006 I1009 R1093	I1006-Q1011 VanDerWaalsContact CB-OE1 3.28Å; I1006-Q1011 VanDerWaalsContact O-CB 3.24Å; I1006-Q1011 WeakPolarHBondContact O-CB 3.35Å; I1009-Q1011 VanDerWaalsContact C-N 3.35Å; I1009-Q1011 PolarHBondContact O-N 2.91Å; Q1011-R1093 VanDerWaalsContact OE1-CZ 3.23Å
1012	P	42.5	Very low	50.3	Low	51.8 Å²	51.8	71.5 Å²	71.5	34%	0.336	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-70.1	155	177.2	28.6	-33.2	0	0	0	111.7	Y630 K1014 L1094 F1096	Y630-P1012 HydrophobicContact CD2-CG 4.34Å; P1012-K1014 PolarHBondContact O-N 3.02Å; P1012-L1094 VanDerWaalsContact CB-O 3.25Å; P1012-L1094 WeakPolarHBondContact CB-O 3.43Å; P1012-L1094 HydrophobicContact CG-CB 4.21Å; P1012-L1094 WeakPolarHBondContact CG-O 3.29Å; P1012-F1096 HydrophobicContact CB-CB 3.72Å; P1012-F1096 HydrophobicContact CG-CB 4.2Å
1013	L	42.2	Very low	50.7	Low	74 Å²	74	69.5 Å²	69.5	39%	0.387	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-49.4	129.4	173.6	-82.3	130.5	0	0	0	110.9	I972 F1003 L1015 F1096	I972-L1013 HydrophobicContact CB-CD2 4.38Å; I972-L1013 HydrophobicContact CD1-CD2 4.08Å; F1003-L1013 HydrophobicContact CB-CB 4.12Å; F1003-L1013 HydrophobicContact CB-CD2 3.64Å; F1003-L1013 HydrophobicContact CB-CG 4.21Å; F1003-L1013 HydrophobicContact CD1-CB 4.27Å; F1003-L1013 HydrophobicContact CD1-CD2 4.47Å; F1003-L1013 HydrophobicContact CG-CB 4.29Å; F1003-L1013 HydrophobicContact CG-CD2 3.97Å; L1013-L1015 PolarHBondContact O-N 2.91Å; L1013-F1096 HydrophobicContact CB-CD2 4.07Å; L1013-F1096 HydrophobicContact CB-CE2 4.05Å; L1013-F1096 HydrophobicContact CD1-CD2 4.27Å; L1013-F1096 HydrophobicContact CD1-CE2 3.73Å; L1013-F1096 HydrophobicContact CD1-CZ 4.17Å; L1013-F1096 HydrophobicContact CG-CE2 4.43Å
1014	K	44.1	Very low	51.4	Low	56.2 Å²	56.2	69.4 Å²	69.4	24%	0.244	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	127.6	176.4	-166.4	179.5	173	-142.3	0	108.6	F1003 R1004 I1006 P1012 D1016 D1090 V1092	F1003-K1014 CarbonylContact C-O 3.54Å; F1003-K1014 VanDerWaalsContact CA-O 3.29Å; F1003-K1014 WeakPolarHBondContact CA-O 3.38Å; R1004-K1014 PolarHBondContact N-O 2.92Å; R1004-K1014 PolarHBondContact O-N 3.07Å; I1006-K1014 HydrophobicContact CD1-CB 4.31Å; I1006-K1014 HydrophobicContact CD1-CD 3.71Å; I1006-K1014 HydrophobicContact CD1-CG 4.44Å; P1012-K1014 PolarHBondContact O-N 3.02Å; K1014-D1016 WeakPolarHBondContact CD-OD1 3.39Å; K1014-D1016 WeakPolarHBondContact CE-OD1 3.18Å; K1014-D1016 VanDerWaalsContact CG-OD1 3.23Å; K1014-D1016 WeakPolarHBondContact CG-OD1 3.48Å; K1014-D1016 IonicContact NZ-OD1 3.03Å; K1014-D1016 PolarHBondContact NZ-OD1 2.91Å; K1014-D1016 PolarHBondContact O-N 3.07Å; K1014-D1090 WeakPolarHBondContact CE-O 3.33Å; K1014-D1090 PolarHBondContact NZ-O 3.16Å; K1014-D1090 VanDerWaalsContact NZ-O 3.1Å; K1014-D1090 IonicContact NZ-OD1 2.66Å; K1014-D1090 PolarHBondContact NZ-OD1 2.84Å; K1014-V1092 VanDerWaalsContact CE-O 3.22Å; K1014-V1092 WeakPolarHBondContact CE-O 3.22Å; K1014-V1092 WeakPolarHBondContact CG-O 3.31Å
1015	L	47.4	Very low	52.3	Low	36.8 Å²	36.8	64.5 Å²	64.5	19%	0.193	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	102.5	171.4	-177.6	71.3	0	0	0	107.5	A1001 Q1002 F1003 L1013 S1017 L1018 L1088 L1094	A1001-L1015 HydrophobicContact CB-CD1 3.96Å; Q1002-L1015 WeakPolarHBondContact O-CD1 3.42Å; F1003-L1015 HydrophobicContact CD1-CB 4.22Å; F1003-L1015 HydrophobicContact CD1-CD1 3.87Å; F1003-L1015 HydrophobicContact CD2-CD1 4.34Å; F1003-L1015 HydrophobicContact CE1-CB 4.14Å; F1003-L1015 HydrophobicContact CE1-CD1 3.62Å; F1003-L1015 VanDerWaalsContact CE1-CD1 3.42Å; F1003-L1015 HydrophobicContact CE1-CG 4.32Å; F1003-L1015 HydrophobicContact CE2-CD1 4.35Å; F1003-L1015 HydrophobicContact CG-CD1 4.24Å; F1003-L1015 HydrophobicContact CZ-CD1 3.94Å; L1013-L1015 PolarHBondContact O-N 2.91Å; L1015-S1017 VanDerWaalsContact C-N 3.27Å; L1015-S1017 WeakPolarHBondContact CD1-O 3.3Å; L1015-S1017 PolarHBondContact O-N 2.89Å; L1015-L1018 HydrophobicContact CD1-CB 4.23Å; L1015-L1018 HydrophobicContact CD1-CD1 4.12Å; L1015-L1018 HydrophobicContact CD2-CB 4.32Å; L1015-L1018 HydrophobicContact CD2-CD1 4.16Å; L1015-L1018 HydrophobicContact CG-CB 4.45Å; L1015-L1088 HydrophobicContact CB-CD2 4.17Å; L1015-L1088 HydrophobicContact CD2-CD1 3.66Å; L1015-L1088 VanDerWaalsContact CD2-CD1 3.48Å; L1015-L1088 HydrophobicContact CD2-CD2 3.94Å; L1015-L1088 HydrophobicContact CD2-CG 4.41Å; L1015-L1088 HydrophobicContact CG-CD1 4.04Å; L1015-L1088 HydrophobicContact CG-CD2 4.18Å; L1015-L1094 HydrophobicContact CB-CD1 4.31Å
1016	D	48.4	Very low	53.6	Low	46 Å²	46	63.3 Å²	63.3	25%	0.246	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	-33.2	-173.8	-93.8	3.9	0	0	0	111.8	Q1002 R1004 K1014	Q1002-D1016 PolarHBondContact O-N 3.05Å; R1004-D1016 HydrophobicContact CB-CB 4.41Å; R1004-D1016 WeakPolarHBondContact CB-OD2 3.36Å; R1004-D1016 VanDerWaalsContact CD-OD2 3.27Å; R1004-D1016 WeakPolarHBondContact CD-OD2 3.35Å; R1004-D1016 HydrophobicContact CG-CB 4.47Å; R1004-D1016 VanDerWaalsContact CG-OD2 3.29Å; R1004-D1016 WeakPolarHBondContact CG-OD2 3.4Å; R1004-D1016 IonicContact CZ-OD2 3.43Å; R1004-D1016 IonicContact NE-OD2 3.34Å; R1004-D1016 PolarHBondContact NE-OD2 2.87Å; R1004-D1016 IonicContact NH1-OD2 3.05Å; R1004-D1016 PolarHBondContact NH1-OD2 3.24Å; K1014-D1016 WeakPolarHBondContact CD-OD1 3.39Å; K1014-D1016 WeakPolarHBondContact CE-OD1 3.18Å; K1014-D1016 VanDerWaalsContact CG-OD1 3.23Å; K1014-D1016 WeakPolarHBondContact CG-OD1 3.48Å; K1014-D1016 IonicContact NZ-OD1 3.03Å; K1014-D1016 PolarHBondContact NZ-OD1 2.91Å; K1014-D1016 PolarHBondContact O-N 3.07Å
1017	S	52.7	Low	55.4	Low	43.4 Å²	43.4	60.7 Å²	60.7	30%	0.303	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	146.2	174.4	62	0	0	0	0	112.4	A1001 Q1002 L1015 S1019	A1001-S1017 CarbonylContact C-O 3.46Å; A1001-S1017 WeakPolarHBondContact CA-O 3.37Å; Q1002-S1017 WeakPolarHBondContact CB-OG 3.46Å; Q1002-S1017 PolarHBondContact N-O 3.11Å; Q1002-S1017 PolarHBondContact O-N 2.86Å; Q1002-S1017 PolarHBondContact OE1-OG 2.79Å; L1015-S1017 VanDerWaalsContact C-N 3.27Å; L1015-S1017 WeakPolarHBondContact CD1-O 3.3Å; L1015-S1017 PolarHBondContact O-N 2.89Å; S1017-S1019 PolarHBondContact O-N 2.75Å; S1017-S1019 VanDerWaalsContact O-N 3.12Å
1018	L	50.5	Low	57.4	Low	44.8 Å²	44.8	56.6 Å²	56.6	24%	0.235	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	99.1	166.4	-134.1	127.4	0	0	0	108.9	A1001 L1015 Q1020 I1021 D1085 V1086 K1087 L1088 L1110	A1001-L1018 HydrophobicContact CB-CD1 4.02Å; A1001-L1018 HydrophobicContact CB-CG 4.29Å; L1015-L1018 HydrophobicContact CD1-CB 4.23Å; L1015-L1018 HydrophobicContact CD1-CD1 4.12Å; L1015-L1018 HydrophobicContact CD2-CB 4.32Å; L1015-L1018 HydrophobicContact CD2-CD1 4.16Å; L1015-L1018 HydrophobicContact CG-CB 4.45Å; L1018-Q1020 HydrophobicContact CB-CG 4.4Å; L1018-Q1020 HydrophobicContact CD2-CG 4.32Å; L1018-Q1020 PolarHBondContact O-N 3.15Å; L1018-I1021 HydrophobicContact CD2-CD1 3.69Å; L1018-I1021 VanDerWaalsContact CD2-CD1 3.49Å; L1018-I1021 HydrophobicContact CD2-CG1 3.69Å; L1018-D1085 HydrophobicContact CD2-CB 3.69Å; L1018-V1086 HydrophobicContact CB-CB 4.27Å; L1018-V1086 HydrophobicContact CB-CG1 4.2Å; L1018-V1086 HydrophobicContact CD2-CB 3.96Å; L1018-V1086 HydrophobicContact CD2-CG1 3.98Å; L1018-V1086 HydrophobicContact CD2-CG2 3.81Å; L1018-V1086 HydrophobicContact CG-CB 4.4Å; L1018-V1086 PolarHBondContact N-O 2.81Å; L1018-V1086 CarbonylContact O-C 3.58Å; L1018-K1087 HydrophobicContact CD1-CG 4.25Å; L1018-K1087 HydrophobicContact CD2-CD 4.43Å; L1018-K1087 HydrophobicContact CD2-CG 3.86Å; L1018-K1087 HydrophobicContact CG-CG 3.74Å; L1018-L1088 HydrophobicContact CB-CD1 3.86Å; L1018-L1088 VanDerWaalsContact CB-CD1 3.47Å; L1018-L1110 HydrophobicContact CD2-CD2 4.29Å
1019	S	60.4	Low	59.2	Low	37 Å²	37	53.1 Å²	53.1	26%	0.259	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	62	178	55.6	0	0	0	0	110.3	I1000 S1017 V1086	I1000-S1019 WeakPolarHBondContact CB-O 3.44Å; I1000-S1019 WeakPolarHBondContact CB-OG 3.29Å; I1000-S1019 WeakPolarHBondContact CG2-OG 3.39Å; I1000-S1019 CarbonylContact O-C 3.55Å; I1000-S1019 WeakPolarHBondContact O-CA 3.48Å; I1000-S1019 PolarHBondContact O-N 2.93Å; I1000-S1019 PolarHBondContact O-OG 2.85Å; S1017-S1019 PolarHBondContact O-N 2.75Å; S1017-S1019 VanDerWaalsContact O-N 3.12Å; S1019-V1086 PolarHBondContact N-O 2.92Å; S1019-V1086 PolarHBondContact O-N 3.02Å; S1019-V1086 WeakPolarHBondContact OG-CB 3.38Å; S1019-V1086 PolarHBondContact OG-O 3.43Å
1020	Q	67.8	Low	61.1	Low	84.6 Å²	84.6	49.1 Å²	49.1	40%	0.395	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	128.9	179.2	-94	-173.3	-26.6	0	0	111.1	F999 I1000 L1018 T1022 D1085	F999-Q1020 WeakPolarHBondContact CA-O 3.35Å; I1000-Q1020 PolarHBondContact N-O 3.2Å; I1000-Q1020 VanDerWaalsContact N-O 3.09Å; I1000-Q1020 PolarHBondContact O-N 2.73Å; L1018-Q1020 HydrophobicContact CB-CG 4.4Å; L1018-Q1020 HydrophobicContact CD2-CG 4.32Å; L1018-Q1020 PolarHBondContact O-N 3.15Å; Q1020-T1022 HydrophobicContact CG-CG2 3.8Å; Q1020-D1085 WeakPolarHBondContact CA-OD1 3.31Å; Q1020-D1085 WeakPolarHBondContact CB-OD1 3.4Å; Q1020-D1085 WeakPolarHBondContact CG-OD1 3.44Å; Q1020-D1085 PolarHBondContact NE2-OD1 2.86Å
1021	I	72.3	Confident	62.5	Low	31.6 Å²	31.6	40.4 Å²	40.4	16%	0.162	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	125	165.9	-56.9	170	0	0	0	107.2	Q997 R998 F999 L1018 I1023 H1083 V1084	Q997-I1021 HydrophobicContact CG-CG2 4.25Å; R998-I1021 CarbonylContact O-C 3.55Å; R998-I1021 WeakPolarHBondContact O-CA 3.42Å; R998-I1021 WeakPolarHBondContact O-CG2 3.41Å; F999-I1021 HydrophobicContact CB-CG1 4.11Å; F999-I1021 HydrophobicContact CB-CG2 4.37Å; L1018-I1021 HydrophobicContact CD2-CD1 3.69Å; L1018-I1021 VanDerWaalsContact CD2-CD1 3.49Å; L1018-I1021 HydrophobicContact CD2-CG1 3.69Å; I1021-I1023 HydrophobicContact CG2-CD1 4.43Å; I1021-I1023 HydrophobicContact CG2-CG1 4.13Å; I1021-H1083 WeakPolarHBondContact O-CA 3.22Å; I1021-V1084 HydrophobicContact CB-CB 4.22Å; I1021-V1084 HydrophobicContact CB-CG1 4.46Å; I1021-V1084 HydrophobicContact CD1-CG1 4.44Å; I1021-V1084 PolarHBondContact N-O 2.94Å; I1021-V1084 PolarHBondContact O-N 3.15Å
1022	T	71.1	Confident	63.8	Low	30.8 Å²	30.8	40.6 Å²	40.6	19%	0.189	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	124.3	175	65.8	0	0	0	0	109.2	Q997 R998 Q1020 I1082 H1083	Q997-T1022 CarbonylContact C-O 3.52Å; Q997-T1022 VanDerWaalsContact CA-O 3.27Å; Q997-T1022 WeakPolarHBondContact CA-O 3.38Å; R998-T1022 WeakPolarHBondContact CB-OG1 3.26Å; R998-T1022 PolarHBondContact N-O 3.14Å; R998-T1022 PolarHBondContact O-N 3.16Å; Q1020-T1022 HydrophobicContact CG-CG2 3.8Å; T1022-I1082 WeakPolarHBondContact CA-O 3.32Å; T1022-H1083 WeakPolarHBondContact CG2-ND1 3.41Å
1023	I	75.6	Confident	64.4	Low	31.2 Å²	31.2	41.7 Å²	41.7	16%	0.16	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	125.1	178.6	-58.2	172.4	0	0	0	107.2	I994 Q997 I1021 A1026 E1081 I1082	I994-I1023 HydrophobicContact CD1-CG2 4.28Å; I994-I1023 HydrophobicContact CG1-CG2 4.33Å; I994-I1023 HydrophobicContact CG2-CG2 3.64Å; Q997-I1023 HydrophobicContact CB-CG1 4.46Å; Q997-I1023 HydrophobicContact CG-CG1 4.09Å; I1021-I1023 HydrophobicContact CG2-CD1 4.43Å; I1021-I1023 HydrophobicContact CG2-CG1 4.13Å; I1023-A1026 HydrophobicContact CG2-CB 4.04Å; I1023-E1081 CarbonylContact O-C 3.48Å; I1023-E1081 VanDerWaalsContact O-CA 3.32Å; I1023-E1081 WeakPolarHBondContact O-CA 3.28Å; I1023-I1082 HydrophobicContact CB-CB 4.28Å; I1023-I1082 HydrophobicContact CB-CD1 4.38Å; I1023-I1082 HydrophobicContact CG2-CD1 4.36Å; I1023-I1082 PolarHBondContact N-O 3.12Å; I1023-I1082 PolarHBondContact O-N 3.06Å
1024	T	74.8	Confident	64.6	Low	38 Å²	38	45 Å²	45	23%	0.233	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	137.9	-177.8	54.6	0	0	0	0	110.6	D995 S996 T1080 E1081	D995-T1024 PolarHBondContact N-O 3.04Å; D995-T1024 VanDerWaalsContact N-O 3.14Å; S996-T1024 PolarHBondContact N-O 2.87Å; S996-T1024 VanDerWaalsContact N-O 3.16Å; S996-T1024 PolarHBondContact N-OG1 3Å; S996-T1024 PolarHBondContact O-N 3.07Å; S996-T1024 PolarHBondContact O-OG1 3.11Å; S996-T1024 PolarHBondContact OG-OG1 3.15Å; T1024-T1080 CarbonylContact C-O 3.53Å; T1024-T1080 WeakPolarHBondContact CA-O 3.36Å; T1024-E1081 HydrophobicContact CG2-CB 4.33Å; T1024-E1081 HydrophobicContact CG2-CG 4.13Å
1025	G	71.8	Confident	64.4	Low	13.8 Å²	13.8	50.4 Å²	50.4	14%	0.142	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	63.4	53	177.7	0	0	0	0	0	113.8	I994 D995 S1068 T1080	I994-G1025 WeakPolarHBondContact CA-O 3.35Å; D995-G1025 PolarHBondContact N-O 3.02Å; D995-G1025 VanDerWaalsContact N-O 3.12Å; G1025-S1068 WeakPolarHBondContact O-CB 3.49Å; G1025-T1080 PolarHBondContact N-O 2.98Å
1026	A	77.4	Confident	63.8	Low	8.2 Å²	8.2	55.8 Å²	55.8	7%	0.068	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	115.4	179	0	0	0	0	0	111.7	R993 I994 I1023 L1079 I1082	R993-A1026 CarbonylContact O-C 3.52Å; R993-A1026 VanDerWaalsContact O-CA 3.25Å; R993-A1026 WeakPolarHBondContact O-CA 3.33Å; I994-A1026 HydrophobicContact CG1-CB 4.19Å; I1023-A1026 HydrophobicContact CG2-CB 4.04Å; A1026-L1079 WeakPolarHBondContact CA-O 3.18Å; A1026-L1079 HydrophobicContact CB-CB 4.2Å; A1026-L1079 PolarHBondContact N-O 2.99Å; A1026-L1079 PolarHBondContact O-N 2.97Å; A1026-L1079 VanDerWaalsContact O-O 3.09Å; A1026-I1082 HydrophobicContact CB-CD1 4.5Å
1027	K	79.3	Confident	63.1	Low	30.4 Å²	30.4	59.7 Å²	59.7	13%	0.132	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	132.1	174.6	-72.2	-169.9	173.5	-173.5	0	111.4	R993 S1068 I1071 L1075 L1077	R993-K1027 HydrophobicContact CB-CB 4.33Å; R993-K1027 WeakPolarHBondContact CB-O 3.49Å; R993-K1027 PolarHBondContact N-O 2.97Å; R993-K1027 PolarHBondContact O-N 2.93Å; R993-K1027 VanDerWaalsContact O-O 3.06Å; K1027-S1068 VanDerWaalsContact CD-O 3.29Å; K1027-S1068 WeakPolarHBondContact CD-O 3.31Å; K1027-S1068 VanDerWaalsContact CE-O 3.25Å; K1027-S1068 WeakPolarHBondContact CE-O 3.33Å; K1027-S1068 PolarHBondContact NZ-O 3.06Å; K1027-I1071 HydrophobicContact CD-CB 4.1Å; K1027-I1071 HydrophobicContact CD-CG2 4.42Å; K1027-I1071 PolarHBondContact NZ-O 3.03Å; K1027-I1071 VanDerWaalsContact NZ-O 3.09Å; K1027-L1075 HydrophobicContact CB-CD1 3.94Å; K1027-L1075 HydrophobicContact CD-CD1 3.81Å; K1027-L1075 HydrophobicContact CG-CD1 3.93Å; K1027-L1077 CarbonylContact C-O 3.57Å; K1027-L1077 VanDerWaalsContact CA-O 3.28Å; K1027-L1077 WeakPolarHBondContact CA-O 3.35Å
1028	L	80.3	Confident	62.1	Low	26.6 Å²	26.6	65.4 Å²	65.4	14%	0.139	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	124.2	169.6	-164.5	72	0	0	0	108.8	I990 M991 L992 V1076 L1077 F1131	I990-L1028 HydrophobicContact CG2-CD1 3.5Å; I990-L1028 VanDerWaalsContact CG2-CD1 3.44Å; I990-L1028 HydrophobicContact CG2-CD2 4.43Å; I990-L1028 HydrophobicContact CG2-CG 3.97Å; M991-L1028 CarbonylContact O-C 3.49Å; M991-L1028 WeakPolarHBondContact O-CA 3.29Å; L992-L1028 HydrophobicContact CB-CD1 3.94Å; L992-L1028 HydrophobicContact CD1-CD1 3.97Å; L992-L1028 HydrophobicContact CG-CD1 4.41Å; L1028-V1076 HydrophobicContact CB-CB 4.38Å; L1028-V1076 HydrophobicContact CD2-CB 4.3Å; L1028-V1076 HydrophobicContact CD2-CG1 4Å; L1028-V1076 HydrophobicContact CG-CB 4.37Å; L1028-V1076 WeakPolarHBondContact O-CA 3.42Å; L1028-V1076 WeakPolarHBondContact O-CB 3.35Å; L1028-V1076 PolarHBondContact O-N 3.05Å; L1028-L1077 HydrophobicContact CB-CB 3.64Å; L1028-L1077 HydrophobicContact CD2-CB 4.44Å; L1028-L1077 PolarHBondContact N-O 2.94Å; L1028-L1077 PolarHBondContact O-N 3.19Å; L1028-L1077 VanDerWaalsContact O-N 3.16Å; L1028-F1131 HydrophobicContact CD2-CE2 3.8Å; L1028-F1131 VanDerWaalsContact CD2-CE2 3.49Å; L1028-F1131 HydrophobicContact CD2-CZ 3.84Å
1029	V	76.8	Confident	61	Low	4.8 Å²	4.8	66.3 Å²	66.3	3%	0.029	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	134.6	178.5	-175.4	0	0	0	0	108.5	F989 I990 M991 S1031 I1071 D1074	F989-V1029 HydrophobicContact CE1-CG1 4.3Å; I990-V1029 CarbonylContact C-O 3.56Å; I990-V1029 VanDerWaalsContact CA-O 3.27Å; I990-V1029 WeakPolarHBondContact CA-O 3.41Å; M991-V1029 HydrophobicContact CB-CB 4.38Å; M991-V1029 HydrophobicContact CE-CB 4.12Å; M991-V1029 HydrophobicContact CE-CG2 3.71Å; M991-V1029 PolarHBondContact N-O 3.06Å; M991-V1029 PolarHBondContact O-N 3.03Å; V1029-S1031 PolarHBondContact O-N 2.83Å; V1029-I1071 HydrophobicContact CG1-CG2 4.44Å; V1029-I1071 HydrophobicContact CG2-CD1 4.34Å; V1029-I1071 HydrophobicContact CG2-CG2 3.57Å; V1029-I1071 VanDerWaalsContact CG2-CG2 3.5Å; V1029-D1074 WeakPolarHBondContact CA-O 3.28Å; V1029-D1074 HydrophobicContact CG1-CB 4.11Å; V1029-D1074 WeakPolarHBondContact CG1-O 3.37Å
1030	Y	74.6	Confident	59.5	Low	33.4 Å²	33.4	69.1 Å²	69.1	13%	0.131	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	102.5	169.8	168.9	-108.8	0	0	0	108.3	T988 F989 I990 D1074 V1076 G1130 F1131 C1134 Y1623 P1624 W1625	T988-Y1030 HydrophobicContact CG2-CE2 4.4Å; F989-Y1030 WeakPolarHBondContact O-CA 3.47Å; F989-Y1030 WeakPolarHBondContact O-CD2 3.45Å; I990-Y1030 HydrophobicContact CD1-CD2 4.33Å; I990-Y1030 HydrophobicContact CG1-CD2 3.89Å; I990-Y1030 HydrophobicContact CG1-CG 4.44Å; Y1030-D1074 PolarHBondContact N-O 3.28Å; Y1030-D1074 VanDerWaalsContact N-O 3.11Å; Y1030-D1074 VanDerWaalsContact O-CB 3.23Å; Y1030-D1074 WeakPolarHBondContact O-CB 3.33Å; Y1030-V1076 HydrophobicContact CD1-CG2 4.42Å; Y1030-V1076 HydrophobicContact CG-CG2 4.48Å; Y1030-G1130 PolarHBondContact OH-O 3.01Å; Y1030-F1131 HydrophobicContact CD1-CB 4.18Å; Y1030-F1131 HydrophobicContact CD2-CD2 4.4Å; Y1030-F1131 HydrophobicContact CE1-CB 4.38Å; Y1030-F1131 HydrophobicContact CG-CB 4.23Å; Y1030-F1131 HydrophobicContact CG-CD2 4.22Å; Y1030-C1134 HydrophobicContact CD2-CB 4.17Å; Y1030-C1134 HydrophobicContact CE2-CB 3.99Å; Y1030-C1134 WeakPolarHBondContact CE2-SG 3.4Å; Y1030-Y1623 PolarHBondContact OH-O 3.49Å; Y1030-Y1623 VanDerWaalsContact OH-O 3.13Å; Y1030-P1624 VanDerWaalsContact OH-CD 3.28Å; Y1030-P1624 WeakPolarHBondContact OH-CD 3.36Å; Y1030-W1625 PolarHBondContact OH-NE1 3.02Å
1031	S	68.3	Low	57.7	Low	19 Å²	19	72.5 Å²	72.5	13%	0.133	40%	0.396	C	S	.	.			trans	-115.5	155.3	173.6	84.1	0	0	0	0	109.8	F989 V1029 I1033 D1074	F989-S1031 WeakPolarHBondContact CB-O 3.22Å; F989-S1031 WeakPolarHBondContact CD1-OG 3.45Å; F989-S1031 WeakPolarHBondContact CE1-OG 3.43Å; F989-S1031 WeakPolarHBondContact CG-OG 3.27Å; F989-S1031 VanDerWaalsContact CZ-CB 3.47Å; F989-S1031 PolarHBondContact N-O 3.44Å; F989-S1031 VanDerWaalsContact N-O 3.08Å; F989-S1031 PolarHBondContact O-N 3.11Å; F989-S1031 VanDerWaalsContact O-N 3.09Å; F989-S1031 VanDerWaalsContact O-O 3.11Å; V1029-S1031 PolarHBondContact O-N 2.83Å; S1031-I1033 PolarHBondContact O-N 2.79Å; S1031-D1074 VanDerWaalsContact CB-OD2 3.3Å; S1031-D1074 WeakPolarHBondContact CB-OD2 3.25Å; S1031-D1074 PolarHBondContact OG-OD2 2.82Å; S1031-D1074 VanDerWaalsContact OG-OD2 3.07Å
1032	Y	61.2	Low	55.4	Low	110.2 Å²	110.2	77.4 Å²	77.4	43%	0.432	43%	0.428	S	S	.	.			trans	-105.1	133.7	172.1	73.2	-85.7	0	0	0	108.7	K1034 Y1623	Y1032-K1034 HydrophobicContact CD1-CB 4.12Å; Y1032-K1034 HydrophobicContact CD2-CB 4.03Å; Y1032-K1034 HydrophobicContact CD2-CG 4.05Å; Y1032-K1034 HydrophobicContact CE1-CB 4.22Å; Y1032-K1034 HydrophobicContact CE1-CG 4.28Å; Y1032-K1034 HydrophobicContact CE2-CB 3.78Å; Y1032-K1034 HydrophobicContact CE2-CD 4.09Å; Y1032-K1034 VanDerWaalsContact CE2-CE 3.49Å; Y1032-K1034 HydrophobicContact CE2-CG 3.51Å; Y1032-K1034 VanDerWaalsContact CE2-CG 3.45Å; Y1032-K1034 PolarHBondContact O-N 3.32Å; Y1032-K1034 VanDerWaalsContact O-N 3.15Å; Y1032-K1034 VanDerWaalsContact OH-CE 3.27Å; Y1032-K1034 WeakPolarHBondContact OH-CE 3.26Å; Y1032-Y1623 HydrophobicContact CD1-CD1 4.32Å; Y1032-Y1623 AromaticContact CD2-CD1 3.7Å; Y1032-Y1623 HydrophobicContact CD2-CD1 3.7Å; Y1032-Y1623 AromaticContact CD2-CE1 3.38Å; Y1032-Y1623 HydrophobicContact CD2-CE1 3.73Å; Y1032-Y1623 HydrophobicContact CE1-CD1 4.32Å; Y1032-Y1623 AromaticContact CE2-CD1 3.58Å; Y1032-Y1623 HydrophobicContact CE2-CD1 3.58Å; Y1032-Y1623 AromaticContact CE2-CE1 3.55Å; Y1032-Y1623 HydrophobicContact CE2-CE1 3.55Å; Y1032-Y1623 HydrophobicContact CG-CD1 4.09Å; Y1032-Y1623 HydrophobicContact CG-CE1 4.04Å; Y1032-Y1623 AromaticContact CZ-CD1 3.96Å
1033	I	55	Low	53.4	Low	75.8 Å²	75.8	82.1 Å²	82.1	39%	0.389	46%	0.456	S	S	.	.			trans	-71.8	100.7	172	-56.7	175.8	0	0	0	106.7	W890 F989 S1031 K1035 P1060	W890-I1033 HydrophobicContact CD2-CD1 4.09Å; W890-I1033 HydrophobicContact CD2-CG1 4.46Å; W890-I1033 HydrophobicContact CE3-CD1 3.87Å; W890-I1033 HydrophobicContact CH2-CD1 4.04Å; W890-I1033 HydrophobicContact CH2-CG1 3.92Å; W890-I1033 HydrophobicContact CZ2-CD1 3.79Å; W890-I1033 HydrophobicContact CZ2-CG1 3.95Å; W890-I1033 HydrophobicContact CZ3-CD1 3.94Å; W890-I1033 HydrophobicContact CZ3-CG1 4.42Å; F989-I1033 HydrophobicContact CB-CD1 3.97Å; F989-I1033 HydrophobicContact CB-CG1 4.04Å; F989-I1033 HydrophobicContact CD1-CG1 3.9Å; F989-I1033 HydrophobicContact CD2-CD1 3.81Å; F989-I1033 HydrophobicContact CD2-CG1 4.37Å; F989-I1033 HydrophobicContact CG-CD1 4.04Å; F989-I1033 HydrophobicContact CG-CG1 4.21Å; S1031-I1033 PolarHBondContact O-N 2.79Å; I1033-K1035 PolarHBondContact O-N 3.25Å; I1033-K1035 VanDerWaalsContact O-N 3.12Å; I1033-P1060 HydrophobicContact CG2-CB 3.99Å
1034	K	45.8	Very low	50.9	Low	143 Å²	143	85.7 Å²	85.7	62%	0.622	48%	0.484	S	S	*	.			trans	-65.8	111.6	166.9	-108.9	-177.7	-176.5	-170.7	0	106.7	Y1032 L1036 D1037	Y1032-K1034 HydrophobicContact CD1-CB 4.12Å; Y1032-K1034 HydrophobicContact CD2-CB 4.03Å; Y1032-K1034 HydrophobicContact CD2-CG 4.05Å; Y1032-K1034 HydrophobicContact CE1-CB 4.22Å; Y1032-K1034 HydrophobicContact CE1-CG 4.28Å; Y1032-K1034 HydrophobicContact CE2-CB 3.78Å; Y1032-K1034 HydrophobicContact CE2-CD 4.09Å; Y1032-K1034 VanDerWaalsContact CE2-CE 3.49Å; Y1032-K1034 HydrophobicContact CE2-CG 3.51Å; Y1032-K1034 VanDerWaalsContact CE2-CG 3.45Å; Y1032-K1034 PolarHBondContact O-N 3.32Å; Y1032-K1034 VanDerWaalsContact O-N 3.15Å; Y1032-K1034 VanDerWaalsContact OH-CE 3.27Å; Y1032-K1034 WeakPolarHBondContact OH-CE 3.26Å; K1034-L1036 PolarHBondContact O-N 3.07Å; K1034-D1037 WeakPolarHBondContact CE-OD2 3.45Å; K1034-D1037 IonicContact NZ-OD2 2.64Å; K1034-D1037 PolarHBondContact NZ-OD2 2.85Å
1035	K	41.1	Very low	48.5	Very low	169.4 Å²	169.4	89.5 Å²	89.5	74%	0.737	51%	0.511	S	S	*	.			trans	-60.6	133	160.8	-76	-173.4	174.6	-175.4	0	106.4	I1033 D1037	I1033-K1035 PolarHBondContact O-N 3.25Å; I1033-K1035 VanDerWaalsContact O-N 3.12Å; K1035-D1037 VanDerWaalsContact C-N 3.33Å; K1035-D1037 PolarHBondContact O-N 3.13Å
1036	L	34.7	Very low	46.2	Very low	150 Å²	150	94.5 Å²	94.5	79%	0.785	54%	0.542	S	S	*	.			trans	-62.1	101.4	-179.4	-169.6	72.9	0	0	0	108	K1034 N1038	K1034-L1036 PolarHBondContact O-N 3.07Å; L1036-N1038 PolarHBondContact O-N 3.11Å
1037	D	34.2	Very low	43.6	Very low	127.8 Å²	127.8	99.7 Å²	99.7	68%	0.683	58%	0.578	S	S	*	*			trans	-67	123.8	170.9	-71.7	-38.8	0	0	0	107.1	K1034 K1035 G1039	K1034-D1037 WeakPolarHBondContact CE-OD2 3.45Å; K1034-D1037 IonicContact NZ-OD2 2.64Å; K1034-D1037 PolarHBondContact NZ-OD2 2.85Å; K1035-D1037 VanDerWaalsContact C-N 3.33Å; K1035-D1037 PolarHBondContact O-N 3.13Å; D1037-G1039 PolarHBondContact O-N 3.04Å
1038	N	30.4	Very low	41.1	Very low	163.6 Å²	163.6	103.5 Å²	103.5	88%	0.875	61%	0.608	S	S	*	*	S	Bend	trans	-65	76.1	177.1	-71.7	-25.6	0	0	0	110.6	L1036	L1036-N1038 PolarHBondContact O-N 3.11Å
1039	G	28.8	Very low	38.4	Very low	63.4 Å²	63.4	108.8 Å²	108.8	65%	0.654	64%	0.642	S	S	*	*			trans	-138.9	120.1	175.9	0	0	0	0	0	110	D1037 D1041	D1037-G1039 PolarHBondContact O-N 3.04Å; G1039-D1041 PolarHBondContact O-N 3.25Å
1040	A	28.1	Very low	36	Very low	95 Å²	95	114.3 Å²	114.3	79%	0.785	68%	0.681	S	S	*	*			trans	-48.2	123.7	172	0	0	0	0	0	112.1
1041	D	29.3	Very low	33.5	Very low	155.8 Å²	155.8	118.7 Å²	118.7	83%	0.833	72%	0.716	S	S	*	*				-170.2	135.8	129.1	-91.6	-25.5	0	0	0	110.5	G1039 V1043	G1039-D1041 PolarHBondContact O-N 3.25Å; D1041-V1043 PolarHBondContact O-N 3.35Å
1042	T	25.1	Very low	31.4	Very low	134.8 Å²	134.8	122.4 Å²	122.4	83%	0.827	75%	0.748	S	S	*	*			trans	-47.2	121.5	-178.3	49.6	0	0	0	0	114.1
1043	V	28.5	Very low	29.6	Very low	130.8 Å²	130.8	122.3 Å²	122.3	79%	0.793	76%	0.764	S	S	*	*				-137.7	124.7	115.9	174.5	0	0	0	0	110	D1041 C1045	D1041-V1043 PolarHBondContact O-N 3.35Å; V1043-C1045 HydrophobicContact CG1-CB 4.29Å; V1043-C1045 PolarHBondContact O-N 3.28Å; V1043-C1045 VanDerWaalsContact O-N 3.16Å
1044	S	23.7	Very low	28.1	Very low	106 Å²	106	125.8 Å²	125.8	74%	0.741	79%	0.788	S	S	*	*			trans	-53.4	124.4	170.5	98.9	0	0	0	0	114
1045	C	23.8	Very low	27.1	Very low	117.6 Å²	117.6	123.4 Å²	123.4	80%	0.795	79%	0.79	S	S	*	*				-144.9	123.9	114.6	-78.4	0	0	0	0	110.8	V1043	V1043-C1045 HydrophobicContact CG1-CB 4.29Å; V1043-C1045 PolarHBondContact O-N 3.28Å; V1043-C1045 VanDerWaalsContact O-N 3.16Å
1046	C	24.6	Very low	26.4	Very low	118 Å²	118	121 Å²	121	80%	0.797	79%	0.794	S	S	*	*			trans	-100.2	123.6	158.2	-63.7	0	0	0	0	114.4	S1048	C1046-S1048 PolarHBondContact O-N 3.24Å
1047	S	22.1	Very low	26.1	Very low	118.2 Å²	118.2	120.5 Å²	120.5	83%	0.827	79%	0.792	S	S	*	*			trans	-101.6	122	148.2	32.9	0	0	0	0	112.8
1048	S	27.3	Very low	26.1	Very low	109.8 Å²	109.8	119.2 Å²	119.2	77%	0.768	79%	0.793	S	S	*	*			trans	-174.4	111.4	153.7	29.2	0	0	0	0	112.5	C1046 S1050	C1046-S1048 PolarHBondContact O-N 3.24Å; S1048-S1050 PolarHBondContact O-N 3.23Å
1049	T	23	Very low	26.7	Very low	138.6 Å²	138.6	116.1 Å²	116.1	85%	0.85	78%	0.784	S	S	*	*			trans	-32.9	127.5	159.3	47.7	0	0	0	0	114.8
1050	S	25.9	Very low	27.9	Very low	120.8 Å²	120.8	116.3 Å²	116.3	85%	0.845	77%	0.774	S	S	*	*				-179.2	130.6	123.7	49.1	0	0	0	0	112.6	S1048 A1052	S1048-S1050 PolarHBondContact O-N 3.23Å; S1050-A1052 PolarHBondContact O-N 3.31Å
1051	S	22.1	Very low	29.2	Very low	125 Å²	125	116.4 Å²	116.4	87%	0.874	77%	0.768	S	S	*	*			trans	-83.6	114.7	179.4	48.4	0	0	0	0	112.5
1052	A	24	Very low	30.7	Very low	95.8 Å²	95.8	111.9 Å²	111.9	79%	0.792	75%	0.747	S	S	*	*			trans	-158.2	139.7	160.8	0	0	0	0	0	110.8	S1050	S1050-A1052 PolarHBondContact O-N 3.31Å
1053	S	24	Very low	32.8	Very low	109.6 Å²	109.6	108.6 Å²	108.6	77%	0.766	72%	0.72	S	S	*	*			trans	-10.2	132.2	171.5	54.1	0	0	0	0	116.4	S1055	S1053-S1055 VanDerWaalsContact C-N 3.31Å; S1053-S1055 PolarHBondContact O-N 2.89Å
1054	V	23.8	Very low	34.6	Very low	148.2 Å²	148.2	105.1 Å²	105.1	90%	0.898	71%	0.705	S	S	*	*			trans	-50	110.7	164.1	-179.7	0	0	0	0	111.5
1055	S	24.6	Very low	36.7	Very low	93.8 Å²	93.8	101 Å²	101	66%	0.656	67%	0.674	S	S	*	*			trans	-123	133.9	160.8	61.7	0	0	0	0	109.3	S1053 N1057	S1053-S1055 VanDerWaalsContact C-N 3.31Å; S1053-S1055 PolarHBondContact O-N 2.89Å; S1055-N1057 VanDerWaalsContact C-N 3.26Å; S1055-N1057 PolarHBondContact O-N 2.99Å
1056	S	26.2	Very low	38.8	Very low	118 Å²	118	98.6 Å²	98.6	83%	0.825	66%	0.656	S	S	*	*	S	Bend	trans	-77.6	31.1	-169.1	53.5	0	0	0	0	114.6
1057	N	29.1	Very low	40.7	Very low	140.2 Å²	140.2	95.4 Å²	95.4	75%	0.75	64%	0.635	S	S	*	*			trans	-121.2	50.1	-177.2	-75.8	1.3	0	0	0	111.2	S1055 S1059	S1055-N1057 VanDerWaalsContact C-N 3.26Å; S1055-N1057 PolarHBondContact O-N 2.99Å; N1057-S1059 PolarHBondContact O-N 3.09Å
1058	S	33.2	Very low	42.9	Very low	100.2 Å²	100.2	90.2 Å²	90.2	70%	0.701	60%	0.598	S	S	*	*			trans	-69.8	101.8	171	62.4	0	0	0	0	109
1059	S	44.4	Very low	44.7	Very low	98 Å²	98	89.4 Å²	89.4	69%	0.685	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-55.1	135.2	167.5	50.4	0	0	0	0	109	N1057 C1061	N1057-S1059 PolarHBondContact O-N 3.09Å; S1059-C1061 PolarHBondContact O-N 3.12Å
1060	P	53.6	Low	46.7	Very low	67.4 Å²	67.4	87.6 Å²	87.6	44%	0.438	58%	0.577	S	S	.	*	P	Polyproline II helix	trans	-58	134	176.8	23.9	-32.8	0	0	0	109.5	W890 I1033	W890-P1060 HydrophobicContact CB-CG 3.81Å; W890-P1060 VanDerWaalsContact CD1-CB 3.46Å; W890-P1060 HydrophobicContact CG-CB 4.25Å; W890-P1060 HydrophobicContact CG-CG 3.79Å; I1033-P1060 HydrophobicContact CG2-CB 3.99Å
1061	C	55	Low	48.6	Very low	98 Å²	98	82.8 Å²	82.8	66%	0.662	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-55.2	140.5	-178.5	-65.1	0	0	0	0	110.7	W890 S1059 Y1063	W890-C1061 PolarHBondContact NE1-O 2.93Å; W890-C1061 VanDerWaalsContact NE1-O 3.1Å; S1059-C1061 PolarHBondContact O-N 3.12Å; C1061-Y1063 PolarHBondContact O-N 2.99Å
1062	P	60.5	Low	50.4	Low	61.4 Å²	61.4	85.1 Å²	85.1	40%	0.399	54%	0.536	S	S	.	.	P	Polyproline II helix	trans	-59	139.4	177.3	23.4	-32	0	0	0	110.5	N887 H888 A1064	N887-P1062 HydrophobicContact CB-CB 4.14Å; H888-P1062 CarbonylContact O-C 3.51Å; H888-P1062 VanDerWaalsContact O-CA 3.26Å; H888-P1062 WeakPolarHBondContact O-CA 3.37Å; H888-P1062 WeakPolarHBondContact O-CB 3.39Å; P1062-A1064 PolarHBondContact O-N 3.07Å
1063	Y	68.2	Low	52.1	Low	64.2 Å²	64.2	86.8 Å²	86.8	25%	0.252	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	116.7	178.3	-176.1	-90.1	0	0	0	109.6	N887 H888 F984 F989 M991 C1061 I1065	N887-Y1063 CarbonylContact C-O 3.44Å; N887-Y1063 WeakPolarHBondContact CA-O 3.35Å; H888-Y1063 PolarHBondContact N-O 3.12Å; H888-Y1063 PolarHBondContact O-N 3.24Å; F984-Y1063 AromaticContact CE1-CD1 3.8Å; F984-Y1063 HydrophobicContact CE1-CD1 3.8Å; F984-Y1063 HydrophobicContact CE1-CE1 4.15Å; F984-Y1063 HydrophobicContact CE1-CG 4.41Å; F984-Y1063 HydrophobicContact CZ-CD1 4.14Å; F984-Y1063 HydrophobicContact CZ-CE1 4.49Å; F989-Y1063 HydrophobicContact CE1-CE2 4.3Å; F989-Y1063 AromaticContact CE2-CD2 3.85Å; F989-Y1063 HydrophobicContact CE2-CD2 4.07Å; F989-Y1063 AromaticContact CE2-CE2 3.94Å; F989-Y1063 HydrophobicContact CE2-CE2 4.04Å; F989-Y1063 HydrophobicContact CE2-CG 4.33Å; F989-Y1063 HydrophobicContact CZ-CD1 4.48Å; F989-Y1063 AromaticContact CZ-CD2 3.86Å; F989-Y1063 HydrophobicContact CZ-CD2 3.86Å; F989-Y1063 HydrophobicContact CZ-CE1 4.25Å; F989-Y1063 AromaticContact CZ-CE2 3.5Å; F989-Y1063 HydrophobicContact CZ-CE2 3.5Å; F989-Y1063 VanDerWaalsContact CZ-CE2 3.49Å; F989-Y1063 HydrophobicContact CZ-CG 4.32Å; F989-Y1063 AromaticContact CZ-CZ 3.7Å; M991-Y1063 HydrophobicContact CE-CE1 4.39Å; M991-Y1063 HydrophobicContact SD-CD1 4.27Å; M991-Y1063 HydrophobicContact SD-CE1 3.71Å; M991-Y1063 WeakPolarHBondContact SD-CE1 3.42Å; C1061-Y1063 PolarHBondContact O-N 2.99Å; Y1063-I1065 PolarHBondContact O-N 3.13Å
1064	A	66.8	Low	54	Low	57.6 Å²	57.6	85.8 Å²	85.8	48%	0.476	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	116.9	177	0	0	0	0	0	110.5	N886 P1062 V1066	N886-A1064 CarbonylContact O-C 3.49Å; N886-A1064 WeakPolarHBondContact O-CA 3.42Å; P1062-A1064 PolarHBondContact O-N 3.07Å; A1064-V1066 PolarHBondContact O-N 3.27Å
1065	I	67.2	Low	56.1	Low	20.6 Å²	20.6	80.3 Å²	80.3	11%	0.106	48%	0.483	C	S	.	.			trans	-83.4	117.4	177.3	-57.8	170	0	0	0	107.9	N886 H888 Q916 N982 F984 M991 Y1063	N886-I1065 WeakPolarHBondContact O-CB 3.32Å; N886-I1065 PolarHBondContact O-N 3.3Å; H888-I1065 HydrophobicContact CB-CD1 4.15Å; H888-I1065 HydrophobicContact CB-CG1 4.37Å; Q916-I1065 VanDerWaalsContact CD-CD1 3.5Å; Q916-I1065 HydrophobicContact CG-CD1 4.18Å; Q916-I1065 VanDerWaalsContact NE2-CD1 3.26Å; N982-I1065 VanDerWaalsContact ND2-CD1 3.3Å; N982-I1065 WeakPolarHBondContact ND2-CD1 3.38Å; N982-I1065 WeakPolarHBondContact ND2-CG1 3.47Å; N982-I1065 VanDerWaalsContact ND2-CG2 3.3Å; N982-I1065 WeakPolarHBondContact ND2-CG2 3.36Å; N982-I1065 WeakPolarHBondContact OD1-CG2 3.37Å; F984-I1065 HydrophobicContact CZ-CD1 4.45Å; F984-I1065 HydrophobicContact CZ-CG1 4.39Å; M991-I1065 HydrophobicContact CE-CG2 4.41Å; Y1063-I1065 PolarHBondContact O-N 3.13Å
1066	V	68.2	Low	58.5	Low	67.8 Å²	67.8	76.1 Å²	76.1	41%	0.411	45%	0.454	S	S	.	.			trans	-112.7	157.2	177.7	-150.5	0	0	0	0	109.5	A1064 D1070	A1064-V1066 PolarHBondContact O-N 3.27Å; V1066-D1070 HydrophobicContact CB-CB 4.28Å; V1066-D1070 HydrophobicContact CG1-CB 3.44Å; V1066-D1070 WeakPolarHBondContact CG1-OD2 3.4Å
1067	S	65.9	Low	60.9	Low	49.6 Å²	49.6	72.4 Å²	72.4	35%	0.347	42%	0.424	S	S	.	.			trans	-57.7	151.1	174.4	167.4	0	0	0	0	111	C1069 D1070	S1067-C1069 PolarHBondContact O-N 3.1Å; S1067-C1069 VanDerWaalsContact O-N 3.13Å; S1067-C1069 PolarHBondContact OG-N 2.75Å; S1067-D1070 WeakPolarHBondContact CB-OD2 3.38Å; S1067-D1070 PolarHBondContact O-N 3.18Å; S1067-D1070 VanDerWaalsContact O-N 3.11Å; S1067-D1070 PolarHBondContact OG-OD2 2.89Å
1068	S	67.6	Low	63.1	Low	9 Å²	9	66.8 Å²	66.8	6%	0.063	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-56.6	-35.1	179.6	83.4	0	0	0	0	111.7	D995 G1025 K1027 D1070 I1071	D995-S1068 WeakPolarHBondContact OD1-CB 3.34Å; D995-S1068 PolarHBondContact OD1-N 3.01Å; D995-S1068 VanDerWaalsContact OD1-N 3.16Å; D995-S1068 WeakPolarHBondContact OD2-CB 3.36Å; D995-S1068 PolarHBondContact OD2-OG 3.19Å; G1025-S1068 WeakPolarHBondContact O-CB 3.49Å; K1027-S1068 VanDerWaalsContact CD-O 3.29Å; K1027-S1068 WeakPolarHBondContact CD-O 3.31Å; K1027-S1068 VanDerWaalsContact CE-O 3.25Å; K1027-S1068 WeakPolarHBondContact CE-O 3.33Å; K1027-S1068 PolarHBondContact NZ-O 3.06Å; S1068-D1070 VanDerWaalsContact C-N 3.25Å; S1068-D1070 PolarHBondContact O-N 3Å; S1068-D1070 VanDerWaalsContact O-N 3.15Å; S1068-I1071 PolarHBondContact O-N 2.99Å; S1068-I1071 VanDerWaalsContact O-N 3.17Å
1069	C	64.7	Low	65	Low	93.6 Å²	93.6	63.3 Å²	63.3	63%	0.632	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-57.1	-32.9	178.4	-63.4	0	0	0	0	113.7	S1067	S1067-C1069 PolarHBondContact O-N 3.1Å; S1067-C1069 VanDerWaalsContact O-N 3.13Å; S1067-C1069 PolarHBondContact OG-N 2.75Å
1070	D	65.8	Low	66.2	Low	101.4 Å²	101.4	60.6 Å²	60.6	54%	0.542	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-88.4	-17.2	-174.5	-57.9	-45.5	0	0	0	112.9	V1066 S1067 S1068 K1072	V1066-D1070 HydrophobicContact CB-CB 4.28Å; V1066-D1070 HydrophobicContact CG1-CB 3.44Å; V1066-D1070 WeakPolarHBondContact CG1-OD2 3.4Å; S1067-D1070 WeakPolarHBondContact CB-OD2 3.38Å; S1067-D1070 PolarHBondContact O-N 3.18Å; S1067-D1070 VanDerWaalsContact O-N 3.11Å; S1067-D1070 PolarHBondContact OG-OD2 2.89Å; S1068-D1070 VanDerWaalsContact C-N 3.25Å; S1068-D1070 PolarHBondContact O-N 3Å; S1068-D1070 VanDerWaalsContact O-N 3.15Å; D1070-K1072 PolarHBondContact O-N 2.85Å; D1070-K1072 VanDerWaalsContact O-N 3.1Å
1071	I	65.4	Low	67	Low	19 Å²	19	59.8 Å²	59.8	10%	0.097	34%	0.339	C	S	.	.			trans	-73.5	99.7	176.6	-58.5	174.1	0	0	0	109.4	M991 R993 K1027 V1029 S1068	M991-I1071 HydrophobicContact CE-CD1 3.86Å; R993-I1071 HydrophobicContact CB-CD1 4.33Å; R993-I1071 HydrophobicContact CG-CD1 4.24Å; K1027-I1071 HydrophobicContact CD-CB 4.1Å; K1027-I1071 HydrophobicContact CD-CG2 4.42Å; K1027-I1071 PolarHBondContact NZ-O 3.03Å; K1027-I1071 VanDerWaalsContact NZ-O 3.09Å; V1029-I1071 HydrophobicContact CG1-CG2 4.44Å; V1029-I1071 HydrophobicContact CG2-CD1 4.34Å; V1029-I1071 HydrophobicContact CG2-CG2 3.57Å; V1029-I1071 VanDerWaalsContact CG2-CG2 3.5Å; S1068-I1071 PolarHBondContact O-N 2.99Å; S1068-I1071 VanDerWaalsContact O-N 3.17Å
1072	K	59.8	Low	67.7	Low	173.4 Å²	173.4	56.1 Å²	56.1	75%	0.754	31%	0.313	S	S	*	.			trans	-105.5	-33	177.3	-66.3	-179.1	-178.2	177	0	114	D1070	D1070-K1072 PolarHBondContact O-N 2.85Å; D1070-K1072 VanDerWaalsContact O-N 3.1Å
1073	N	59.5	Low	68.1	Low	132 Å²	132	55.5 Å²	55.5	71%	0.706	31%	0.305	S	S	*	.	S	Bend	trans	-96.3	154.3	-174.1	-62.4	-8.4	0	0	0	111.4	L1075	N1073-L1075 PolarHBondContact O-N 3Å; N1073-L1075 VanDerWaalsContact O-N 3.12Å
1074	D	63.6	Low	68	Low	88.6 Å²	88.6	53.4 Å²	53.4	47%	0.474	30%	0.299	S	S	.	.	S	Bend	trans	55.7	23.6	175.6	-65.6	-13.1	0	0	0	116	V1029 Y1030 S1031 V1076	V1029-D1074 WeakPolarHBondContact CA-O 3.28Å; V1029-D1074 HydrophobicContact CG1-CB 4.11Å; V1029-D1074 WeakPolarHBondContact CG1-O 3.37Å; Y1030-D1074 PolarHBondContact N-O 3.28Å; Y1030-D1074 VanDerWaalsContact N-O 3.11Å; Y1030-D1074 VanDerWaalsContact O-CB 3.23Å; Y1030-D1074 WeakPolarHBondContact O-CB 3.33Å; S1031-D1074 VanDerWaalsContact CB-OD2 3.3Å; S1031-D1074 WeakPolarHBondContact CB-OD2 3.25Å; S1031-D1074 PolarHBondContact OG-OD2 2.82Å; S1031-D1074 VanDerWaalsContact OG-OD2 3.07Å; D1074-V1076 PolarHBondContact O-N 3.12Å
1075	L	68.9	Low	67.9	Low	32.8 Å²	32.8	53.1 Å²	53.1	17%	0.172	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	128.7	175.9	-171.8	75.1	0	0	0	111.1	K1027 N1073 L1077 I1126	K1027-L1075 HydrophobicContact CB-CD1 3.94Å; K1027-L1075 HydrophobicContact CD-CD1 3.81Å; K1027-L1075 HydrophobicContact CG-CD1 3.93Å; N1073-L1075 PolarHBondContact O-N 3Å; N1073-L1075 VanDerWaalsContact O-N 3.12Å; L1075-L1077 VanDerWaalsContact CD1-O 3.31Å; L1075-L1077 WeakPolarHBondContact CD1-O 3.23Å; L1075-I1126 WeakPolarHBondContact O-CD1 3.46Å
1076	V	74.8	Confident	67.6	Low	6 Å²	6	52.8 Å²	52.8	4%	0.036	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	-32.6	172.8	170.2	0	0	0	0	111.9	L1028 Y1030 D1074 F1125 I1126 F1131	L1028-V1076 HydrophobicContact CB-CB 4.38Å; L1028-V1076 HydrophobicContact CD2-CB 4.3Å; L1028-V1076 HydrophobicContact CD2-CG1 4Å; L1028-V1076 HydrophobicContact CG-CB 4.37Å; L1028-V1076 WeakPolarHBondContact O-CA 3.42Å; L1028-V1076 WeakPolarHBondContact O-CB 3.35Å; L1028-V1076 PolarHBondContact O-N 3.05Å; Y1030-V1076 HydrophobicContact CD1-CG2 4.42Å; Y1030-V1076 HydrophobicContact CG-CG2 4.48Å; D1074-V1076 PolarHBondContact O-N 3.12Å; V1076-F1125 HydrophobicContact CG1-CD2 4.29Å; V1076-F1125 HydrophobicContact CG1-CE2 3.96Å; V1076-F1125 CarbonylContact O-C 3.51Å; V1076-F1125 VanDerWaalsContact O-CA 3.27Å; V1076-F1125 WeakPolarHBondContact O-CA 3.33Å; V1076-F1125 VanDerWaalsContact O-CD2 3.31Å; V1076-F1125 WeakPolarHBondContact O-CD2 3.37Å; V1076-I1126 PolarHBondContact O-N 3.11Å; V1076-F1131 HydrophobicContact CB-CD2 4.47Å; V1076-F1131 HydrophobicContact CB-CE2 4.47Å; V1076-F1131 HydrophobicContact CG1-CD1 3.97Å; V1076-F1131 HydrophobicContact CG1-CD2 3.91Å; V1076-F1131 HydrophobicContact CG1-CE1 3.77Å; V1076-F1131 HydrophobicContact CG1-CE2 3.69Å; V1076-F1131 HydrophobicContact CG1-CG 4.04Å; V1076-F1131 HydrophobicContact CG1-CZ 3.62Å; V1076-F1131 HydrophobicContact CG2-CD2 4.09Å; V1076-F1131 HydrophobicContact CG2-CE2 4.33Å; V1076-F1131 HydrophobicContact CG2-CG 4.34Å
1077	L	77.4	Confident	66.9	Low	39.6 Å²	39.6	55.6 Å²	55.6	21%	0.207	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	133.2	179	-178.5	65.4	0	0	0	109.4	K1027 L1028 L1075 L1079 C1123 E1124 F1125 F1201	K1027-L1077 CarbonylContact C-O 3.57Å; K1027-L1077 VanDerWaalsContact CA-O 3.28Å; K1027-L1077 WeakPolarHBondContact CA-O 3.35Å; L1028-L1077 HydrophobicContact CB-CB 3.64Å; L1028-L1077 HydrophobicContact CD2-CB 4.44Å; L1028-L1077 PolarHBondContact N-O 2.94Å; L1028-L1077 PolarHBondContact O-N 3.19Å; L1028-L1077 VanDerWaalsContact O-N 3.16Å; L1075-L1077 VanDerWaalsContact CD1-O 3.31Å; L1075-L1077 WeakPolarHBondContact CD1-O 3.23Å; L1077-L1079 HydrophobicContact CD1-CD1 4.19Å; L1077-L1079 HydrophobicContact CD1-CD2 4.24Å; L1077-L1079 HydrophobicContact CD1-CG 4.02Å; L1077-L1079 HydrophobicContact CD2-CD1 3.66Å; L1077-L1079 VanDerWaalsContact CD2-CD1 3.47Å; L1077-L1079 HydrophobicContact CD2-CG 4.24Å; L1077-L1079 HydrophobicContact CG-CD1 3.95Å; L1077-L1079 HydrophobicContact CG-CG 3.96Å; L1077-C1123 VanDerWaalsContact CD1-SG 3.58Å; L1077-E1124 CarbonylContact C-O 3.51Å; L1077-E1124 VanDerWaalsContact CA-O 3.31Å; L1077-E1124 WeakPolarHBondContact CA-O 3.24Å; L1077-F1125 HydrophobicContact CB-CD2 4.27Å; L1077-F1125 HydrophobicContact CD1-CB 4.06Å; L1077-F1125 HydrophobicContact CD1-CD2 3.97Å; L1077-F1125 HydrophobicContact CD1-CG 4.4Å; L1077-F1201 HydrophobicContact CD1-CZ 4.41Å
1078	S	74.4	Confident	66.1	Low	23.2 Å²	23.2	55.1 Å²	55.1	16%	0.162	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	121.9	167.3	168.8	0	0	0	0	110.1	C1123 E1124	S1078-C1123 WeakPolarHBondContact O-CA 3.47Å; S1078-C1123 WeakPolarHBondContact O-CB 3.27Å; S1078-C1123 PolarHBondContact O-SG 3.34Å; S1078-C1123 VanDerWaalsContact O-SG 3.34Å; S1078-E1124 PolarHBondContact N-O 2.94Å; S1078-E1124 VanDerWaalsContact N-O 3.12Å; S1078-E1124 PolarHBondContact O-N 2.86Å; S1078-E1124 PolarHBondContact OG-N 2.91Å; S1078-E1124 VanDerWaalsContact OG-N 3.08Å; S1078-E1124 PolarHBondContact OG-O 3.36Å
1079	L	72.5	Confident	65.1	Low	25.6 Å²	25.6	56.8 Å²	56.8	13%	0.134	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	116.3	177.6	-67.1	168.1	0	0	0	108	A1026 L1077 I1082 I1116 C1123 F1201	A1026-L1079 WeakPolarHBondContact CA-O 3.18Å; A1026-L1079 HydrophobicContact CB-CB 4.2Å; A1026-L1079 PolarHBondContact N-O 2.99Å; A1026-L1079 PolarHBondContact O-N 2.97Å; A1026-L1079 VanDerWaalsContact O-O 3.09Å; L1077-L1079 HydrophobicContact CD1-CD1 4.19Å; L1077-L1079 HydrophobicContact CD1-CD2 4.24Å; L1077-L1079 HydrophobicContact CD1-CG 4.02Å; L1077-L1079 HydrophobicContact CD2-CD1 3.66Å; L1077-L1079 VanDerWaalsContact CD2-CD1 3.47Å; L1077-L1079 HydrophobicContact CD2-CG 4.24Å; L1077-L1079 HydrophobicContact CG-CD1 3.95Å; L1077-L1079 HydrophobicContact CG-CG 3.96Å; L1079-I1082 HydrophobicContact CB-CD1 4.01Å; L1079-I1082 HydrophobicContact CB-CG1 4.16Å; L1079-I1082 HydrophobicContact CD1-CD1 3.57Å; L1079-I1082 HydrophobicContact CD1-CG1 4.21Å; L1079-I1082 HydrophobicContact CD2-CD1 4.1Å; L1079-I1082 HydrophobicContact CD2-CG1 4.44Å; L1079-I1082 HydrophobicContact CG-CD1 4.26Å; L1079-I1116 HydrophobicContact CD2-CG2 4.37Å; L1079-C1123 HydrophobicContact CD2-CB 3.99Å; L1079-C1123 VanDerWaalsContact CD2-SG 3.53Å; L1079-C1123 WeakPolarHBondContact CD2-SG 3.42Å; L1079-F1201 HydrophobicContact CD2-CE2 3.65Å; L1079-F1201 HydrophobicContact CD2-CZ 3.94Å
1080	T	69.7	Low	64	Low	42.4 Å²	42.4	58.7 Å²	58.7	26%	0.26	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	-44.8	-174.7	51.3	0	0	0	0	112.3	T1024 G1025 P1118 Q1121	T1024-T1080 CarbonylContact C-O 3.53Å; T1024-T1080 WeakPolarHBondContact CA-O 3.36Å; G1025-T1080 PolarHBondContact N-O 2.98Å; T1080-P1118 WeakPolarHBondContact OG1-CA 3.44Å; T1080-Q1121 HydrophobicContact CG2-CB 4.09Å; T1080-Q1121 HydrophobicContact CG2-CG 4.44Å; T1080-Q1121 VanDerWaalsContact CG2-OE1 3.28Å; T1080-Q1121 PolarHBondContact OG1-OE1 3.03Å
1081	E	71.2	Confident	62.7	Low	49 Å²	49	62.1 Å²	62.1	23%	0.229	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	135.4	177.8	-172.6	165.1	-150.7	0	0	110.5	I1023 T1024 H1083 P1118 N1119	I1023-E1081 CarbonylContact O-C 3.48Å; I1023-E1081 VanDerWaalsContact O-CA 3.32Å; I1023-E1081 WeakPolarHBondContact O-CA 3.28Å; T1024-E1081 HydrophobicContact CG2-CB 4.33Å; T1024-E1081 HydrophobicContact CG2-CG 4.13Å; E1081-H1083 VanDerWaalsContact CD-CE1 3.47Å; E1081-H1083 VanDerWaalsContact CD-NE2 3.3Å; E1081-H1083 IonicContact OE1-CE1 2.89Å; E1081-H1083 PolarHBondContact OE1-CE1 3.31Å; E1081-H1083 VanDerWaalsContact OE1-CE1 3.29Å; E1081-H1083 IonicContact OE1-NE2 2.88Å; E1081-H1083 PolarHBondContact OE1-NE2 2.94Å; E1081-H1083 IonicContact OE2-NE2 3.16Å; E1081-P1118 WeakPolarHBondContact O-CA 3.41Å; E1081-N1119 HydrophobicContact CB-CB 4.23Å; E1081-N1119 HydrophobicContact CG-CB 4.4Å; E1081-N1119 PolarHBondContact O-N 3.4Å; E1081-N1119 WeakPolarHBondContact OE2-CB 3.31Å; E1081-N1119 PolarHBondContact OE2-ND2 2.92Å; E1081-N1119 VanDerWaalsContact OE2-ND2 3.12Å
1082	I	69.3	Low	61.4	Low	21.6 Å²	21.6	64 Å²	64	11%	0.111	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	120.6	177.8	-55.4	170.1	0	0	0	107.6	T1022 I1023 A1026 L1079 V1084 I1114 I1116	T1022-I1082 WeakPolarHBondContact CA-O 3.32Å; I1023-I1082 HydrophobicContact CB-CB 4.28Å; I1023-I1082 HydrophobicContact CB-CD1 4.38Å; I1023-I1082 HydrophobicContact CG2-CD1 4.36Å; I1023-I1082 PolarHBondContact N-O 3.12Å; I1023-I1082 PolarHBondContact O-N 3.06Å; A1026-I1082 HydrophobicContact CB-CD1 4.5Å; L1079-I1082 HydrophobicContact CB-CD1 4.01Å; L1079-I1082 HydrophobicContact CB-CG1 4.16Å; L1079-I1082 HydrophobicContact CD1-CD1 3.57Å; L1079-I1082 HydrophobicContact CD1-CG1 4.21Å; L1079-I1082 HydrophobicContact CD2-CD1 4.1Å; L1079-I1082 HydrophobicContact CD2-CG1 4.44Å; L1079-I1082 HydrophobicContact CG-CD1 4.26Å; I1082-V1084 HydrophobicContact CG2-CG2 3.82Å; I1082-I1114 HydrophobicContact CG2-CG2 4.33Å; I1082-I1116 HydrophobicContact CG1-CG2 4.36Å; I1082-I1116 HydrophobicContact CG2-CG1 4.37Å; I1082-I1116 HydrophobicContact CG2-CG2 3.78Å
1083	H	68.5	Low	59.9	Low	48.2 Å²	48.2	64.9 Å²	64.9	22%	0.223	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	130	165.6	-57	-70.7	0	0	0	109.1	I1021 T1022 E1081 E1115 I1116 S1117	I1021-H1083 WeakPolarHBondContact O-CA 3.22Å; T1022-H1083 WeakPolarHBondContact CG2-ND1 3.41Å; E1081-H1083 VanDerWaalsContact CD-CE1 3.47Å; E1081-H1083 VanDerWaalsContact CD-NE2 3.3Å; E1081-H1083 IonicContact OE1-CE1 2.89Å; E1081-H1083 PolarHBondContact OE1-CE1 3.31Å; E1081-H1083 VanDerWaalsContact OE1-CE1 3.29Å; E1081-H1083 IonicContact OE1-NE2 2.88Å; E1081-H1083 PolarHBondContact OE1-NE2 2.94Å; E1081-H1083 IonicContact OE2-NE2 3.16Å; H1083-E1115 WeakPolarHBondContact CA-O 3.37Å; H1083-E1115 HydrophobicContact CB-CB 4.43Å; H1083-E1115 PolarHBondContact N-O 3Å; H1083-E1115 CarbonylContact O-C 3.49Å; H1083-E1115 PolarHBondContact O-N 3.01Å; H1083-I1116 WeakPolarHBondContact O-CA 3.38Å; H1083-S1117 PolarHBondContact CD2-OG 3.4Å; H1083-S1117 PolarHBondContact N-O 2.91Å; H1083-S1117 PolarHBondContact NE2-OG 3.24Å; H1083-S1117 PolarHBondContact O-N 3.18Å; H1083-S1117 PolarHBondContact O-OG 2.8Å
1084	V	67.6	Low	58.6	Low	21.4 Å²	21.4	63.1 Å²	63.1	13%	0.13	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	105.6	175.7	178.8	0	0	0	0	108.1	I1021 I1082 V1086 I1114 E1115 I1116	I1021-V1084 HydrophobicContact CB-CB 4.22Å; I1021-V1084 HydrophobicContact CB-CG1 4.46Å; I1021-V1084 HydrophobicContact CD1-CG1 4.44Å; I1021-V1084 PolarHBondContact N-O 2.94Å; I1021-V1084 PolarHBondContact O-N 3.15Å; I1082-V1084 HydrophobicContact CG2-CG2 3.82Å; V1084-V1086 HydrophobicContact CG1-CG2 3.85Å; V1084-I1114 HydrophobicContact CB-CG2 4.47Å; V1084-I1114 HydrophobicContact CG1-CB 4.46Å; V1084-I1114 HydrophobicContact CG1-CG1 4.11Å; V1084-I1114 HydrophobicContact CG1-CG2 3.7Å; V1084-I1114 HydrophobicContact CG2-CG1 4.32Å; V1084-I1114 HydrophobicContact CG2-CG2 4.26Å; V1084-E1115 CarbonylContact C-O 3.41Å; V1084-E1115 WeakPolarHBondContact CA-O 3.34Å; V1084-I1116 HydrophobicContact CG1-CG1 4.35Å; V1084-I1116 HydrophobicContact CG2-CG1 4.15Å; V1084-I1116 HydrophobicContact CG2-CG2 4.4Å
1085	D	63	Low	56.9	Low	49.4 Å²	49.4	67.2 Å²	67.2	26%	0.264	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	117.6	172.8	-75.8	-16.7	0	0	0	108.9	L1018 Q1020 S1113 E1115	L1018-D1085 HydrophobicContact CD2-CB 3.69Å; Q1020-D1085 WeakPolarHBondContact CA-OD1 3.31Å; Q1020-D1085 WeakPolarHBondContact CB-OD1 3.4Å; Q1020-D1085 WeakPolarHBondContact CG-OD1 3.44Å; Q1020-D1085 PolarHBondContact NE2-OD1 2.86Å; D1085-S1113 CarbonylContact C-O 3.54Å; D1085-S1113 WeakPolarHBondContact CB-OG 3.36Å; D1085-S1113 PolarHBondContact N-O 2.86Å; D1085-S1113 PolarHBondContact O-N 3.18Å; D1085-S1113 VanDerWaalsContact O-N 3.13Å; D1085-S1113 VanDerWaalsContact O-O 3.09Å; D1085-S1113 PolarHBondContact O-OG 3.12Å; D1085-E1115 HydrophobicContact CB-CB 4.26Å; D1085-E1115 PolarHBondContact N-O 2.87Å; D1085-E1115 PolarHBondContact O-N 3.01Å
1086	V	61.3	Low	54.9	Low	15 Å²	15	72.4 Å²	72.4	9%	0.091	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	108.3	178.1	-175.6	0	0	0	0	108.7	L1018 S1019 V1084 L1088 L1110 R1112 I1114	L1018-V1086 HydrophobicContact CB-CB 4.27Å; L1018-V1086 HydrophobicContact CB-CG1 4.2Å; L1018-V1086 HydrophobicContact CD2-CB 3.96Å; L1018-V1086 HydrophobicContact CD2-CG1 3.98Å; L1018-V1086 HydrophobicContact CD2-CG2 3.81Å; L1018-V1086 HydrophobicContact CG-CB 4.4Å; L1018-V1086 PolarHBondContact N-O 2.81Å; L1018-V1086 CarbonylContact O-C 3.58Å; S1019-V1086 PolarHBondContact N-O 2.92Å; S1019-V1086 PolarHBondContact O-N 3.02Å; S1019-V1086 WeakPolarHBondContact OG-CB 3.38Å; S1019-V1086 PolarHBondContact OG-O 3.43Å; V1084-V1086 HydrophobicContact CG1-CG2 3.85Å; V1086-L1088 HydrophobicContact CG1-CD1 4.11Å; V1086-L1088 HydrophobicContact CG1-CG 4.41Å; V1086-L1088 PolarHBondContact O-N 2.76Å; V1086-L1110 HydrophobicContact CB-CD1 4.42Å; V1086-L1110 HydrophobicContact CG1-CB 4.27Å; V1086-L1110 HydrophobicContact CG1-CD1 3.89Å; V1086-L1110 HydrophobicContact CG1-CD2 3.28Å; V1086-L1110 HydrophobicContact CG1-CG 3.86Å; V1086-L1110 HydrophobicContact CG2-CD1 3.79Å; V1086-R1112 HydrophobicContact CG1-CG 4.33Å; V1086-I1114 HydrophobicContact CG2-CG1 4.44Å
1087	K	53.6	Low	52.6	Low	125.8 Å²	125.8	81.2 Å²	81.2	55%	0.547	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	118.3	172.3	-68	179.3	-178.9	175.1	0	108.9	L1018 E1111 S1113 E1115	L1018-K1087 HydrophobicContact CD1-CG 4.25Å; L1018-K1087 HydrophobicContact CD2-CD 4.43Å; L1018-K1087 HydrophobicContact CD2-CG 3.86Å; L1018-K1087 HydrophobicContact CG-CG 3.74Å; K1087-E1111 PolarHBondContact N-O 3.43Å; K1087-E1111 VanDerWaalsContact O-O 3.09Å; K1087-S1113 WeakPolarHBondContact CB-OG 3.21Å; K1087-S1113 PolarHBondContact N-O 2.95Å; K1087-S1113 PolarHBondContact O-N 3.47Å; K1087-S1113 VanDerWaalsContact O-N 3.12Å; K1087-E1115 IonicContact NZ-OE2 3.07Å
1088	L	50	Low	50.3	Low	39.6 Å²	39.6	83.8 Å²	83.8	21%	0.207	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-92.1	136.1	168	-76.6	97.8	0	0	0	109	L1015 L1018 V1086 V1092 L1110	L1015-L1088 HydrophobicContact CB-CD2 4.17Å; L1015-L1088 HydrophobicContact CD2-CD1 3.66Å; L1015-L1088 VanDerWaalsContact CD2-CD1 3.48Å; L1015-L1088 HydrophobicContact CD2-CD2 3.94Å; L1015-L1088 HydrophobicContact CD2-CG 4.41Å; L1015-L1088 HydrophobicContact CG-CD1 4.04Å; L1015-L1088 HydrophobicContact CG-CD2 4.18Å; L1018-L1088 HydrophobicContact CB-CD1 3.86Å; L1018-L1088 VanDerWaalsContact CB-CD1 3.47Å; V1086-L1088 HydrophobicContact CG1-CD1 4.11Å; V1086-L1088 HydrophobicContact CG1-CG 4.41Å; V1086-L1088 PolarHBondContact O-N 2.76Å; L1088-V1092 HydrophobicContact CB-CG2 4.41Å; L1088-V1092 HydrophobicContact CD2-CG2 4.43Å; L1088-L1110 HydrophobicContact CB-CD2 4.25Å; L1088-L1110 HydrophobicContact CD1-CD1 4.36Å; L1088-L1110 HydrophobicContact CD1-CD2 4.12Å; L1088-L1110 HydrophobicContact CD2-CD2 4.15Å; L1088-L1110 HydrophobicContact CG-CD1 4.16Å; L1088-L1110 HydrophobicContact CG-CD2 4.07Å
1089	P	45.3	Very low	48.1	Very low	45.6 Å²	45.6	88.3 Å²	88.3	30%	0.296	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-72.8	149.3	175.4	27	-31.1	0	0	0	111.9	Q1091 V1092 L1110 E1111	P1089-Q1091 VanDerWaalsContact C-N 3.27Å; P1089-Q1091 PolarHBondContact O-N 3.05Å; P1089-V1092 HydrophobicContact CG-CG2 3.89Å; P1089-V1092 WeakPolarHBondContact O-CG2 3.49Å; P1089-L1110 HydrophobicContact CB-CD2 3.55Å; P1089-L1110 HydrophobicContact CG-CB 3.5Å; P1089-L1110 HydrophobicContact CG-CD2 3.92Å; P1089-L1110 HydrophobicContact CG-CG 3.82Å; P1089-E1111 WeakPolarHBondContact CD-O 3.26Å; P1089-E1111 HydrophobicContact CG-CB 3.8Å; P1089-E1111 HydrophobicContact CG-CG 4.47Å; P1089-E1111 WeakPolarHBondContact CG-O 2.93Å; P1089-E1111 WeakPolarHBondContact CG-OE2 3.44Å
1090	D	43.1	Very low	46.1	Very low	132.4 Å²	132.4	93.9 Å²	93.9	71%	0.708	46%	0.46	S	S	*	.	S	Bend	trans	-63.8	-3.1	-167.7	-73.3	-46.8	0	0	0	116.8	K1014 V1092	K1014-D1090 WeakPolarHBondContact CE-O 3.33Å; K1014-D1090 PolarHBondContact NZ-O 3.16Å; K1014-D1090 VanDerWaalsContact NZ-O 3.1Å; K1014-D1090 IonicContact NZ-OD1 2.66Å; K1014-D1090 PolarHBondContact NZ-OD1 2.84Å; D1090-V1092 PolarHBondContact O-N 2.8Å
1091	Q	38	Very low	44.2	Very low	174 Å²	174	97.7 Å²	97.7	81%	0.813	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119	38.9	-174.3	-73.3	-167.8	-0.2	0	0	114.9	P1089 R1093 L1110	P1089-Q1091 VanDerWaalsContact C-N 3.27Å; P1089-Q1091 PolarHBondContact O-N 3.05Å; Q1091-R1093 PolarHBondContact O-N 3.01Å; Q1091-L1110 HydrophobicContact CB-CD2 4.04Å; Q1091-L1110 WeakPolarHBondContact O-CD1 3.38Å
1092	V	37.1	Very low	42.1	Very low	57.4 Å²	57.4	100.1 Å²	100.1	35%	0.348	49%	0.489	S	S	.	.			trans	-91.3	85	172	-172.1	0	0	0	0	111.6	K1014 L1088 P1089 D1090 L1094 L1110	K1014-V1092 VanDerWaalsContact CE-O 3.22Å; K1014-V1092 WeakPolarHBondContact CE-O 3.22Å; K1014-V1092 WeakPolarHBondContact CG-O 3.31Å; L1088-V1092 HydrophobicContact CB-CG2 4.41Å; L1088-V1092 HydrophobicContact CD2-CG2 4.43Å; P1089-V1092 HydrophobicContact CG-CG2 3.89Å; P1089-V1092 WeakPolarHBondContact O-CG2 3.49Å; D1090-V1092 PolarHBondContact O-N 2.8Å; V1092-L1094 VanDerWaalsContact C-N 3.28Å; V1092-L1094 HydrophobicContact CG1-CB 3.83Å; V1092-L1094 HydrophobicContact CG1-CD1 4.1Å; V1092-L1094 HydrophobicContact CG1-CG 4.26Å; V1092-L1094 PolarHBondContact O-N 2.96Å; V1092-L1094 VanDerWaalsContact O-N 3.1Å; V1092-L1110 HydrophobicContact CG2-CD2 4.42Å
1093	R	30.3	Very low	40.2	Very low	193 Å²	193	103 Å²	103	73%	0.728	51%	0.51	S	S	*	.			trans	-76.1	89.7	170.2	-87.6	179.2	175	166.3	-1.9	111.1	Q1011 Q1091 F1095	Q1011-R1093 VanDerWaalsContact OE1-CZ 3.23Å; Q1091-R1093 PolarHBondContact O-N 3.01Å; R1093-F1095 VanDerWaalsContact C-N 3.27Å; R1093-F1095 PolarHBondContact O-N 3.45Å
1094	L	31	Very low	38.4	Very low	93.6 Å²	93.6	105.8 Å²	105.8	49%	0.49	53%	0.526	S	S	.	.			trans	-123.7	100.5	172.5	-110.6	130.1	0	0	0	114.3	P1012 L1015 V1092 F1096 L1108	P1012-L1094 VanDerWaalsContact CB-O 3.25Å; P1012-L1094 WeakPolarHBondContact CB-O 3.43Å; P1012-L1094 HydrophobicContact CG-CB 4.21Å; P1012-L1094 WeakPolarHBondContact CG-O 3.29Å; L1015-L1094 HydrophobicContact CB-CD1 4.31Å; V1092-L1094 VanDerWaalsContact C-N 3.28Å; V1092-L1094 HydrophobicContact CG1-CB 3.83Å; V1092-L1094 HydrophobicContact CG1-CD1 4.1Å; V1092-L1094 HydrophobicContact CG1-CG 4.26Å; V1092-L1094 PolarHBondContact O-N 2.96Å; V1092-L1094 VanDerWaalsContact O-N 3.1Å; L1094-F1096 HydrophobicContact CD2-CD2 3.65Å; L1094-F1096 HydrophobicContact CD2-CE2 3.71Å; L1094-F1096 HydrophobicContact CG-CD2 4.18Å; L1094-F1096 PolarHBondContact O-N 3.2Å; L1094-F1096 VanDerWaalsContact O-N 3.11Å; L1094-L1108 HydrophobicContact CD1-CD1 4.36Å; L1094-L1108 HydrophobicContact CD2-CD1 4.34Å
1095	F	27.6	Very low	36.5	Very low	175 Å²	175	109.5 Å²	109.5	77%	0.768	55%	0.545	S	S	*	.			trans	-66.5	97.6	174.5	-92.5	-86.8	0	0	0	113.7	R1093 K1097	R1093-F1095 VanDerWaalsContact C-N 3.27Å; R1093-F1095 PolarHBondContact O-N 3.45Å; F1095-K1097 HydrophobicContact CD1-CB 4.18Å; F1095-K1097 HydrophobicContact CD1-CG 4.49Å; F1095-K1097 PolarHBondContact O-N 3.01Å
1096	F	27.8	Very low	34.9	Very low	143 Å²	143	113.8 Å²	113.8	63%	0.627	56%	0.561	S	S	*	*			trans	-88.1	43.4	172.8	-120	-89	0	0	0	112.5	F1003 P1012 L1013 L1094 C1098 F1106	F1003-F1096 AromaticContact CD1-CE2 3.99Å; F1003-F1096 HydrophobicContact CD1-CE2 4.16Å; F1003-F1096 HydrophobicContact CD1-CZ 4.07Å; F1003-F1096 AromaticContact CE1-CE2 3.96Å; F1003-F1096 HydrophobicContact CE1-CE2 4Å; F1003-F1096 AromaticContact CE1-CZ 3.83Å; F1003-F1096 HydrophobicContact CE1-CZ 4.06Å; F1003-F1096 HydrophobicContact CZ-CE2 4.46Å; F1003-F1096 HydrophobicContact CZ-CZ 4.35Å; P1012-F1096 HydrophobicContact CB-CB 3.72Å; P1012-F1096 HydrophobicContact CG-CB 4.2Å; L1013-F1096 HydrophobicContact CB-CD2 4.07Å; L1013-F1096 HydrophobicContact CB-CE2 4.05Å; L1013-F1096 HydrophobicContact CD1-CD2 4.27Å; L1013-F1096 HydrophobicContact CD1-CE2 3.73Å; L1013-F1096 HydrophobicContact CD1-CZ 4.17Å; L1013-F1096 HydrophobicContact CG-CE2 4.43Å; L1094-F1096 HydrophobicContact CD2-CD2 3.65Å; L1094-F1096 HydrophobicContact CD2-CE2 3.71Å; L1094-F1096 HydrophobicContact CG-CD2 4.18Å; L1094-F1096 PolarHBondContact O-N 3.2Å; L1094-F1096 VanDerWaalsContact O-N 3.11Å; F1096-C1098 PolarHBondContact O-N 2.63Å; F1096-F1106 HydrophobicContact CE1-CE2 4.48Å; F1096-F1106 AromaticContact CE1-CZ 3.9Å; F1096-F1106 HydrophobicContact CE1-CZ 3.9Å; F1096-F1106 HydrophobicContact CZ-CE1 4.3Å; F1096-F1106 HydrophobicContact CZ-CE2 4.41Å; F1096-F1106 AromaticContact CZ-CZ 3.8Å; F1096-F1106 HydrophobicContact CZ-CZ 3.8Å
1097	K	26.7	Very low	33.3	Very low	190.4 Å²	190.4	120.6 Å²	120.6	83%	0.828	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103	33.7	175.1	-113.1	-174.8	178.8	-175.9	0	112.3	F1095	F1095-K1097 HydrophobicContact CD1-CB 4.18Å; F1095-K1097 HydrophobicContact CD1-CG 4.49Å; F1095-K1097 PolarHBondContact O-N 3.01Å
1098	C	27.8	Very low	32.2	Very low	95 Å²	95	118 Å²	118	64%	0.642	58%	0.581	S	S	*	*	S	Bend	trans	-169.9	75.6	-179.3	-70.9	0	0	0	0	116.1	F1096 I1100 L1101 H1102	F1096-C1098 PolarHBondContact O-N 2.63Å; C1098-I1100 PolarHBondContact O-N 2.98Å; C1098-L1101 PolarHBondContact O-N 2.96Å; C1098-H1102 HydrophobicContact CB-CB 4.33Å; C1098-H1102 VanDerWaalsContact O-CB 3.26Å; C1098-H1102 WeakPolarHBondContact O-CB 3.34Å; C1098-H1102 PolarHBondContact O-N 2.98Å
1099	L	28.2	Very low	31.3	Very low	116.4 Å²	116.4	119.6 Å²	119.6	61%	0.609	60%	0.596	S	S	*	*			trans	25.8	58.1	163.1	-150.6	71.6	0	0	0	116.5	F1003 L1101 H1102 C1103	F1003-L1099 HydrophobicContact CE1-CD2 3.89Å; F1003-L1099 HydrophobicContact CZ-CD2 3.97Å; L1099-L1101 VanDerWaalsContact C-N 3.25Å; L1099-L1101 PolarHBondContact O-N 3.1Å; L1099-H1102 PolarHBondContact O-N 3.05Å; L1099-C1103 VanDerWaalsContact O-CB 3.27Å; L1099-C1103 WeakPolarHBondContact O-CB 3.46Å; L1099-C1103 PolarHBondContact O-N 2.85Å; L1099-C1103 PolarHBondContact O-SG 3.06Å; L1099-C1103 VanDerWaalsContact O-SG 3.35Å
1100	I	31.2	Very low	30.9	Very low	144.4 Å²	144.4	118.3 Å²	118.3	74%	0.741	59%	0.586	S	S	*	*	H	α-helix	trans	-51.9	-19.8	171.9	-68.1	167	0	0	0	114.1	C1098	C1098-I1100 PolarHBondContact O-N 2.98Å
1101	L	28.7	Very low	30.7	Very low	120.6 Å²	120.6	116.4 Å²	116.4	63%	0.631	57%	0.573	S	S	*	*	H	α-helix	trans	-98.8	-14.8	174.1	-152.6	70.1	0	0	0	115.4	C1098 L1099 C1103 L1105	C1098-L1101 PolarHBondContact O-N 2.96Å; L1099-L1101 VanDerWaalsContact C-N 3.25Å; L1099-L1101 PolarHBondContact O-N 3.1Å; L1101-C1103 VanDerWaalsContact C-N 3.32Å; L1101-L1105 HydrophobicContact CD1-CD1 4.46Å; L1101-L1105 HydrophobicContact CG-CD1 4.2Å; L1101-L1105 WeakPolarHBondContact O-CD1 3.48Å; L1101-L1105 PolarHBondContact O-N 2.89Å
1102	H	28.3	Very low	31.3	Very low	101.2 Å²	101.2	111.5 Å²	111.5	47%	0.469	55%	0.547	S	S	.	.	H	α-helix	trans	-98.3	0.2	-178.7	-145.4	-125.4	0	0	0	114.2	C1098 L1099 L1104 L1105 F1106 K1107 L1108	C1098-H1102 HydrophobicContact CB-CB 4.33Å; C1098-H1102 VanDerWaalsContact O-CB 3.26Å; C1098-H1102 WeakPolarHBondContact O-CB 3.34Å; C1098-H1102 PolarHBondContact O-N 2.98Å; L1099-H1102 PolarHBondContact O-N 3.05Å; H1102-L1104 PolarHBondContact O-N 3.31Å; H1102-L1104 VanDerWaalsContact O-N 3.14Å; H1102-L1105 PolarHBondContact O-N 3.02Å; H1102-F1106 HydrophobicContact CB-CE2 4.44Å; H1102-F1106 WeakPolarHBondContact O-CD2 3.49Å; H1102-F1106 WeakPolarHBondContact O-CE2 3.49Å; H1102-K1107 PolarHBondContact CE1-O 2.82Å; H1102-L1108 WeakPolarHBondContact ND1-CD2 3.16Å
1103	C	28.7	Very low	32.1	Very low	81.6 Å²	81.6	110.4 Å²	110.4	55%	0.551	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-15.7	179.3	-74.1	0	0	0	0	114.6	L1099 L1101 L1105 F1106	L1099-C1103 VanDerWaalsContact O-CB 3.27Å; L1099-C1103 WeakPolarHBondContact O-CB 3.46Å; L1099-C1103 PolarHBondContact O-N 2.85Å; L1099-C1103 PolarHBondContact O-SG 3.06Å; L1099-C1103 VanDerWaalsContact O-SG 3.35Å; L1101-C1103 VanDerWaalsContact C-N 3.32Å; C1103-L1105 VanDerWaalsContact C-N 3.26Å; C1103-L1105 PolarHBondContact O-N 3.11Å; C1103-L1105 VanDerWaalsContact O-N 3.13Å; C1103-F1106 VanDerWaalsContact CA-CD2 3.49Å; C1103-F1106 HydrophobicContact CB-CB 4.31Å; C1103-F1106 HydrophobicContact CB-CD2 4.13Å; C1103-F1106 HydrophobicContact CB-CE2 4.39Å; C1103-F1106 WeakPolarHBondContact SG-CD2 3.47Å
1104	L	30.3	Very low	33.4	Very low	107.8 Å²	107.8	103.2 Å²	103.2	56%	0.564	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-15.3	175.5	-118.1	155.4	0	0	0	114.2	L915 L978 H1102	L915-L1104 HydrophobicContact CD1-CD1 4.3Å; L915-L1104 HydrophobicContact CD2-CD1 3.6Å; L915-L1104 HydrophobicContact CD2-CD2 3.52Å; L915-L1104 HydrophobicContact CD2-CG 4.2Å; L978-L1104 HydrophobicContact CD2-CD2 4.44Å; H1102-L1104 PolarHBondContact O-N 3.31Å; H1102-L1104 VanDerWaalsContact O-N 3.14Å
1105	L	27.8	Very low	34.7	Very low	97.8 Å²	97.8	101.5 Å²	101.5	51%	0.512	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.4	29.9	-168.3	-93.2	151.5	0	0	0	115	L1101 H1102 C1103 K1107 W1142	L1101-L1105 HydrophobicContact CD1-CD1 4.46Å; L1101-L1105 HydrophobicContact CG-CD1 4.2Å; L1101-L1105 WeakPolarHBondContact O-CD1 3.48Å; L1101-L1105 PolarHBondContact O-N 2.89Å; H1102-L1105 PolarHBondContact O-N 3.02Å; C1103-L1105 VanDerWaalsContact C-N 3.26Å; C1103-L1105 PolarHBondContact O-N 3.11Å; C1103-L1105 VanDerWaalsContact O-N 3.13Å; L1105-K1107 VanDerWaalsContact C-N 3.29Å; L1105-K1107 PolarHBondContact O-N 3.17Å; L1105-K1107 VanDerWaalsContact O-N 3.15Å; L1105-W1142 HydrophobicContact CB-CH2 3.52Å; L1105-W1142 HydrophobicContact CB-CZ2 3.71Å; L1105-W1142 VanDerWaalsContact CB-CZ2 3.42Å; L1105-W1142 HydrophobicContact CB-CZ3 4.26Å; L1105-W1142 HydrophobicContact CD1-CE3 4.49Å; L1105-W1142 HydrophobicContact CD1-CH2 3.4Å; L1105-W1142 HydrophobicContact CD1-CZ2 3.9Å; L1105-W1142 VanDerWaalsContact CD1-CZ2 3.48Å; L1105-W1142 HydrophobicContact CD1-CZ3 3.87Å; L1105-W1142 HydrophobicContact CD2-CD2 4.33Å; L1105-W1142 HydrophobicContact CD2-CH2 3.96Å; L1105-W1142 HydrophobicContact CD2-CZ2 3.62Å; L1105-W1142 HydrophobicContact CD2-CZ3 4.43Å; L1105-W1142 HydrophobicContact CG-CH2 4.11Å; L1105-W1142 HydrophobicContact CG-CZ2 4.15Å; L1105-W1142 HydrophobicContact CG-CZ3 4.46Å; L1105-W1142 WeakPolarHBondContact O-CZ2 3.4Å
1106	F	30.4	Very low	36.4	Very low	139.4 Å²	139.4	94.5 Å²	94.5	61%	0.611	48%	0.477	S	S	*	.			trans	-32.4	74.4	165.2	-100.6	-91.1	0	0	0	115.8	F1096 H1102 C1103 L1108 R1112 L1184 W1190	F1096-F1106 HydrophobicContact CE1-CE2 4.48Å; F1096-F1106 AromaticContact CE1-CZ 3.9Å; F1096-F1106 HydrophobicContact CE1-CZ 3.9Å; F1096-F1106 HydrophobicContact CZ-CE1 4.3Å; F1096-F1106 HydrophobicContact CZ-CE2 4.41Å; F1096-F1106 AromaticContact CZ-CZ 3.8Å; F1096-F1106 HydrophobicContact CZ-CZ 3.8Å; H1102-F1106 HydrophobicContact CB-CE2 4.44Å; H1102-F1106 WeakPolarHBondContact O-CD2 3.49Å; H1102-F1106 WeakPolarHBondContact O-CE2 3.49Å; C1103-F1106 VanDerWaalsContact CA-CD2 3.49Å; C1103-F1106 HydrophobicContact CB-CB 4.31Å; C1103-F1106 HydrophobicContact CB-CD2 4.13Å; C1103-F1106 HydrophobicContact CB-CE2 4.39Å; C1103-F1106 WeakPolarHBondContact SG-CD2 3.47Å; F1106-L1108 VanDerWaalsContact C-N 3.26Å; F1106-L1108 HydrophobicContact CB-CG 4.47Å; F1106-L1108 PolarHBondContact O-N 3.29Å; F1106-R1112 PolarHBondContact O-NH1 3.1Å; F1106-L1184 HydrophobicContact CE1-CD2 3.75Å; F1106-L1184 HydrophobicContact CZ-CD2 3.95Å; F1106-W1190 AromaticContact CD1-CH2 3.5Å; F1106-W1190 HydrophobicContact CD1-CH2 3.5Å; F1106-W1190 HydrophobicContact CD1-CZ3 4.01Å; F1106-W1190 AromaticContact CE1-CH2 3.58Å; F1106-W1190 HydrophobicContact CE1-CH2 3.58Å; F1106-W1190 AromaticContact CE1-CZ3 3.56Å; F1106-W1190 HydrophobicContact CE1-CZ3 3.56Å; F1106-W1190 HydrophobicContact CG-CH2 4.5Å; F1106-W1190 HydrophobicContact CZ-CZ3 4.36Å
1107	K	28.3	Very low	38.1	Very low	158.6 Å²	158.6	88.8 Å²	88.8	69%	0.69	46%	0.455	S	S	*	.			trans	-83.6	65.5	167.8	-143.8	-178.2	-178.8	-176.2	0	111.9	H1102 L1105 S1109 H1146 N1188	H1102-K1107 PolarHBondContact CE1-O 2.82Å; L1105-K1107 VanDerWaalsContact C-N 3.29Å; L1105-K1107 PolarHBondContact O-N 3.17Å; L1105-K1107 VanDerWaalsContact O-N 3.15Å; K1107-S1109 VanDerWaalsContact C-N 3.33Å; K1107-S1109 PolarHBondContact O-N 3.26Å; K1107-H1146 WeakPolarHBondContact CD-NE2 3.41Å; K1107-N1188 WeakPolarHBondContact CB-ND2 3.5Å
1108	L	30	Very low	39.7	Very low	71.2 Å²	71.2	79.9 Å²	79.9	37%	0.373	42%	0.417	S	S	.	.			trans	-87	119.8	176	-83.7	158.8	0	0	0	110.2	L1094 H1102 F1106 L1110 R1112 N1188 W1190	L1094-L1108 HydrophobicContact CD1-CD1 4.36Å; L1094-L1108 HydrophobicContact CD2-CD1 4.34Å; H1102-L1108 WeakPolarHBondContact ND1-CD2 3.16Å; F1106-L1108 VanDerWaalsContact C-N 3.26Å; F1106-L1108 HydrophobicContact CB-CG 4.47Å; F1106-L1108 PolarHBondContact O-N 3.29Å; L1108-L1110 HydrophobicContact CB-CB 4.42Å; L1108-L1110 HydrophobicContact CB-CD1 4.01Å; L1108-L1110 HydrophobicContact CB-CG 3.92Å; L1108-L1110 HydrophobicContact CD1-CD1 4.01Å; L1108-L1110 HydrophobicContact CD1-CG 4.42Å; L1108-L1110 HydrophobicContact CD2-CD1 3.83Å; L1108-L1110 HydrophobicContact CD2-CD2 3.83Å; L1108-L1110 HydrophobicContact CD2-CG 3.47Å; L1108-L1110 VanDerWaalsContact CD2-CG 3.47Å; L1108-L1110 HydrophobicContact CG-CD1 4.13Å; L1108-L1110 HydrophobicContact CG-CG 4Å; L1108-L1110 PolarHBondContact O-N 3.31Å; L1108-L1110 VanDerWaalsContact O-N 3.1Å; L1108-R1112 VanDerWaalsContact CB-CZ 3.43Å; L1108-R1112 PolarHBondContact O-NH1 3.39Å; L1108-N1188 PolarHBondContact O-ND2 3.43Å; L1108-N1188 PolarHBondContact O-OD1 3.12Å; L1108-W1190 WeakPolarHBondContact O-CH2 3.37Å; L1108-W1190 WeakPolarHBondContact O-CZ3 3.42Å
1109	S	31.2	Very low	41	Very low	72.4 Å²	72.4	79.2 Å²	79.2	51%	0.506	41%	0.407	S	S	.	.			trans	-69.8	91.7	169.4	128.6	0	0	0	0	109.5	K1107 N1188 W1190	K1107-S1109 VanDerWaalsContact C-N 3.33Å; K1107-S1109 PolarHBondContact O-N 3.26Å; S1109-N1188 VanDerWaalsContact CA-OD1 3.28Å; S1109-N1188 WeakPolarHBondContact CA-OD1 3.27Å; S1109-N1188 PolarHBondContact N-OD1 2.9Å; S1109-W1190 VanDerWaalsContact C-CZ3 3.42Å; S1109-W1190 VanDerWaalsContact CA-CZ3 3.5Å
1110	L	36.4	Very low	42.3	Very low	19 Å²	19	78.5 Å²	78.5	10%	0.099	40%	0.403	C	S	.	.			trans	-136.8	130.1	176.4	-71.9	160.3	0	0	0	110.6	L1018 V1086 L1088 P1089 Q1091 V1092 L1108 R1112 S1187 G1189 W1190	L1018-L1110 HydrophobicContact CD2-CD2 4.29Å; V1086-L1110 HydrophobicContact CB-CD1 4.42Å; V1086-L1110 HydrophobicContact CG1-CB 4.27Å; V1086-L1110 HydrophobicContact CG1-CD1 3.89Å; V1086-L1110 HydrophobicContact CG1-CD2 3.28Å; V1086-L1110 HydrophobicContact CG1-CG 3.86Å; V1086-L1110 HydrophobicContact CG2-CD1 3.79Å; L1088-L1110 HydrophobicContact CB-CD2 4.25Å; L1088-L1110 HydrophobicContact CD1-CD1 4.36Å; L1088-L1110 HydrophobicContact CD1-CD2 4.12Å; L1088-L1110 HydrophobicContact CD2-CD2 4.15Å; L1088-L1110 HydrophobicContact CG-CD1 4.16Å; L1088-L1110 HydrophobicContact CG-CD2 4.07Å; P1089-L1110 HydrophobicContact CB-CD2 3.55Å; P1089-L1110 HydrophobicContact CG-CB 3.5Å; P1089-L1110 HydrophobicContact CG-CD2 3.92Å; P1089-L1110 HydrophobicContact CG-CG 3.82Å; Q1091-L1110 HydrophobicContact CB-CD2 4.04Å; Q1091-L1110 WeakPolarHBondContact O-CD1 3.38Å; V1092-L1110 HydrophobicContact CG2-CD2 4.42Å; L1108-L1110 HydrophobicContact CB-CB 4.42Å; L1108-L1110 HydrophobicContact CB-CD1 4.01Å; L1108-L1110 HydrophobicContact CB-CG 3.92Å; L1108-L1110 HydrophobicContact CD1-CD1 4.01Å; L1108-L1110 HydrophobicContact CD1-CG 4.42Å; L1108-L1110 HydrophobicContact CD2-CD1 3.83Å; L1108-L1110 HydrophobicContact CD2-CD2 3.83Å; L1108-L1110 HydrophobicContact CD2-CG 3.47Å; L1108-L1110 VanDerWaalsContact CD2-CG 3.47Å; L1108-L1110 HydrophobicContact CG-CD1 4.13Å; L1108-L1110 HydrophobicContact CG-CG 4Å; L1108-L1110 PolarHBondContact O-N 3.31Å; L1108-L1110 VanDerWaalsContact O-N 3.1Å; L1110-R1112 HydrophobicContact CB-CG 4.23Å; L1110-R1112 WeakPolarHBondContact O-CG 3.37Å; L1110-R1112 PolarHBondContact O-N 3.23Å; L1110-S1187 CarbonylContact C-O 3.54Å; L1110-S1187 PolarHBondContact N-O 3.46Å; L1110-G1189 PolarHBondContact O-N 2.86Å; L1110-W1190 VanDerWaalsContact CA-CZ3 3.4Å; L1110-W1190 HydrophobicContact CB-CZ3 4.03Å; L1110-W1190 VanDerWaalsContact O-CH2 3.3Å; L1110-W1190 WeakPolarHBondContact O-CH2 3.44Å; L1110-W1190 WeakPolarHBondContact O-CZ3 3.43Å
1111	E	39.3	Very low	43.7	Very low	92 Å²	92	77.2 Å²	77.2	43%	0.43	39%	0.394	S	S	.	.			trans	-69.3	114.7	166.9	-89.4	-174.7	157.5	0	0	109.6	K1087 P1089 S1187 G1189 W1190	K1087-E1111 PolarHBondContact N-O 3.43Å; K1087-E1111 VanDerWaalsContact O-O 3.09Å; P1089-E1111 WeakPolarHBondContact CD-O 3.26Å; P1089-E1111 HydrophobicContact CG-CB 3.8Å; P1089-E1111 HydrophobicContact CG-CG 4.47Å; P1089-E1111 WeakPolarHBondContact CG-O 2.93Å; P1089-E1111 WeakPolarHBondContact CG-OE2 3.44Å; E1111-S1187 VanDerWaalsContact CD-O 3.31Å; E1111-S1187 WeakPolarHBondContact CG-O 3.35Å; E1111-S1187 VanDerWaalsContact OE1-CB 3.29Å; E1111-S1187 WeakPolarHBondContact OE1-CB 3.48Å; E1111-S1187 PolarHBondContact OE1-OG 3.1Å; E1111-G1189 WeakPolarHBondContact CA-O 3.3Å; E1111-G1189 WeakPolarHBondContact CG-O 3.37Å; E1111-W1190 HydrophobicContact CG-CH2 4.4Å; E1111-W1190 HydrophobicContact CG-CZ2 4.34Å
1112	R	51.1	Low	45.4	Very low	71 Å²	71	73.5 Å²	73.5	27%	0.268	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	124.6	178.5	-69.8	176.4	175.9	-173.6	-4.9	111.8	V1086 F1106 L1108 L1110 S1187 G1189 W1190 H1191	V1086-R1112 HydrophobicContact CG1-CG 4.33Å; F1106-R1112 PolarHBondContact O-NH1 3.1Å; L1108-R1112 VanDerWaalsContact CB-CZ 3.43Å; L1108-R1112 PolarHBondContact O-NH1 3.39Å; L1110-R1112 HydrophobicContact CB-CG 4.23Å; L1110-R1112 WeakPolarHBondContact O-CG 3.37Å; L1110-R1112 PolarHBondContact O-N 3.23Å; R1112-S1187 PolarHBondContact NH2-O 2.87Å; R1112-S1187 PolarHBondContact NH2-OG 2.81Å; R1112-G1189 WeakPolarHBondContact CG-O 3.35Å; R1112-G1189 PolarHBondContact N-O 3.06Å; R1112-G1189 VanDerWaalsContact N-O 3.16Å; R1112-G1189 PolarHBondContact NE-O 3.47Å; R1112-G1189 VanDerWaalsContact NE-O 3.12Å; R1112-W1190 HydrophobicContact CB-CD2 4.19Å; R1112-W1190 HydrophobicContact CB-CE3 4.04Å; R1112-W1190 HydrophobicContact CB-CZ3 4.24Å; R1112-W1190 VanDerWaalsContact NH1-CZ2 3.3Å; R1112-W1190 CarbonylContact O-C 3.53Å; R1112-W1190 VanDerWaalsContact O-CA 3.27Å; R1112-W1190 WeakPolarHBondContact O-CA 3.32Å; R1112-H1191 HydrophobicContact CG-CB 4.39Å; R1112-H1191 WeakPolarHBondContact O-CA 3.35Å; R1112-H1191 PolarHBondContact O-N 2.99Å; R1112-H1191 VanDerWaalsContact O-O 3.08Å
1113	S	52.8	Low	47.5	Very low	34.8 Å²	34.8	68.8 Å²	68.8	24%	0.243	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	114.9	174.1	51	0	0	0	0	111.6	D1085 K1087 H1191	D1085-S1113 CarbonylContact C-O 3.54Å; D1085-S1113 WeakPolarHBondContact CB-OG 3.36Å; D1085-S1113 PolarHBondContact N-O 2.86Å; D1085-S1113 PolarHBondContact O-N 3.18Å; D1085-S1113 VanDerWaalsContact O-N 3.13Å; D1085-S1113 VanDerWaalsContact O-O 3.09Å; D1085-S1113 PolarHBondContact O-OG 3.12Å; K1087-S1113 WeakPolarHBondContact CB-OG 3.21Å; K1087-S1113 PolarHBondContact N-O 2.95Å; K1087-S1113 PolarHBondContact O-N 3.47Å; K1087-S1113 VanDerWaalsContact O-N 3.12Å; S1113-H1191 CarbonylContact C-O 3.48Å; S1113-H1191 VanDerWaalsContact CA-O 3.3Å; S1113-H1191 WeakPolarHBondContact CA-O 3.4Å; S1113-H1191 PolarHBondContact N-O 3.45Å
1114	I	57.9	Low	50	Low	42.8 Å²	42.8	68 Å²	68	22%	0.219	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	115.8	166.3	-62.6	169.2	0	0	0	106.3	I1082 V1084 V1086 I1116 W1190 H1191 L1192 S1193	I1082-I1114 HydrophobicContact CG2-CG2 4.33Å; V1084-I1114 HydrophobicContact CB-CG2 4.47Å; V1084-I1114 HydrophobicContact CG1-CB 4.46Å; V1084-I1114 HydrophobicContact CG1-CG1 4.11Å; V1084-I1114 HydrophobicContact CG1-CG2 3.7Å; V1084-I1114 HydrophobicContact CG2-CG1 4.32Å; V1084-I1114 HydrophobicContact CG2-CG2 4.26Å; V1086-I1114 HydrophobicContact CG2-CG1 4.44Å; I1114-I1116 HydrophobicContact CG2-CD1 4.32Å; I1114-I1116 HydrophobicContact CG2-CG1 4.01Å; I1114-W1190 HydrophobicContact CD1-CE3 3.92Å; I1114-W1190 HydrophobicContact CD1-CZ3 3.93Å; I1114-W1190 HydrophobicContact CG1-CE3 4.1Å; I1114-W1190 HydrophobicContact CG1-CZ3 4.1Å; I1114-H1191 PolarHBondContact N-O 3.25Å; I1114-L1192 HydrophobicContact CB-CD1 3.78Å; I1114-L1192 HydrophobicContact CD1-CD1 4.13Å; I1114-L1192 HydrophobicContact CG1-CD1 4.45Å; I1114-L1192 HydrophobicContact CG2-CD1 3.65Å; I1114-L1192 VanDerWaalsContact CG2-CD1 3.46Å; I1114-L1192 CarbonylContact O-C 3.5Å; I1114-L1192 WeakPolarHBondContact O-CA 3.41Å; I1114-S1193 CarbonylContact O-C 3.54Å; I1114-S1193 WeakPolarHBondContact O-CA 3.4Å; I1114-S1193 PolarHBondContact O-N 3.11Å; I1114-S1193 PolarHBondContact O-OG 3.33Å
1115	E	59	Low	52.6	Low	56.4 Å²	56.4	64.9 Å²	64.9	26%	0.264	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	116.7	172.4	-158.1	149.2	-165.5	0	0	109	H1083 V1084 D1085 K1087 S1193 K1195	H1083-E1115 WeakPolarHBondContact CA-O 3.37Å; H1083-E1115 HydrophobicContact CB-CB 4.43Å; H1083-E1115 PolarHBondContact N-O 3Å; H1083-E1115 CarbonylContact O-C 3.49Å; H1083-E1115 PolarHBondContact O-N 3.01Å; V1084-E1115 CarbonylContact C-O 3.41Å; V1084-E1115 WeakPolarHBondContact CA-O 3.34Å; D1085-E1115 HydrophobicContact CB-CB 4.26Å; D1085-E1115 PolarHBondContact N-O 2.87Å; D1085-E1115 PolarHBondContact O-N 3.01Å; K1087-E1115 IonicContact NZ-OE2 3.07Å; E1115-S1193 CarbonylContact C-O 3.55Å; E1115-S1193 VanDerWaalsContact CA-O 3.3Å; E1115-S1193 WeakPolarHBondContact CA-O 3.29Å; E1115-S1193 WeakPolarHBondContact OE1-CB 3.43Å; E1115-S1193 PolarHBondContact OE1-OG 3.2Å; E1115-S1193 WeakPolarHBondContact OE2-CB 3.42Å; E1115-S1193 PolarHBondContact OE2-OG 3.2Å; E1115-K1195 VanDerWaalsContact OE1-CD 3.3Å; E1115-K1195 WeakPolarHBondContact OE1-CD 3.3Å; E1115-K1195 VanDerWaalsContact OE1-CE 3.26Å; E1115-K1195 WeakPolarHBondContact OE1-CE 3.48Å; E1115-K1195 WeakPolarHBondContact OE1-CG 3.25Å; E1115-K1195 IonicContact OE1-NZ 3.17Å; E1115-K1195 PolarHBondContact OE1-NZ 3.06Å; E1115-K1195 WeakPolarHBondContact OE2-CE 3.26Å; E1115-K1195 IonicContact OE2-NZ 3Å; E1115-K1195 PolarHBondContact OE2-NZ 2.76Å
1116	I	63	Low	55.3	Low	29 Å²	29	62.2 Å²	62.2	15%	0.149	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	111.4	175	-55.6	-179.7	0	0	0	107.8	L1079 I1082 H1083 V1084 I1114 P1118 L1192 S1193 I1194 K1195	L1079-I1116 HydrophobicContact CD2-CG2 4.37Å; I1082-I1116 HydrophobicContact CG1-CG2 4.36Å; I1082-I1116 HydrophobicContact CG2-CG1 4.37Å; I1082-I1116 HydrophobicContact CG2-CG2 3.78Å; H1083-I1116 WeakPolarHBondContact O-CA 3.38Å; V1084-I1116 HydrophobicContact CG1-CG1 4.35Å; V1084-I1116 HydrophobicContact CG2-CG1 4.15Å; V1084-I1116 HydrophobicContact CG2-CG2 4.4Å; I1114-I1116 HydrophobicContact CG2-CD1 4.32Å; I1114-I1116 HydrophobicContact CG2-CG1 4.01Å; I1116-P1118 VanDerWaalsContact O-CD 3.29Å; I1116-P1118 WeakPolarHBondContact O-CD 3.39Å; I1116-L1192 HydrophobicContact CD1-CD1 3.91Å; I1116-L1192 HydrophobicContact CG1-CD1 4.15Å; I1116-S1193 PolarHBondContact N-O 3.11Å; I1116-I1194 HydrophobicContact CB-CB 4.48Å; I1116-I1194 HydrophobicContact CB-CG1 4.32Å; I1116-I1194 HydrophobicContact CB-CG2 4.19Å; I1116-I1194 HydrophobicContact CD1-CD1 4.25Å; I1116-I1194 HydrophobicContact CD1-CG1 4.23Å; I1116-I1194 HydrophobicContact CG1-CG1 4.4Å; I1116-I1194 HydrophobicContact CG2-CG2 4.37Å; I1116-I1194 CarbonylContact O-C 3.33Å; I1116-I1194 WeakPolarHBondContact O-CA 3.3Å; I1116-K1195 CarbonylContact O-C 3.35Å; I1116-K1195 PolarHBondContact O-N 3.15Å; I1116-K1195 VanDerWaalsContact O-N 3.12Å; I1116-K1195 VanDerWaalsContact O-O 3.09Å
1117	S	62	Low	58	Low	22.2 Å²	22.2	56.8 Å²	56.8	16%	0.155	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	92.8	176.8	47.8	0	0	0	0	110	H1083 N1119	H1083-S1117 PolarHBondContact CD2-OG 3.4Å; H1083-S1117 PolarHBondContact N-O 2.91Å; H1083-S1117 PolarHBondContact NE2-OG 3.24Å; H1083-S1117 PolarHBondContact O-N 3.18Å; H1083-S1117 PolarHBondContact O-OG 2.8Å; S1117-N1119 PolarHBondContact O-N 3.29Å; S1117-N1119 VanDerWaalsContact O-N 3.08Å
1118	P	60.7	Low	60.8	Low	4 Å²	4	50.4 Å²	50.4	3%	0.026	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	125.3	171.4	20.7	-21.6	0	0	0	110.2	T1080 E1081 I1116 N1120 P1196 S1199 F1201	T1080-P1118 WeakPolarHBondContact OG1-CA 3.44Å; E1081-P1118 WeakPolarHBondContact O-CA 3.41Å; I1116-P1118 VanDerWaalsContact O-CD 3.29Å; I1116-P1118 WeakPolarHBondContact O-CD 3.39Å; P1118-N1120 PolarHBondContact O-N 3.16Å; P1118-N1120 VanDerWaalsContact O-N 3.12Å; P1118-P1196 HydrophobicContact CG-CB 3.84Å; P1118-S1199 WeakPolarHBondContact CG-OG 3.24Å; P1118-S1199 PolarHBondContact O-OG 3.36Å; P1118-F1201 HydrophobicContact CG-CE2 4.24Å; P1118-F1201 HydrophobicContact CG-CZ 3.94Å
1119	N	55.5	Low	63.4	Low	80 Å²	80	48 Å²	48	43%	0.428	25%	0.251	S	S	.	.			trans	-70.5	127.3	176.8	-125.2	-18.1	0	0	0	110.7	E1081 S1117 Q1121 S1199	E1081-N1119 HydrophobicContact CB-CB 4.23Å; E1081-N1119 HydrophobicContact CG-CB 4.4Å; E1081-N1119 PolarHBondContact O-N 3.4Å; E1081-N1119 WeakPolarHBondContact OE2-CB 3.31Å; E1081-N1119 PolarHBondContact OE2-ND2 2.92Å; E1081-N1119 VanDerWaalsContact OE2-ND2 3.12Å; S1117-N1119 PolarHBondContact O-N 3.29Å; S1117-N1119 VanDerWaalsContact O-N 3.08Å; N1119-Q1121 PolarHBondContact O-N 3.18Å; N1119-S1199 PolarHBondContact O-OG 2.9Å; N1119-S1199 VanDerWaalsContact O-OG 3.04Å
1120	N	54.6	Low	65.8	Low	101.6 Å²	101.6	45.2 Å²	45.2	54%	0.543	23%	0.234	S	C	.	.	S	Bend	trans	12.9	6.7	179.9	-80.7	2.4	0	0	0	120	P1118 I1197 Q1198 S1199	P1118-N1120 PolarHBondContact O-N 3.16Å; P1118-N1120 VanDerWaalsContact O-N 3.12Å; N1120-I1197 VanDerWaalsContact OD1-C 3.28Å; N1120-I1197 WeakPolarHBondContact OD1-CG2 3.28Å; N1120-I1197 PolarHBondContact OD1-O 3.14Å; N1120-Q1198 PolarHBondContact ND2-OE1 2.91Å; N1120-Q1198 WeakPolarHBondContact OD1-CB 3.15Å; N1120-Q1198 PolarHBondContact OD1-OE1 3.14Å; N1120-S1199 WeakPolarHBondContact CA-OG 3.39Å
1121	Q	61.1	Low	68	Low	117.6 Å²	117.6	45 Å²	45	55%	0.55	23%	0.232	S	C	.	.	S	Bend	trans	-109.2	155.4	177.6	-66.1	179.6	-10.9	0	0	111.8	T1080 N1119 C1123 S1199	T1080-Q1121 HydrophobicContact CG2-CB 4.09Å; T1080-Q1121 HydrophobicContact CG2-CG 4.44Å; T1080-Q1121 VanDerWaalsContact CG2-OE1 3.28Å; T1080-Q1121 PolarHBondContact OG1-OE1 3.03Å; N1119-Q1121 PolarHBondContact O-N 3.18Å; Q1121-C1123 PolarHBondContact O-N 3.33Å; Q1121-S1199 VanDerWaalsContact C-OG 3.27Å; Q1121-S1199 PolarHBondContact N-OG 2.78Å; Q1121-S1199 VanDerWaalsContact N-OG 3.11Å; Q1121-S1199 VanDerWaalsContact O-CB 3.24Å; Q1121-S1199 WeakPolarHBondContact O-CB 3.41Å; Q1121-S1199 PolarHBondContact O-OG 3.14Å
1122	S	65.4	Low	70.3	Confident	43.4 Å²	43.4	42.4 Å²	42.4	30%	0.303	22%	0.22	S	C	.	.			trans	-73.5	131.7	176.9	47.3	0	0	0	0	111.6	E1124 Y1200	S1122-E1124 WeakPolarHBondContact CB-OE1 3.35Å; S1122-E1124 PolarHBondContact OG-OE1 2.93Å; S1122-Y1200 VanDerWaalsContact CB-CE2 3.48Å; S1122-Y1200 VanDerWaalsContact CB-OH 3.22Å; S1122-Y1200 WeakPolarHBondContact CB-OH 3.34Å; S1122-Y1200 PolarHBondContact OG-OH 3.02Å
1123	C	72.8	Confident	71.8	Confident	2.6 Å²	2.6	40.2 Å²	40.2	2%	0.018	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	128.3	168.5	-84	0	0	0	0	109.2	L1077 S1078 L1079 Q1121 Y1200 F1201 Q1202	L1077-C1123 VanDerWaalsContact CD1-SG 3.58Å; S1078-C1123 WeakPolarHBondContact O-CA 3.47Å; S1078-C1123 WeakPolarHBondContact O-CB 3.27Å; S1078-C1123 PolarHBondContact O-SG 3.34Å; S1078-C1123 VanDerWaalsContact O-SG 3.34Å; L1079-C1123 HydrophobicContact CD2-CB 3.99Å; L1079-C1123 VanDerWaalsContact CD2-SG 3.53Å; L1079-C1123 WeakPolarHBondContact CD2-SG 3.42Å; Q1121-C1123 PolarHBondContact O-N 3.33Å; C1123-Y1200 PolarHBondContact N-O 3.24Å; C1123-F1201 HydrophobicContact CB-CD1 3.42Å; C1123-F1201 VanDerWaalsContact CB-CD1 3.43Å; C1123-F1201 HydrophobicContact CB-CD2 3.54Å; C1123-F1201 HydrophobicContact CB-CE1 3.41Å; C1123-F1201 HydrophobicContact CB-CE2 3.53Å; C1123-F1201 HydrophobicContact CB-CG 4.28Å; C1123-F1201 HydrophobicContact CB-CZ 4.17Å; C1123-F1201 CarbonylContact O-C 3.5Å; C1123-F1201 WeakPolarHBondContact O-CA 3.34Å; C1123-Q1202 PolarHBondContact O-N 3.24Å
1124	E	79.5	Confident	73.2	Confident	63.8 Å²	63.8	38.7 Å²	38.7	30%	0.298	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	131.5	-179	-67.3	176.7	-173.9	0	0	109.8	L1077 S1078 S1122 Q1202 Y1204	L1077-E1124 CarbonylContact C-O 3.51Å; L1077-E1124 VanDerWaalsContact CA-O 3.31Å; L1077-E1124 WeakPolarHBondContact CA-O 3.24Å; S1078-E1124 PolarHBondContact N-O 2.94Å; S1078-E1124 VanDerWaalsContact N-O 3.12Å; S1078-E1124 PolarHBondContact O-N 2.86Å; S1078-E1124 PolarHBondContact OG-N 2.91Å; S1078-E1124 VanDerWaalsContact OG-N 3.08Å; S1078-E1124 PolarHBondContact OG-O 3.36Å; S1122-E1124 WeakPolarHBondContact CB-OE1 3.35Å; S1122-E1124 PolarHBondContact OG-OE1 2.93Å; E1124-Q1202 WeakPolarHBondContact CA-O 3.28Å; E1124-Q1202 HydrophobicContact CG-CB 4.38Å; E1124-Y1204 HydrophobicContact CB-CE2 4.43Å; E1124-Y1204 HydrophobicContact CG-CE2 4.28Å
1125	F	84.7	Confident	74.3	Confident	43.2 Å²	43.2	38.6 Å²	38.6	19%	0.189	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	121.1	174.1	176.2	-105.8	0	0	0	109.7	V1076 L1077 W1127 F1131 F1201 Q1202 F1203 Y1204	V1076-F1125 HydrophobicContact CG1-CD2 4.29Å; V1076-F1125 HydrophobicContact CG1-CE2 3.96Å; V1076-F1125 CarbonylContact O-C 3.51Å; V1076-F1125 VanDerWaalsContact O-CA 3.27Å; V1076-F1125 WeakPolarHBondContact O-CA 3.33Å; V1076-F1125 VanDerWaalsContact O-CD2 3.31Å; V1076-F1125 WeakPolarHBondContact O-CD2 3.37Å; L1077-F1125 HydrophobicContact CB-CD2 4.27Å; L1077-F1125 HydrophobicContact CD1-CB 4.06Å; L1077-F1125 HydrophobicContact CD1-CD2 3.97Å; L1077-F1125 HydrophobicContact CD1-CG 4.4Å; F1125-W1127 HydrophobicContact CD1-CB 4.31Å; F1125-W1127 HydrophobicContact CE1-CB 3.74Å; F1125-W1127 AromaticContact CE1-CD1 3.98Å; F1125-W1127 HydrophobicContact CE1-CG 4.35Å; F1125-W1127 HydrophobicContact CZ-CB 4.36Å; F1125-F1131 AromaticContact CE2-CE1 3.89Å; F1125-F1131 HydrophobicContact CE2-CE1 3.98Å; F1125-F1131 HydrophobicContact CE2-CZ 4.4Å; F1125-F1131 HydrophobicContact CZ-CD1 4.49Å; F1125-F1131 AromaticContact CZ-CE1 3.88Å; F1125-F1131 HydrophobicContact CZ-CE1 3.88Å; F1125-F1201 HydrophobicContact CB-CE1 3.98Å; F1125-Q1202 PolarHBondContact N-O 3.06Å; F1125-F1203 HydrophobicContact CB-CD1 3.92Å; F1125-F1203 HydrophobicContact CB-CE1 4.28Å; F1125-F1203 AromaticContact CD1-CD1 3.68Å; F1125-F1203 HydrophobicContact CD1-CD1 3.68Å; F1125-F1203 HydrophobicContact CD1-CE1 4.39Å; F1125-F1203 HydrophobicContact CE1-CD1 4.49Å; F1125-F1203 HydrophobicContact CG-CD1 4.13Å; F1125-F1203 CarbonylContact O-C 3.51Å; F1125-F1203 WeakPolarHBondContact O-CA 3.2Å; F1125-Y1204 PolarHBondContact O-N 3.11Å
1126	I	85.1	Confident	75.4	Confident	41.6 Å²	41.6	37.8 Å²	37.8	21%	0.213	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	95.7	-178.7	-54.5	177.8	0	0	0	109	L1075 V1076 Y1204 K1206	L1075-I1126 WeakPolarHBondContact O-CD1 3.46Å; V1076-I1126 PolarHBondContact O-N 3.11Å; I1126-Y1204 CarbonylContact C-O 3.59Å; I1126-Y1204 HydrophobicContact CG1-CD2 4.17Å; I1126-Y1204 HydrophobicContact CG1-CG 4.32Å; I1126-K1206 HydrophobicContact CG2-CD 4.21Å; I1126-K1206 HydrophobicContact CG2-CG 4.41Å
1127	W	88.4	Confident	76.1	Confident	26 Å²	26	39.3 Å²	39.3	10%	0.098	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	133	171.8	-171.3	86.8	0	0	0	111.2	F1125 L1129 H1132 Y1204 F1205 K1206 V1350 L1354	F1125-W1127 HydrophobicContact CD1-CB 4.31Å; F1125-W1127 HydrophobicContact CE1-CB 3.74Å; F1125-W1127 AromaticContact CE1-CD1 3.98Å; F1125-W1127 HydrophobicContact CE1-CG 4.35Å; F1125-W1127 HydrophobicContact CZ-CB 4.36Å; W1127-L1129 HydrophobicContact CH2-CB 4.39Å; W1127-L1129 HydrophobicContact CH2-CD1 4.05Å; W1127-L1129 HydrophobicContact CZ2-CD1 4.49Å; W1127-H1132 AromaticContact CE2-ND1 3.68Å; W1127-H1132 HydrophobicContact CZ2-CB 3.61Å; W1127-H1132 AromaticContact CZ2-CG 3.81Å; W1127-H1132 AromaticContact CZ2-ND1 3.78Å; W1127-H1132 AromaticContact NE1-CG 3.88Å; W1127-H1132 AromaticContact NE1-ND1 3.48Å; W1127-H1132 PolarHBondContact NE1-ND1 3.23Å; W1127-Y1204 WeakPolarHBondContact CA-O 3.41Å; W1127-Y1204 WeakPolarHBondContact CB-O 3.41Å; W1127-Y1204 PolarHBondContact N-O 3.14Å; W1127-F1205 HydrophobicContact CB-CD1 3.69Å; W1127-F1205 HydrophobicContact CB-CE1 4.04Å; W1127-F1205 HydrophobicContact CB-CG 4.41Å; W1127-F1205 AromaticContact CD2-CD1 3.88Å; W1127-F1205 HydrophobicContact CD2-CD1 3.88Å; W1127-F1205 HydrophobicContact CD2-CE1 4.45Å; W1127-F1205 HydrophobicContact CE3-CB 4.29Å; W1127-F1205 AromaticContact CE3-CD1 3.85Å; W1127-F1205 HydrophobicContact CE3-CD1 3.85Å; W1127-F1205 HydrophobicContact CE3-CG 4.48Å; W1127-F1205 AromaticContact CG-CD1 3.84Å; W1127-F1205 HydrophobicContact CG-CD1 3.84Å; W1127-F1205 HydrophobicContact CG-CE1 4.13Å; W1127-K1206 WeakPolarHBondContact CZ3-O 3.36Å; W1127-K1206 PolarHBondContact O-N 3.12Å; W1127-V1350 HydrophobicContact CH2-CG1 3.66Å; W1127-V1350 HydrophobicContact CZ3-CG1 4.05Å; W1127-L1354 HydrophobicContact CH2-CD1 4.11Å; W1127-L1354 HydrophobicContact CZ2-CD1 3.99Å; W1127-L1354 HydrophobicContact CZ2-CD2 4.33Å
1128	S	85.8	Confident	76.8	Confident	24 Å²	24	39.9 Å²	39.9	17%	0.168	21%	0.21	C	C	.	.			trans	-135.5	158.9	168.8	70.9	0	0	0	0	110.4	G1130 F1131 H1132	S1128-G1130 VanDerWaalsContact C-N 3.32Å; S1128-G1130 PolarHBondContact O-N 2.96Å; S1128-F1131 PolarHBondContact O-N 3.01Å; S1128-F1131 VanDerWaalsContact OG-CB 3.31Å; S1128-F1131 WeakPolarHBondContact OG-CB 3.37Å; S1128-F1131 PolarHBondContact OG-N 2.93Å; S1128-F1131 VanDerWaalsContact OG-N 3.15Å; S1128-H1132 PolarHBondContact O-N 3.03Å
1129	L	84.8	Confident	77.7	Confident	21.2 Å²	21.2	44.5 Å²	44.5	11%	0.111	23%	0.233	C	C	.	.	H	α-helix	trans	-63.4	-38.2	179.2	-169.4	64.5	0	0	0	112.3	W1127 H1132 L1133 F1353 L1354 I1619 P1621	W1127-L1129 HydrophobicContact CH2-CB 4.39Å; W1127-L1129 HydrophobicContact CH2-CD1 4.05Å; W1127-L1129 HydrophobicContact CZ2-CD1 4.49Å; L1129-H1132 PolarHBondContact O-N 3.06Å; L1129-L1133 HydrophobicContact CG-CD1 4.44Å; L1129-L1133 WeakPolarHBondContact O-CG 3.34Å; L1129-L1133 PolarHBondContact O-N 2.95Å; L1129-F1353 HydrophobicContact CD1-CD1 3.84Å; L1129-F1353 HydrophobicContact CD1-CE1 3.82Å; L1129-F1353 HydrophobicContact CD2-CD1 4.37Å; L1129-F1353 HydrophobicContact CD2-CE1 4.21Å; L1129-F1353 HydrophobicContact CG-CE1 4.39Å; L1129-L1354 HydrophobicContact CD1-CD2 4.23Å; L1129-I1619 HydrophobicContact CD2-CG2 3.3Å; L1129-P1621 HydrophobicContact CB-CB 4.35Å; L1129-P1621 HydrophobicContact CD2-CB 3.96Å; L1129-P1621 HydrophobicContact CD2-CG 4.06Å; L1129-P1621 HydrophobicContact CG-CB 4.12Å; L1129-P1621 HydrophobicContact CG-CG 4.48Å
1130	G	82	Confident	78.6	Confident	13.4 Å²	13.4	46.8 Å²	46.8	14%	0.138	24%	0.236	C	C	.	.	H	α-helix	trans	-62.4	-45.5	175.2	0	0	0	0	0	112.5	Y1030 S1128 H1132 L1133 C1134 W1625	Y1030-G1130 PolarHBondContact OH-O 3.01Å; S1128-G1130 VanDerWaalsContact C-N 3.32Å; S1128-G1130 PolarHBondContact O-N 2.96Å; G1130-H1132 VanDerWaalsContact C-N 3.34Å; G1130-H1132 PolarHBondContact O-N 3.24Å; G1130-L1133 PolarHBondContact O-N 3.01Å; G1130-C1134 WeakPolarHBondContact O-CB 3.48Å; G1130-C1134 PolarHBondContact O-N 3.17Å; G1130-C1134 VanDerWaalsContact O-N 3.07Å; G1130-C1134 PolarHBondContact O-SG 2.97Å; G1130-W1625 PolarHBondContact O-NE1 2.94Å; G1130-W1625 VanDerWaalsContact O-NE1 3.14Å
1131	F	83.3	Confident	79.4	Confident	14.4 Å²	14.4	43.1 Å²	43.1	6%	0.063	22%	0.219	C	C	.	.	H	α-helix	trans	-60.3	-42.7	173.5	171.8	-108.2	0	0	0	112	I990 L1028 Y1030 V1076 F1125 S1128 L1133 C1134 C1135	I990-F1131 HydrophobicContact CD1-CD2 4.02Å; I990-F1131 HydrophobicContact CD1-CE2 3.78Å; I990-F1131 HydrophobicContact CG1-CD2 4.48Å; I990-F1131 HydrophobicContact CG1-CE2 4.38Å; L1028-F1131 HydrophobicContact CD2-CE2 3.8Å; L1028-F1131 VanDerWaalsContact CD2-CE2 3.49Å; L1028-F1131 HydrophobicContact CD2-CZ 3.84Å; Y1030-F1131 HydrophobicContact CD1-CB 4.18Å; Y1030-F1131 HydrophobicContact CD2-CD2 4.4Å; Y1030-F1131 HydrophobicContact CE1-CB 4.38Å; Y1030-F1131 HydrophobicContact CG-CB 4.23Å; Y1030-F1131 HydrophobicContact CG-CD2 4.22Å; V1076-F1131 HydrophobicContact CB-CD2 4.47Å; V1076-F1131 HydrophobicContact CB-CE2 4.47Å; V1076-F1131 HydrophobicContact CG1-CD1 3.97Å; V1076-F1131 HydrophobicContact CG1-CD2 3.91Å; V1076-F1131 HydrophobicContact CG1-CE1 3.77Å; V1076-F1131 HydrophobicContact CG1-CE2 3.69Å; V1076-F1131 HydrophobicContact CG1-CG 4.04Å; V1076-F1131 HydrophobicContact CG1-CZ 3.62Å; V1076-F1131 HydrophobicContact CG2-CD2 4.09Å; V1076-F1131 HydrophobicContact CG2-CE2 4.33Å; V1076-F1131 HydrophobicContact CG2-CG 4.34Å; F1125-F1131 AromaticContact CE2-CE1 3.89Å; F1125-F1131 HydrophobicContact CE2-CE1 3.98Å; F1125-F1131 HydrophobicContact CE2-CZ 4.4Å; F1125-F1131 HydrophobicContact CZ-CD1 4.49Å; F1125-F1131 AromaticContact CZ-CE1 3.88Å; F1125-F1131 HydrophobicContact CZ-CE1 3.88Å; S1128-F1131 PolarHBondContact O-N 3.01Å; S1128-F1131 VanDerWaalsContact OG-CB 3.31Å; S1128-F1131 WeakPolarHBondContact OG-CB 3.37Å; S1128-F1131 PolarHBondContact OG-N 2.93Å; S1128-F1131 VanDerWaalsContact OG-N 3.15Å; F1131-L1133 VanDerWaalsContact C-N 3.34Å; F1131-L1133 PolarHBondContact O-N 3.18Å; F1131-C1134 VanDerWaalsContact O-CB 3.27Å; F1131-C1134 WeakPolarHBondContact O-CB 3.27Å; F1131-C1134 PolarHBondContact O-N 3.1Å; F1131-C1134 VanDerWaalsContact O-N 3.14Å; F1131-C1135 VanDerWaalsContact CE2-SG 3.54Å; F1131-C1135 WeakPolarHBondContact CE2-SG 3.43Å; F1131-C1135 WeakPolarHBondContact CZ-SG 3.18Å; F1131-C1135 PolarHBondContact O-N 2.96Å; F1131-C1135 PolarHBondContact O-SG 3.2Å
1132	H	86.1	Confident	79.9	Confident	37.8 Å²	37.8	41.7 Å²	41.7	18%	0.175	21%	0.208	C	C	.	.	H	α-helix	trans	-61.9	-42.8	177.7	-171.8	89.3	0	0	0	112.6	W1127 S1128 L1129 G1130 C1134 C1135 Y1136 L1354 H1358	W1127-H1132 AromaticContact CE2-ND1 3.68Å; W1127-H1132 HydrophobicContact CZ2-CB 3.61Å; W1127-H1132 AromaticContact CZ2-CG 3.81Å; W1127-H1132 AromaticContact CZ2-ND1 3.78Å; W1127-H1132 AromaticContact NE1-CG 3.88Å; W1127-H1132 AromaticContact NE1-ND1 3.48Å; W1127-H1132 PolarHBondContact NE1-ND1 3.23Å; S1128-H1132 PolarHBondContact O-N 3.03Å; L1129-H1132 PolarHBondContact O-N 3.06Å; G1130-H1132 VanDerWaalsContact C-N 3.34Å; G1130-H1132 PolarHBondContact O-N 3.24Å; H1132-C1134 VanDerWaalsContact C-N 3.29Å; H1132-C1134 PolarHBondContact O-N 3.25Å; H1132-C1135 PolarHBondContact O-N 3.01Å; H1132-Y1136 WeakPolarHBondContact O-CB 3.39Å; H1132-Y1136 PolarHBondContact O-N 3.06Å; H1132-L1354 VanDerWaalsContact CD2-CD2 3.42Å; H1132-L1354 WeakPolarHBondContact CD2-CD2 3.34Å; H1132-L1354 WeakPolarHBondContact NE2-CD2 3.44Å; H1132-H1358 AromaticContact CE1-NE2 3.66Å; H1132-H1358 AromaticContact NE2-CD2 3.96Å; H1132-H1358 AromaticContact NE2-CE1 3.81Å; H1132-H1358 AromaticContact NE2-NE2 2.99Å; H1132-H1358 PolarHBondContact NE2-NE2 3.22Å
1133	L	83.6	Confident	80.2	Confident	24.8 Å²	24.8	47 Å²	47	13%	0.13	23%	0.226	C	C	.	.	H	α-helix	trans	-63.6	-37.6	175.8	-71.8	170.7	0	0	0	111.6	L1129 G1130 F1131 Y1136 N1137 F1353 L1357 P1621 W1625 Y1628	L1129-L1133 HydrophobicContact CG-CD1 4.44Å; L1129-L1133 WeakPolarHBondContact O-CG 3.34Å; L1129-L1133 PolarHBondContact O-N 2.95Å; G1130-L1133 PolarHBondContact O-N 3.01Å; F1131-L1133 VanDerWaalsContact C-N 3.34Å; F1131-L1133 PolarHBondContact O-N 3.18Å; L1133-Y1136 PolarHBondContact O-N 3.19Å; L1133-N1137 WeakPolarHBondContact O-CB 3.4Å; L1133-N1137 VanDerWaalsContact O-CG 3.3Å; L1133-N1137 PolarHBondContact O-N 2.94Å; L1133-N1137 PolarHBondContact O-ND2 3Å; L1133-F1353 HydrophobicContact CD2-CE1 4.3Å; L1133-F1353 HydrophobicContact CD2-CZ 4.35Å; L1133-L1357 HydrophobicContact CD2-CD1 3.9Å; L1133-L1357 VanDerWaalsContact CD2-CD1 3.46Å; L1133-L1357 HydrophobicContact CD2-CD2 3.82Å; L1133-P1621 HydrophobicContact CD1-CB 3.83Å; L1133-P1621 HydrophobicContact CD1-CG 3.84Å; L1133-W1625 VanDerWaalsContact C-CZ2 3.46Å; L1133-W1625 HydrophobicContact CB-CD2 3.74Å; L1133-W1625 VanDerWaalsContact CB-CE2 3.41Å; L1133-W1625 HydrophobicContact CB-CE3 3.96Å; L1133-W1625 HydrophobicContact CB-CG 4.45Å; L1133-W1625 HydrophobicContact CB-CH2 3.75Å; L1133-W1625 HydrophobicContact CB-CZ2 3.54Å; L1133-W1625 VanDerWaalsContact CB-CZ2 3.46Å; L1133-W1625 HydrophobicContact CB-CZ3 3.95Å; L1133-W1625 HydrophobicContact CD1-CB 4.09Å; L1133-W1625 HydrophobicContact CD1-CD2 3.69Å; L1133-W1625 HydrophobicContact CD1-CE3 3.99Å; L1133-W1625 HydrophobicContact CD1-CG 3.71Å; L1133-W1625 HydrophobicContact CG-CD2 4.36Å; L1133-W1625 HydrophobicContact CG-CE3 4.49Å; L1133-Y1628 HydrophobicContact CD1-CE2 3.93Å
1134	C	80.9	Confident	80	Confident	2 Å²	2	52.3 Å²	52.3	1%	0.014	25%	0.251	C	S	.	.	H	α-helix	trans	-60.6	-52.5	172.4	-162.9	0	0	0	0	111.4	T988 I990 Y1030 G1130 F1131 H1132 Y1136 N1137 L1138 W1625	T988-C1134 WeakPolarHBondContact CB-SG 3.32Å; T988-C1134 PolarHBondContact O-SG 2.91Å; T988-C1134 VanDerWaalsContact O-SG 3.36Å; T988-C1134 VanDerWaalsContact OG1-CA 3.29Å; T988-C1134 WeakPolarHBondContact OG1-CA 3.38Å; T988-C1134 VanDerWaalsContact OG1-CB 3.26Å; T988-C1134 WeakPolarHBondContact OG1-CB 3.29Å; T988-C1134 PolarHBondContact OG1-SG 3.14Å; I990-C1134 HydrophobicContact CD1-CB 4.11Å; I990-C1134 WeakPolarHBondContact CD1-SG 3.4Å; I990-C1134 VanDerWaalsContact CG1-SG 3.57Å; I990-C1134 WeakPolarHBondContact CG1-SG 3.5Å; Y1030-C1134 HydrophobicContact CD2-CB 4.17Å; Y1030-C1134 HydrophobicContact CE2-CB 3.99Å; Y1030-C1134 WeakPolarHBondContact CE2-SG 3.4Å; G1130-C1134 WeakPolarHBondContact O-CB 3.48Å; G1130-C1134 PolarHBondContact O-N 3.17Å; G1130-C1134 VanDerWaalsContact O-N 3.07Å; G1130-C1134 PolarHBondContact O-SG 2.97Å; F1131-C1134 VanDerWaalsContact O-CB 3.27Å; F1131-C1134 WeakPolarHBondContact O-CB 3.27Å; F1131-C1134 PolarHBondContact O-N 3.1Å; F1131-C1134 VanDerWaalsContact O-N 3.14Å; H1132-C1134 VanDerWaalsContact C-N 3.29Å; H1132-C1134 PolarHBondContact O-N 3.25Å; C1134-Y1136 VanDerWaalsContact C-N 3.3Å; C1134-Y1136 PolarHBondContact O-N 3.32Å; C1134-N1137 PolarHBondContact O-N 3.1Å; C1134-N1137 VanDerWaalsContact O-N 3.1Å; C1134-L1138 VanDerWaalsContact O-CB 3.26Å; C1134-L1138 WeakPolarHBondContact O-CB 3.33Å; C1134-L1138 WeakPolarHBondContact O-CG 3.36Å; C1134-L1138 PolarHBondContact O-N 2.84Å; C1134-L1138 VanDerWaalsContact SG-CD1 3.59Å; C1134-W1625 HydrophobicContact CB-CZ2 4.14Å; C1134-W1625 VanDerWaalsContact N-CZ2 3.33Å; C1134-W1625 VanDerWaalsContact SG-CZ2 3.5Å
1135	C	81.5	Confident	79.4	Confident	40.8 Å²	40.8	50.6 Å²	50.6	28%	0.276	24%	0.242	S	C	.	.	H	α-helix	trans	-59.9	-39.3	177.2	-68.4	0	0	0	0	112.7	F1131 H1132 L1138 L1139	F1131-C1135 VanDerWaalsContact CE2-SG 3.54Å; F1131-C1135 WeakPolarHBondContact CE2-SG 3.43Å; F1131-C1135 WeakPolarHBondContact CZ-SG 3.18Å; F1131-C1135 PolarHBondContact O-N 2.96Å; F1131-C1135 PolarHBondContact O-SG 3.2Å; H1132-C1135 PolarHBondContact O-N 3.01Å; C1135-L1138 WeakPolarHBondContact O-CB 3.24Å; C1135-L1138 PolarHBondContact O-N 3.01Å; C1135-L1139 VanDerWaalsContact O-CB 3.31Å; C1135-L1139 WeakPolarHBondContact O-CB 3.42Å; C1135-L1139 VanDerWaalsContact O-CG 3.25Å; C1135-L1139 WeakPolarHBondContact O-CG 3.43Å; C1135-L1139 PolarHBondContact O-N 3.17Å
1136	Y	82.3	Confident	78.5	Confident	41 Å²	41	51.8 Å²	51.8	16%	0.161	25%	0.248	C	C	.	.	H	α-helix	trans	-61.6	-47.5	175.7	177.5	-93.3	0	0	0	111.6	H1132 L1133 C1134 L1139 R1140 L1357 H1358	H1132-Y1136 WeakPolarHBondContact O-CB 3.39Å; H1132-Y1136 PolarHBondContact O-N 3.06Å; L1133-Y1136 PolarHBondContact O-N 3.19Å; C1134-Y1136 VanDerWaalsContact C-N 3.3Å; C1134-Y1136 PolarHBondContact O-N 3.32Å; Y1136-L1139 PolarHBondContact O-N 2.79Å; Y1136-R1140 WeakPolarHBondContact O-CB 3.27Å; Y1136-R1140 PolarHBondContact O-N 3.06Å; Y1136-R1140 PolarHBondContact OH-NH1 2.87Å; Y1136-R1140 VanDerWaalsContact OH-NH1 3.16Å; Y1136-L1357 HydrophobicContact CD1-CD1 4.32Å; Y1136-L1357 HydrophobicContact CD1-CD2 4.38Å; Y1136-L1357 HydrophobicContact CD1-CG 4.48Å; Y1136-L1357 HydrophobicContact CD2-CD2 4.08Å; Y1136-L1357 HydrophobicContact CD2-CG 4.37Å; Y1136-L1357 HydrophobicContact CE1-CD1 4.18Å; Y1136-L1357 HydrophobicContact CE1-CG 4.36Å; Y1136-L1357 HydrophobicContact CE2-CD2 4.07Å; Y1136-L1357 HydrophobicContact CE2-CG 4.22Å; Y1136-L1357 HydrophobicContact CG-CD2 4.12Å; Y1136-L1357 HydrophobicContact CG-CG 4.45Å; Y1136-L1357 PolarHBondContact OH-O 3.04Å; Y1136-H1358 AromaticContact CD2-CE1 3.62Å; Y1136-H1358 AromaticContact CD2-ND1 3.89Å; Y1136-H1358 AromaticContact CE2-CE1 3.97Å; Y1136-H1358 AromaticContact CE2-ND1 3.82Å
1137	N	78.4	Confident	77.5	Confident	60.8 Å²	60.8	51.1 Å²	51.1	33%	0.325	25%	0.251	S	S	.	.	H	α-helix	trans	-65.3	-40	177	-79.6	-8.2	0	0	0	112.2	L1133 C1134 R1140 S1141 W1625	L1133-N1137 WeakPolarHBondContact O-CB 3.4Å; L1133-N1137 VanDerWaalsContact O-CG 3.3Å; L1133-N1137 PolarHBondContact O-N 2.94Å; L1133-N1137 PolarHBondContact O-ND2 3Å; C1134-N1137 PolarHBondContact O-N 3.1Å; C1134-N1137 VanDerWaalsContact O-N 3.1Å; N1137-R1140 WeakPolarHBondContact O-CB 3.35Å; N1137-R1140 PolarHBondContact O-N 3.1Å; N1137-S1141 VanDerWaalsContact O-CB 3.3Å; N1137-S1141 WeakPolarHBondContact O-CB 3.44Å; N1137-S1141 PolarHBondContact O-N 3.09Å; N1137-S1141 PolarHBondContact O-OG 2.92Å; N1137-S1141 VanDerWaalsContact O-OG 3.13Å; N1137-W1625 HydrophobicContact CB-CH2 4.44Å; N1137-W1625 VanDerWaalsContact ND2-CH2 3.31Å; N1137-W1625 WeakPolarHBondContact ND2-CH2 3.4Å; N1137-W1625 VanDerWaalsContact ND2-CZ3 3.27Å; N1137-W1625 WeakPolarHBondContact ND2-CZ3 3.31Å
1138	L	76.3	Confident	76.3	Confident	33.4 Å²	33.4	54.4 Å²	54.4	18%	0.175	27%	0.266	C	S	.	.	H	α-helix	trans	-62.2	-46.5	175.5	-134.5	144.2	0	0	0	111.4	L985 I990 C1134 C1135 R1140 S1141 W1142	L985-L1138 HydrophobicContact CB-CD1 3.8Å; L985-L1138 VanDerWaalsContact CB-CD1 3.46Å; L985-L1138 HydrophobicContact CB-CD2 4.06Å; L985-L1138 HydrophobicContact CD1-CD1 3.76Å; L985-L1138 HydrophobicContact CD1-CD2 4.3Å; L985-L1138 HydrophobicContact CD2-CD1 4.23Å; L985-L1138 HydrophobicContact CD2-CD2 4.41Å; L985-L1138 HydrophobicContact CG-CD1 4.14Å; I990-L1138 HydrophobicContact CD1-CD1 4.15Å; C1134-L1138 VanDerWaalsContact O-CB 3.26Å; C1134-L1138 WeakPolarHBondContact O-CB 3.33Å; C1134-L1138 WeakPolarHBondContact O-CG 3.36Å; C1134-L1138 PolarHBondContact O-N 2.84Å; C1134-L1138 VanDerWaalsContact SG-CD1 3.59Å; C1135-L1138 WeakPolarHBondContact O-CB 3.24Å; C1135-L1138 PolarHBondContact O-N 3.01Å; L1138-R1140 VanDerWaalsContact C-N 3.31Å; L1138-R1140 PolarHBondContact O-N 3.1Å; L1138-S1141 PolarHBondContact O-N 3.13Å; L1138-W1142 VanDerWaalsContact O-CB 3.31Å; L1138-W1142 WeakPolarHBondContact O-CB 3.33Å; L1138-W1142 PolarHBondContact O-N 3.19Å
1139	L	78.4	Confident	74.9	Confident	100.6 Å²	100.6	56.6 Å²	56.6	53%	0.527	28%	0.276	S	S	.	.	H	α-helix	trans	-64.2	-35.5	176.7	-110.1	132.3	0	0	0	111.9	C1135 Y1136 K1143	C1135-L1139 VanDerWaalsContact O-CB 3.31Å; C1135-L1139 WeakPolarHBondContact O-CB 3.42Å; C1135-L1139 VanDerWaalsContact O-CG 3.25Å; C1135-L1139 WeakPolarHBondContact O-CG 3.43Å; C1135-L1139 PolarHBondContact O-N 3.17Å; Y1136-L1139 PolarHBondContact O-N 2.79Å; L1139-K1143 WeakPolarHBondContact O-CB 3.43Å; L1139-K1143 VanDerWaalsContact O-CG 3.28Å; L1139-K1143 WeakPolarHBondContact O-CG 3.33Å; L1139-K1143 PolarHBondContact O-N 2.94Å
1140	R	76.4	Confident	73.5	Confident	128 Å²	128	60 Å²	60	48%	0.483	29%	0.29	S	S	.	.	H	α-helix	trans	-68.3	-45.7	175.2	-170.8	175.4	-177.2	165	-0.1	111.6	Y1136 N1137 L1138 W1142 K1143 Q1144	Y1136-R1140 WeakPolarHBondContact O-CB 3.27Å; Y1136-R1140 PolarHBondContact O-N 3.06Å; Y1136-R1140 PolarHBondContact OH-NH1 2.87Å; Y1136-R1140 VanDerWaalsContact OH-NH1 3.16Å; N1137-R1140 WeakPolarHBondContact O-CB 3.35Å; N1137-R1140 PolarHBondContact O-N 3.1Å; L1138-R1140 VanDerWaalsContact C-N 3.31Å; L1138-R1140 PolarHBondContact O-N 3.1Å; R1140-W1142 VanDerWaalsContact C-N 3.34Å; R1140-W1142 PolarHBondContact O-N 3.11Å; R1140-K1143 PolarHBondContact O-N 3.13Å; R1140-Q1144 WeakPolarHBondContact O-CG 3.25Å; R1140-Q1144 PolarHBondContact O-N 2.96Å
1141	S	71.1	Confident	71.8	Confident	25.2 Å²	25.2	67 Å²	67	18%	0.176	32%	0.316	C	S	.	.	H	α-helix	trans	-61.1	-43.6	174.7	-73.2	0	0	0	0	111.2	N987 N1137 L1138 K1143 Q1144 F1145	N987-S1141 WeakPolarHBondContact ND2-CB 3.49Å; N987-S1141 PolarHBondContact ND2-OG 3.14Å; N1137-S1141 VanDerWaalsContact O-CB 3.3Å; N1137-S1141 WeakPolarHBondContact O-CB 3.44Å; N1137-S1141 PolarHBondContact O-N 3.09Å; N1137-S1141 PolarHBondContact O-OG 2.92Å; N1137-S1141 VanDerWaalsContact O-OG 3.13Å; L1138-S1141 PolarHBondContact O-N 3.13Å; S1141-K1143 PolarHBondContact O-N 3.23Å; S1141-Q1144 WeakPolarHBondContact O-CB 3.49Å; S1141-Q1144 PolarHBondContact O-N 3.12Å; S1141-Q1144 VanDerWaalsContact O-N 3.1Å; S1141-F1145 VanDerWaalsContact O-CB 3.25Å; S1141-F1145 WeakPolarHBondContact O-CB 3.38Å; S1141-F1145 PolarHBondContact O-N 3.2Å
1142	W	70.7	Confident	69.8	Low	88.4 Å²	88.4	71.7 Å²	71.7	34%	0.335	34%	0.339	S	S	.	.	H	α-helix	trans	-62	-44.8	174.7	-178.1	-102	0	0	0	112.5	W919 L1105 L1138 R1140 Q1144 F1145 H1146	W919-W1142 AromaticContact CE2-CZ3 3.87Å; W919-W1142 HydrophobicContact CZ2-CE3 4.25Å; W919-W1142 AromaticContact CZ2-CZ3 4Å; W919-W1142 HydrophobicContact CZ2-CZ3 4.13Å; W919-W1142 AromaticContact NE1-CE3 3.46Å; W919-W1142 AromaticContact NE1-CZ3 3.31Å; W919-W1142 VanDerWaalsContact NE1-CZ3 3.31Å; L1105-W1142 HydrophobicContact CB-CH2 3.52Å; L1105-W1142 HydrophobicContact CB-CZ2 3.71Å; L1105-W1142 VanDerWaalsContact CB-CZ2 3.42Å; L1105-W1142 HydrophobicContact CB-CZ3 4.26Å; L1105-W1142 HydrophobicContact CD1-CE3 4.49Å; L1105-W1142 HydrophobicContact CD1-CH2 3.4Å; L1105-W1142 HydrophobicContact CD1-CZ2 3.9Å; L1105-W1142 VanDerWaalsContact CD1-CZ2 3.48Å; L1105-W1142 HydrophobicContact CD1-CZ3 3.87Å; L1105-W1142 HydrophobicContact CD2-CD2 4.33Å; L1105-W1142 HydrophobicContact CD2-CH2 3.96Å; L1105-W1142 HydrophobicContact CD2-CZ2 3.62Å; L1105-W1142 HydrophobicContact CD2-CZ3 4.43Å; L1105-W1142 HydrophobicContact CG-CH2 4.11Å; L1105-W1142 HydrophobicContact CG-CZ2 4.15Å; L1105-W1142 HydrophobicContact CG-CZ3 4.46Å; L1105-W1142 WeakPolarHBondContact O-CZ2 3.4Å; L1138-W1142 VanDerWaalsContact O-CB 3.31Å; L1138-W1142 WeakPolarHBondContact O-CB 3.33Å; L1138-W1142 PolarHBondContact O-N 3.19Å; R1140-W1142 VanDerWaalsContact C-N 3.34Å; R1140-W1142 PolarHBondContact O-N 3.11Å; W1142-Q1144 VanDerWaalsContact C-N 3.31Å; W1142-Q1144 PolarHBondContact O-N 3.02Å; W1142-F1145 HydrophobicContact CD2-CD1 4.43Å; W1142-F1145 AromaticContact CE3-CD1 3.71Å; W1142-F1145 HydrophobicContact CE3-CD1 3.96Å; W1142-F1145 HydrophobicContact CE3-CE1 4.29Å; W1142-F1145 AromaticContact CH2-CD1 3.54Å; W1142-F1145 HydrophobicContact CH2-CD1 3.78Å; W1142-F1145 AromaticContact CH2-CE1 3.67Å; W1142-F1145 HydrophobicContact CH2-CE1 3.67Å; W1142-F1145 VanDerWaalsContact CH2-CE1 3.48Å; W1142-F1145 HydrophobicContact CZ2-CD1 4.2Å; W1142-F1145 HydrophobicContact CZ2-CE1 4.4Å; W1142-F1145 AromaticContact CZ3-CD1 3.34Å; W1142-F1145 HydrophobicContact CZ3-CD1 3.71Å; W1142-F1145 AromaticContact CZ3-CE1 3.46Å; W1142-F1145 HydrophobicContact CZ3-CE1 3.46Å; W1142-F1145 VanDerWaalsContact CZ3-CE1 3.4Å; W1142-F1145 HydrophobicContact CZ3-CG 4.49Å; W1142-F1145 PolarHBondContact O-N 3.02Å; W1142-H1146 VanDerWaalsContact O-CB 3.24Å; W1142-H1146 WeakPolarHBondContact O-CB 3.37Å; W1142-H1146 PolarHBondContact O-N 3.29Å
1143	K	71.9	Confident	67.4	Low	153.8 Å²	153.8	74.4 Å²	74.4	67%	0.669	36%	0.361	S	S	*	.	H	α-helix	trans	-60.4	-39.1	174.5	-79	176.6	179.9	-178.8	0	112.1	L1139 R1140 S1141 G1147	L1139-K1143 WeakPolarHBondContact O-CB 3.43Å; L1139-K1143 VanDerWaalsContact O-CG 3.28Å; L1139-K1143 WeakPolarHBondContact O-CG 3.33Å; L1139-K1143 PolarHBondContact O-N 2.94Å; R1140-K1143 PolarHBondContact O-N 3.13Å; S1141-K1143 PolarHBondContact O-N 3.23Å; K1143-G1147 WeakPolarHBondContact O-CA 3.29Å; K1143-G1147 PolarHBondContact O-N 3.22Å
1144	Q	69.4	Low	64.8	Low	115 Å²	115	77.7 Å²	77.7	54%	0.537	39%	0.387	S	S	.	.	H	α-helix	trans	-67.5	-44.6	175.4	-73	174.8	-15.7	0	0	111.8	R1140 S1141 W1142 G1147 K1148	R1140-Q1144 WeakPolarHBondContact O-CG 3.25Å; R1140-Q1144 PolarHBondContact O-N 2.96Å; S1141-Q1144 WeakPolarHBondContact O-CB 3.49Å; S1141-Q1144 PolarHBondContact O-N 3.12Å; S1141-Q1144 VanDerWaalsContact O-N 3.1Å; W1142-Q1144 VanDerWaalsContact C-N 3.31Å; W1142-Q1144 PolarHBondContact O-N 3.02Å; Q1144-G1147 CarbonylContact O-C 3.56Å; Q1144-G1147 WeakPolarHBondContact O-CA 3.2Å; Q1144-G1147 PolarHBondContact O-N 3.14Å; Q1144-G1147 VanDerWaalsContact O-N 3.17Å; Q1144-K1148 WeakPolarHBondContact O-CG 3.33Å; Q1144-K1148 PolarHBondContact O-N 2.92Å
1145	F	66.3	Low	62.2	Low	27.4 Å²	27.4	82.6 Å²	82.6	12%	0.12	42%	0.417	C	S	.	.	H	α-helix	trans	-61.7	-52.5	176.9	176.2	-102.9	0	0	0	112.1	W919 N925 M928 S1141 W1142 G1147 K1148 L1149	W919-F1145 HydrophobicContact CH2-CB 4.39Å; W919-F1145 AromaticContact CH2-CD1 3.84Å; W919-F1145 HydrophobicContact CH2-CD1 4.11Å; W919-F1145 AromaticContact CH2-CD2 3.56Å; W919-F1145 HydrophobicContact CH2-CD2 3.87Å; W919-F1145 AromaticContact CH2-CE1 3.75Å; W919-F1145 HydrophobicContact CH2-CE1 3.75Å; W919-F1145 AromaticContact CH2-CE2 3.7Å; W919-F1145 HydrophobicContact CH2-CE2 3.7Å; W919-F1145 AromaticContact CH2-CG 3.67Å; W919-F1145 HydrophobicContact CH2-CG 3.67Å; W919-F1145 AromaticContact CH2-CZ 3.52Å; W919-F1145 HydrophobicContact CH2-CZ 3.52Å; W919-F1145 HydrophobicContact CZ2-CB 4.1Å; W919-F1145 AromaticContact CZ2-CD1 3.81Å; W919-F1145 HydrophobicContact CZ2-CD1 3.81Å; W919-F1145 HydrophobicContact CZ2-CD2 4.25Å; W919-F1145 AromaticContact CZ2-CE1 3.43Å; W919-F1145 HydrophobicContact CZ2-CE1 3.82Å; W919-F1145 VanDerWaalsContact CZ2-CE1 3.45Å; W919-F1145 HydrophobicContact CZ2-CE2 4.19Å; W919-F1145 AromaticContact CZ2-CG 3.77Å; W919-F1145 HydrophobicContact CZ2-CG 4Å; W919-F1145 AromaticContact CZ2-CZ 3.6Å; W919-F1145 HydrophobicContact CZ2-CZ 3.89Å; W919-F1145 HydrophobicContact CZ3-CE2 4.31Å; W919-F1145 HydrophobicContact CZ3-CZ 4.27Å; N925-F1145 WeakPolarHBondContact OD1-CD2 3.24Å; M928-F1145 HydrophobicContact CE-CE2 4.05Å; M928-F1145 HydrophobicContact CE-CZ 4.29Å; M928-F1145 HydrophobicContact CG-CD2 4.27Å; M928-F1145 HydrophobicContact CG-CE2 4.1Å; M928-F1145 HydrophobicContact SD-CE2 3.85Å; S1141-F1145 VanDerWaalsContact O-CB 3.25Å; S1141-F1145 WeakPolarHBondContact O-CB 3.38Å; S1141-F1145 PolarHBondContact O-N 3.2Å; W1142-F1145 HydrophobicContact CD2-CD1 4.43Å; W1142-F1145 AromaticContact CE3-CD1 3.71Å; W1142-F1145 HydrophobicContact CE3-CD1 3.96Å; W1142-F1145 HydrophobicContact CE3-CE1 4.29Å; W1142-F1145 AromaticContact CH2-CD1 3.54Å; W1142-F1145 HydrophobicContact CH2-CD1 3.78Å; W1142-F1145 AromaticContact CH2-CE1 3.67Å; W1142-F1145 HydrophobicContact CH2-CE1 3.67Å; W1142-F1145 VanDerWaalsContact CH2-CE1 3.48Å; W1142-F1145 HydrophobicContact CZ2-CD1 4.2Å; W1142-F1145 HydrophobicContact CZ2-CE1 4.4Å; W1142-F1145 AromaticContact CZ3-CD1 3.34Å; W1142-F1145 HydrophobicContact CZ3-CD1 3.71Å; W1142-F1145 AromaticContact CZ3-CE1 3.46Å; W1142-F1145 HydrophobicContact CZ3-CE1 3.46Å; W1142-F1145 VanDerWaalsContact CZ3-CE1 3.4Å; W1142-F1145 HydrophobicContact CZ3-CG 4.49Å; W1142-F1145 PolarHBondContact O-N 3.02Å; F1145-G1147 VanDerWaalsContact C-N 3.26Å; F1145-G1147 PolarHBondContact O-N 2.97Å; F1145-K1148 PolarHBondContact O-N 2.97Å; F1145-K1148 VanDerWaalsContact O-N 3.12Å; F1145-L1149 HydrophobicContact CD1-CD1 4.25Å; F1145-L1149 HydrophobicContact CD2-CD1 4.22Å; F1145-L1149 HydrophobicContact CE1-CD1 3.47Å; F1145-L1149 VanDerWaalsContact CE1-CD1 3.4Å; F1145-L1149 HydrophobicContact CE2-CD1 3.85Å; F1145-L1149 HydrophobicContact CE2-CG 4.24Å; F1145-L1149 HydrophobicContact CZ-CD1 3.25Å; F1145-L1149 HydrophobicContact CZ-CG 4.4Å; F1145-L1149 PolarHBondContact O-N 3.1Å
1146	H	65	Low	59.7	Low	68.2 Å²	68.2	86.8 Å²	86.8	32%	0.316	44%	0.441	S	S	.	.	H	α-helix	trans	-58.7	-37.6	174	-176.3	-55.8	0	0	0	111.2	K1107 W1142 K1148 L1149 F1150	K1107-H1146 WeakPolarHBondContact CD-NE2 3.41Å; W1142-H1146 VanDerWaalsContact O-CB 3.24Å; W1142-H1146 WeakPolarHBondContact O-CB 3.37Å; W1142-H1146 PolarHBondContact O-N 3.29Å; H1146-K1148 VanDerWaalsContact C-N 3.33Å; H1146-K1148 PolarHBondContact O-N 3.02Å; H1146-L1149 PolarHBondContact O-N 3.2Å; H1146-F1150 AromaticContact CD2-CD2 3.57Å; H1146-F1150 AromaticContact CD2-CE2 3.51Å; H1146-F1150 VanDerWaalsContact CD2-CE2 3.45Å; H1146-F1150 WeakPolarHBondContact CD2-CE2 3.44Å; H1146-F1150 AromaticContact CE1-CD2 3.55Å; H1146-F1150 VanDerWaalsContact CE1-CD2 3.4Å; H1146-F1150 WeakPolarHBondContact CE1-CD2 3.45Å; H1146-F1150 AromaticContact CE1-CE2 3.9Å; H1146-F1150 AromaticContact CE1-CG 3.94Å; H1146-F1150 AromaticContact CG-CD2 3.81Å; H1146-F1150 AromaticContact ND1-CD2 3.53Å; H1146-F1150 WeakPolarHBondContact ND1-CD2 3.35Å; H1146-F1150 AromaticContact ND1-CG 3.9Å; H1146-F1150 AromaticContact NE2-CD2 3.39Å; H1146-F1150 WeakPolarHBondContact NE2-CD2 3.34Å; H1146-F1150 AromaticContact NE2-CE2 3.41Å; H1146-F1150 VanDerWaalsContact NE2-CE2 3.33Å; H1146-F1150 WeakPolarHBondContact NE2-CE2 3.27Å; H1146-F1150 WeakPolarHBondContact O-CB 3.3Å; H1146-F1150 WeakPolarHBondContact O-CD2 3.27Å; H1146-F1150 PolarHBondContact O-N 3.17Å
1147	G	64.1	Low	56.9	Low	26.6 Å²	26.6	89.3 Å²	89.3	27%	0.274	46%	0.464	S	S	.	.	H	α-helix	trans	-63.2	-37.5	174.8	0	0	0	0	0	113.7	K1143 Q1144 F1145 K1151	K1143-G1147 WeakPolarHBondContact O-CA 3.29Å; K1143-G1147 PolarHBondContact O-N 3.22Å; Q1144-G1147 CarbonylContact O-C 3.56Å; Q1144-G1147 WeakPolarHBondContact O-CA 3.2Å; Q1144-G1147 PolarHBondContact O-N 3.14Å; Q1144-G1147 VanDerWaalsContact O-N 3.17Å; F1145-G1147 VanDerWaalsContact C-N 3.26Å; F1145-G1147 PolarHBondContact O-N 2.97Å; G1147-K1151 VanDerWaalsContact O-CB 3.29Å; G1147-K1151 WeakPolarHBondContact O-CB 3.38Å; G1147-K1151 VanDerWaalsContact O-CD 3.3Å; G1147-K1151 WeakPolarHBondContact O-CD 3.31Å; G1147-K1151 VanDerWaalsContact O-CG 3.25Å; G1147-K1151 WeakPolarHBondContact O-CG 3.38Å; G1147-K1151 PolarHBondContact O-N 2.96Å; G1147-K1151 VanDerWaalsContact O-N 3.08Å
1148	K	65	Low	54.4	Low	95.8 Å²	95.8	93.6 Å²	93.6	42%	0.417	49%	0.486	S	S	.	.	H	α-helix	trans	-71.7	-44.2	175.2	-74.5	-178.3	177	-177.3	0	112	N929 Q1144 F1145 H1146 F1150	N929-K1148 PolarHBondContact OD1-NZ 3.03Å; Q1144-K1148 WeakPolarHBondContact O-CG 3.33Å; Q1144-K1148 PolarHBondContact O-N 2.92Å; F1145-K1148 PolarHBondContact O-N 2.97Å; F1145-K1148 VanDerWaalsContact O-N 3.12Å; H1146-K1148 VanDerWaalsContact C-N 3.33Å; H1146-K1148 PolarHBondContact O-N 3.02Å; K1148-F1150 PolarHBondContact O-N 2.99Å
1149	L	56.4	Low	52	Low	70.8 Å²	70.8	99 Å²	99	37%	0.371	52%	0.515	S	S	.	.	H	α-helix	trans	-70.9	-36.8	-176	-106.6	160.7	0	0	0	113.9	M928 F1145 H1146	M928-L1149 HydrophobicContact CE-CD1 4.27Å; M928-L1149 HydrophobicContact CE-CD2 3.72Å; M928-L1149 HydrophobicContact CE-CG 3.91Å; F1145-L1149 HydrophobicContact CD1-CD1 4.25Å; F1145-L1149 HydrophobicContact CD2-CD1 4.22Å; F1145-L1149 HydrophobicContact CE1-CD1 3.47Å; F1145-L1149 VanDerWaalsContact CE1-CD1 3.4Å; F1145-L1149 HydrophobicContact CE2-CD1 3.85Å; F1145-L1149 HydrophobicContact CE2-CG 4.24Å; F1145-L1149 HydrophobicContact CZ-CD1 3.25Å; F1145-L1149 HydrophobicContact CZ-CG 4.4Å; F1145-L1149 PolarHBondContact O-N 3.1Å; H1146-L1149 PolarHBondContact O-N 3.2Å
1150	F	54.9	Low	49.5	Very low	92.4 Å²	92.4	101.6 Å²	101.6	41%	0.405	53%	0.53	S	S	.	.	H	α-helix	trans	-108.2	-0.7	-169.8	-66.7	-76.8	0	0	0	115.2	H1146 K1148 Q1152 S1153	H1146-F1150 AromaticContact CD2-CD2 3.57Å; H1146-F1150 AromaticContact CD2-CE2 3.51Å; H1146-F1150 VanDerWaalsContact CD2-CE2 3.45Å; H1146-F1150 WeakPolarHBondContact CD2-CE2 3.44Å; H1146-F1150 AromaticContact CE1-CD2 3.55Å; H1146-F1150 VanDerWaalsContact CE1-CD2 3.4Å; H1146-F1150 WeakPolarHBondContact CE1-CD2 3.45Å; H1146-F1150 AromaticContact CE1-CE2 3.9Å; H1146-F1150 AromaticContact CE1-CG 3.94Å; H1146-F1150 AromaticContact CG-CD2 3.81Å; H1146-F1150 AromaticContact ND1-CD2 3.53Å; H1146-F1150 WeakPolarHBondContact ND1-CD2 3.35Å; H1146-F1150 AromaticContact ND1-CG 3.9Å; H1146-F1150 AromaticContact NE2-CD2 3.39Å; H1146-F1150 WeakPolarHBondContact NE2-CD2 3.34Å; H1146-F1150 AromaticContact NE2-CE2 3.41Å; H1146-F1150 VanDerWaalsContact NE2-CE2 3.33Å; H1146-F1150 WeakPolarHBondContact NE2-CE2 3.27Å; H1146-F1150 WeakPolarHBondContact O-CB 3.3Å; H1146-F1150 WeakPolarHBondContact O-CD2 3.27Å; H1146-F1150 PolarHBondContact O-N 3.17Å; K1148-F1150 PolarHBondContact O-N 2.99Å; F1150-Q1152 VanDerWaalsContact C-N 3.35Å; F1150-Q1152 PolarHBondContact O-N 3.26Å; F1150-Q1152 VanDerWaalsContact O-N 3.12Å; F1150-S1153 PolarHBondContact O-N 2.96Å; F1150-S1153 VanDerWaalsContact O-N 3.14Å; F1150-S1153 PolarHBondContact O-OG 2.85Å
1151	K	46.8	Very low	47	Very low	159.6 Å²	159.6	100.7 Å²	100.7	69%	0.694	54%	0.543	S	S	*	.	H	α-helix	trans	-65.7	-24.3	177.6	-100.6	-177	177.6	-172.4	0	113.9	G1147 S1153 S1154	G1147-K1151 VanDerWaalsContact O-CB 3.29Å; G1147-K1151 WeakPolarHBondContact O-CB 3.38Å; G1147-K1151 VanDerWaalsContact O-CD 3.3Å; G1147-K1151 WeakPolarHBondContact O-CD 3.31Å; G1147-K1151 VanDerWaalsContact O-CG 3.25Å; G1147-K1151 WeakPolarHBondContact O-CG 3.38Å; G1147-K1151 PolarHBondContact O-N 2.96Å; G1147-K1151 VanDerWaalsContact O-N 3.08Å; K1151-S1153 VanDerWaalsContact C-N 3.28Å; K1151-S1153 PolarHBondContact O-N 2.82Å; K1151-S1154 PolarHBondContact O-OG 2.92Å
1152	Q	41.4	Very low	44.8	Very low	114 Å²	114	104.1 Å²	104.1	53%	0.533	57%	0.567	S	S	.	*	G	3₁₀ helix	trans	-79	-17.4	-177.4	-83.1	177.9	-22.8	0	0	114.8	H932 F1150 S1154 T1155	H932-Q1152 PolarHBondContact CE1-NE2 2.76Å; F1150-Q1152 VanDerWaalsContact C-N 3.35Å; F1150-Q1152 PolarHBondContact O-N 3.26Å; F1150-Q1152 VanDerWaalsContact O-N 3.12Å; Q1152-S1154 VanDerWaalsContact C-N 3.3Å; Q1152-S1154 PolarHBondContact O-N 3.07Å; Q1152-S1154 VanDerWaalsContact O-N 3.13Å; Q1152-T1155 PolarHBondContact O-N 2.91Å; Q1152-T1155 PolarHBondContact O-OG1 2.75Å; Q1152-T1155 VanDerWaalsContact O-OG1 3.13Å
1153	S	35	Very low	42.6	Very low	93.2 Å²	93.2	107 Å²	107	65%	0.652	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-85.3	-8.7	-176.2	63.3	0	0	0	0	114.8	F1150 K1151	F1150-S1153 PolarHBondContact O-N 2.96Å; F1150-S1153 VanDerWaalsContact O-N 3.14Å; F1150-S1153 PolarHBondContact O-OG 2.85Å; K1151-S1153 VanDerWaalsContact C-N 3.28Å; K1151-S1153 PolarHBondContact O-N 2.82Å
1154	S	28.4	Very low	40.4	Very low	94.8 Å²	94.8	106.2 Å²	106.2	66%	0.663	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-110.7	1.2	-174.1	47.8	0	0	0	0	115	K1151 Q1152 V1156	K1151-S1154 PolarHBondContact O-OG 2.92Å; Q1152-S1154 VanDerWaalsContact C-N 3.3Å; Q1152-S1154 PolarHBondContact O-N 3.07Å; Q1152-S1154 VanDerWaalsContact O-N 3.13Å; S1154-V1156 VanDerWaalsContact C-N 3.28Å; S1154-V1156 PolarHBondContact O-N 3.07Å
1155	T	25.7	Very low	38.2	Very low	105.6 Å²	105.6	106.6 Å²	106.6	65%	0.648	61%	0.611	S	S	*	*			trans	-105.6	39.5	179.6	51.5	0	0	0	0	113.3	Q1152 S1157	Q1152-T1155 PolarHBondContact O-N 2.91Å; Q1152-T1155 PolarHBondContact O-OG1 2.75Å; Q1152-T1155 VanDerWaalsContact O-OG1 3.13Å; T1155-S1157 PolarHBondContact O-N 3.36Å; T1155-S1157 VanDerWaalsContact O-N 3.14Å
1156	V	29.3	Very low	36.1	Very low	127.8 Å²	127.8	112.2 Å²	112.2	78%	0.775	64%	0.643	S	S	*	*			trans	-101.9	68.7	163.4	-171.8	0	0	0	0	108.2	S1154 L1158	S1154-V1156 VanDerWaalsContact C-N 3.28Å; S1154-V1156 PolarHBondContact O-N 3.07Å; V1156-L1158 HydrophobicContact CG1-CD1 4.42Å; V1156-L1158 PolarHBondContact O-N 3.29Å; V1156-L1158 VanDerWaalsContact O-N 3.11Å
1157	S	24.7	Very low	34.4	Very low	93.6 Å²	93.6	114.2 Å²	114.2	66%	0.655	66%	0.662	S	S	*	*			trans	-91.6	106.9	165.5	51.1	0	0	0	0	108.2	T1155 N1159	T1155-S1157 PolarHBondContact O-N 3.36Å; T1155-S1157 VanDerWaalsContact O-N 3.14Å; S1157-N1159 PolarHBondContact O-N 3.11Å
1158	L	26.2	Very low	32.4	Very low	151 Å²	151	121.9 Å²	121.9	79%	0.791	69%	0.688	S	S	*	*			trans	-49.7	92	175.3	-113.6	114.9	0	0	0	111.6	V1156 N1160	V1156-L1158 HydrophobicContact CG1-CD1 4.42Å; V1156-L1158 PolarHBondContact O-N 3.29Å; V1156-L1158 VanDerWaalsContact O-N 3.11Å; L1158-N1160 VanDerWaalsContact C-N 3.31Å; L1158-N1160 PolarHBondContact O-N 3.21Å
1159	N	24.2	Very low	30.5	Very low	146.6 Å²	146.6	125 Å²	125	78%	0.784	71%	0.708	S	S	*	*			trans	-96.3	97.7	163.7	-84.7	-16	0	0	0	109.8	S1157 S1161	S1157-N1159 PolarHBondContact O-N 3.11Å; N1159-S1161 VanDerWaalsContact C-N 3.27Å; N1159-S1161 PolarHBondContact O-N 3.01Å
1160	N	26.7	Very low	28.9	Very low	156.4 Å²	156.4	127.4 Å²	127.4	84%	0.836	73%	0.726	S	S	*	*			trans	-89.4	92.1	160.5	-80.2	-13.6	0	0	0	111.5	L1158	L1158-N1160 VanDerWaalsContact C-N 3.31Å; L1158-N1160 PolarHBondContact O-N 3.21Å
1161	S	24.7	Very low	27.5	Very low	107.8 Å²	107.8	128.6 Å²	128.6	75%	0.754	74%	0.743	S	S	*	*			trans	-96.9	117.8	154.4	57.2	0	0	0	0	111.9	N1159 N1163	N1159-S1161 VanDerWaalsContact C-N 3.27Å; N1159-S1161 PolarHBondContact O-N 3.01Å; S1161-N1163 PolarHBondContact O-N 3.42Å
1162	S	24.2	Very low	26.3	Very low	98.2 Å²	98.2	126.9 Å²	126.9	69%	0.687	75%	0.745	S	S	*	*			trans	11	120.7	157.9	57.5	0	0	0	0	116
1163	N	24.5	Very low	25.5	Very low	148.6 Å²	148.6	128.6 Å²	128.6	80%	0.795	76%	0.757	S	S	*	*			trans	100.5	121.2	132.4	-67.8	-12.1	0	0	0	115.3	S1161 C1165	S1161-N1163 PolarHBondContact O-N 3.42Å; N1163-C1165 PolarHBondContact O-N 3.45Å
1164	T	25.4	Very low	25.1	Very low	137.4 Å²	137.4	131 Å²	131	84%	0.843	76%	0.762	S	S	*	*				-100.5	126.2	125.9	45.7	0	0	0	0	113.8
1165	C	22.6	Very low	24.8	Very low	122.4 Å²	122.4	133.7 Å²	133.7	83%	0.827	77%	0.77	S	S	*	*			trans	-124.4	143.3	159.3	-77	0	0	0	0	110.3	N1163	N1163-C1165 PolarHBondContact O-N 3.45Å
1166	D	23	Very low	24.8	Very low	145.6 Å²	145.6	135.2 Å²	135.2	78%	0.779	78%	0.778	S	S	*	*			trans	-95.8	161	167.3	-83.9	-45.4	0	0	0	115.1	F1168	D1166-F1168 PolarHBondContact O-N 2.87Å
1167	P	28.8	Very low	24.5	Very low	110 Å²	110	135.2 Å²	135.2	71%	0.714	78%	0.779	S	S	*	*			trans	-88.9	135.2	-170	35.1	-33.4	0	0	0	113.1	L1169	P1167-L1169 PolarHBondContact O-N 2.84Å
1168	F	22.3	Very low	24.6	Very low	188.4 Å²	188.4	136.5 Å²	136.5	83%	0.826	78%	0.783	S	S	*	*			trans	-94.1	117	172.8	-77.1	-80.7	0	0	0	113.4	D1166 V1170	D1166-F1168 PolarHBondContact O-N 2.87Å; F1168-V1170 PolarHBondContact O-N 2.82Å
1169	L	24.9	Very low	24.5	Very low	161.2 Å²	161.2	136.6 Å²	136.6	84%	0.844	79%	0.785	S	S	*	*				96.5	107.4	124.4	-77	164.4	0	0	0	115.1	P1167 P1171	P1167-L1169 PolarHBondContact O-N 2.84Å; L1169-P1171 WeakPolarHBondContact O-CD 3.45Å
1170	V	23.3	Very low	24.5	Very low	121.2 Å²	121.2	136.1 Å²	136.1	74%	0.735	78%	0.782	S	S	*	*			trans	-83.5	127.8	166	173.4	0	0	0	0	108.8	F1168 T1172	F1168-V1170 PolarHBondContact O-N 2.82Å; V1170-T1172 HydrophobicContact CG1-CG2 4.03Å; V1170-T1172 PolarHBondContact O-N 2.93Å; V1170-T1172 VanDerWaalsContact O-N 3.12Å
1171	P	24.5	Very low	24.3	Very low	118.2 Å²	118.2	134.9 Å²	134.9	77%	0.768	78%	0.78	S	S	*	*			trans	-90.1	113.5	163.3	8.9	2.9	0	0	0	110.1	L1169 I1173	L1169-P1171 WeakPolarHBondContact O-CD 3.45Å; P1171-I1173 VanDerWaalsContact C-N 3.3Å; P1171-I1173 PolarHBondContact O-N 3.32Å
1172	T	22.4	Very low	24.4	Very low	122.2 Å²	122.2	136.2 Å²	136.2	75%	0.75	78%	0.777	S	S	*	*			trans	-68.4	127.7	168.9	20.5	0	0	0	0	110.3	V1170 N1174	V1170-T1172 HydrophobicContact CG1-CG2 4.03Å; V1170-T1172 PolarHBondContact O-N 2.93Å; V1170-T1172 VanDerWaalsContact O-N 3.12Å; T1172-N1174 PolarHBondContact O-N 3.11Å; T1172-N1174 VanDerWaalsContact O-N 3.12Å
1173	I	25.6	Very low	24.4	Very low	150.2 Å²	150.2	139.2 Å²	139.2	77%	0.77	78%	0.781	S	S	*	*			trans	-57.7	114.1	167.5	-61.6	170	0	0	0	109.4	P1171 N1175	P1171-I1173 VanDerWaalsContact C-N 3.3Å; P1171-I1173 PolarHBondContact O-N 3.32Å; I1173-N1175 WeakPolarHBondContact CG2-OD1 3.27Å; I1173-N1175 PolarHBondContact O-N 3.02Å
1174	N	25	Very low	24.5	Very low	144 Å²	144	138.9 Å²	138.9	77%	0.77	78%	0.778	S	S	*	*			trans	-95.1	140.3	163.4	-92.9	-19.7	0	0	0	110.9	T1172 T1176	T1172-N1174 PolarHBondContact O-N 3.11Å; T1172-N1174 VanDerWaalsContact O-N 3.12Å; N1174-T1176 PolarHBondContact O-N 2.88Å
1175	N	23.1	Very low	24.6	Very low	152 Å²	152	138.6 Å²	138.6	81%	0.813	77%	0.772	S	S	*	*			trans	-63.5	120.5	179.8	-60.2	-34.4	0	0	0	112.2	I1173	I1173-N1175 WeakPolarHBondContact CG2-OD1 3.27Å; I1173-N1175 PolarHBondContact O-N 3.02Å
1176	T	25.4	Very low	25.2	Very low	135.6 Å²	135.6	136 Å²	136	83%	0.832	76%	0.755	S	S	*	*			trans	-123.9	122.7	149.1	45.4	0	0	0	0	109.1	N1174 T1178	N1174-T1176 PolarHBondContact O-N 2.88Å; T1176-T1178 PolarHBondContact O-N 3.21Å; T1176-T1178 VanDerWaalsContact O-N 3.15Å
1177	T	23.6	Very low	26	Very low	128.6 Å²	128.6	132.1 Å²	132.1	79%	0.789	74%	0.739	S	S	*	*			trans	-78.5	111.8	-177.7	46.6	0	0	0	0	111.4
1178	T	25.8	Very low	26.9	Very low	120.2 Å²	120.2	130 Å²	130	74%	0.737	72%	0.722	S	S	*	*			trans	-137.9	117.6	155	50.6	0	0	0	0	109	T1176 D1180	T1176-T1178 PolarHBondContact O-N 3.21Å; T1176-T1178 VanDerWaalsContact O-N 3.15Å; T1178-D1180 VanDerWaalsContact CB-OD2 3.27Å; T1178-D1180 WeakPolarHBondContact CB-OD2 3.36Å; T1178-D1180 PolarHBondContact O-N 3.28Å; T1178-D1180 PolarHBondContact OG1-OD2 2.95Å
1179	N	24.3	Very low	28.2	Very low	154.4 Å²	154.4	121.6 Å²	121.6	83%	0.826	69%	0.688	S	S	*	*			trans	-78.2	68.6	-176.6	-72.8	-19.6	0	0	0	111.9	T1181	N1179-T1181 PolarHBondContact O-N 3.11Å
1180	D	24.6	Very low	29.7	Very low	135.2 Å²	135.2	118.7 Å²	118.7	72%	0.723	67%	0.666	S	S	*	*			trans	-97.8	85.1	168.4	-75.4	-25.9	0	0	0	109.4	T1178 I1182	T1178-D1180 VanDerWaalsContact CB-OD2 3.27Å; T1178-D1180 WeakPolarHBondContact CB-OD2 3.36Å; T1178-D1180 PolarHBondContact O-N 3.28Å; T1178-D1180 PolarHBondContact OG1-OD2 2.95Å; D1180-I1182 VanDerWaalsContact C-N 3.3Å; D1180-I1182 HydrophobicContact CB-CG1 4.18Å; D1180-I1182 PolarHBondContact O-N 3.1Å
1181	T	23.1	Very low	31.4	Very low	131.2 Å²	131.2	116 Å²	116	81%	0.805	65%	0.645	S	S	*	*			trans	-69.4	88.6	167.2	44.1	0	0	0	0	108.9	N1179 E1183	N1179-T1181 PolarHBondContact O-N 3.11Å; T1181-E1183 VanDerWaalsContact C-N 3.34Å; T1181-E1183 PolarHBondContact O-N 3.02Å; T1181-E1183 VanDerWaalsContact O-N 3.1Å
1182	I	25.7	Very low	33.1	Very low	135.6 Å²	135.6	112.8 Å²	112.8	70%	0.695	62%	0.622	S	S	*	*			trans	-74.3	96.7	172	-59.4	174.6	0	0	0	107.7	D1180 L1184	D1180-I1182 VanDerWaalsContact C-N 3.3Å; D1180-I1182 HydrophobicContact CB-CG1 4.18Å; D1180-I1182 PolarHBondContact O-N 3.1Å; I1182-L1184 HydrophobicContact CG2-CD2 4.34Å; I1182-L1184 HydrophobicContact CG2-CG 4.35Å; I1182-L1184 PolarHBondContact O-N 2.99Å; I1182-L1184 VanDerWaalsContact O-N 3.08Å
1183	E	23.6	Very low	35.1	Very low	161.4 Å²	161.4	107.4 Å²	107.4	75%	0.754	59%	0.589	S	S	*	*			trans	-63.8	106.8	166.5	-74.2	-170.1	153	0	0	109.2	T1181 N1185	T1181-E1183 VanDerWaalsContact C-N 3.34Å; T1181-E1183 PolarHBondContact O-N 3.02Å; T1181-E1183 VanDerWaalsContact O-N 3.1Å; E1183-N1185 VanDerWaalsContact C-N 3.27Å; E1183-N1185 HydrophobicContact CB-CB 4.27Å; E1183-N1185 PolarHBondContact O-N 2.9Å; E1183-N1185 PolarHBondContact OE2-ND2 3.04Å
1184	L	26.8	Very low	37	Very low	142.6 Å²	142.6	101.6 Å²	101.6	75%	0.747	56%	0.559	S	S	*	*			trans	-76.7	74.3	174.4	-81.1	152.8	0	0	0	110.8	F1106 I1182 S1186	F1106-L1184 HydrophobicContact CE1-CD2 3.75Å; F1106-L1184 HydrophobicContact CZ-CD2 3.95Å; I1182-L1184 HydrophobicContact CG2-CD2 4.34Å; I1182-L1184 HydrophobicContact CG2-CG 4.35Å; I1182-L1184 PolarHBondContact O-N 2.99Å; I1182-L1184 VanDerWaalsContact O-N 3.08Å; L1184-S1186 PolarHBondContact O-N 3.16Å; L1184-S1186 VanDerWaalsContact O-N 3.08Å
1185	N	28.1	Very low	38.7	Very low	130.8 Å²	130.8	99.7 Å²	99.7	70%	0.699	54%	0.544	S	S	*	.			trans	-76	77	171.7	-82.3	-34.9	0	0	0	111.2	E1183 S1187	E1183-N1185 VanDerWaalsContact C-N 3.27Å; E1183-N1185 HydrophobicContact CB-CB 4.27Å; E1183-N1185 PolarHBondContact O-N 2.9Å; E1183-N1185 PolarHBondContact OE2-ND2 3.04Å; N1185-S1187 VanDerWaalsContact C-N 3.32Å; N1185-S1187 PolarHBondContact O-N 3.17Å
1186	S	34.7	Very low	40.5	Very low	67.2 Å²	67.2	92.8 Å²	92.8	47%	0.47	51%	0.507	S	S	.	.			trans	-76.9	88.9	178.7	57.6	0	0	0	0	111.9	L1184 N1188 T1231	L1184-S1186 PolarHBondContact O-N 3.16Å; L1184-S1186 VanDerWaalsContact O-N 3.08Å; S1186-N1188 PolarHBondContact O-N 3.23Å; S1186-T1231 WeakPolarHBondContact O-CG2 3.24Å; S1186-T1231 VanDerWaalsContact OG-CG2 3.31Å; S1186-T1231 WeakPolarHBondContact OG-CG2 3.33Å
1187	S	39.8	Very low	41.9	Very low	64.4 Å²	64.4	91.6 Å²	91.6	45%	0.45	50%	0.495	S	S	.	.			trans	-98.7	85	176.7	58.5	0	0	0	0	112.2	L1110 E1111 R1112 N1185 G1189	L1110-S1187 CarbonylContact C-O 3.54Å; L1110-S1187 PolarHBondContact N-O 3.46Å; E1111-S1187 VanDerWaalsContact CD-O 3.31Å; E1111-S1187 WeakPolarHBondContact CG-O 3.35Å; E1111-S1187 VanDerWaalsContact OE1-CB 3.29Å; E1111-S1187 WeakPolarHBondContact OE1-CB 3.48Å; E1111-S1187 PolarHBondContact OE1-OG 3.1Å; R1112-S1187 PolarHBondContact NH2-O 2.87Å; R1112-S1187 PolarHBondContact NH2-OG 2.81Å; N1185-S1187 VanDerWaalsContact C-N 3.32Å; N1185-S1187 PolarHBondContact O-N 3.17Å; S1187-G1189 VanDerWaalsContact C-N 3.29Å; S1187-G1189 PolarHBondContact O-N 3.14Å
1188	N	47.4	Very low	43.4	Very low	66 Å²	66	92.6 Å²	92.6	35%	0.353	49%	0.49	S	S	.	.			trans	-78.4	59.2	175.5	-74.4	-16.9	0	0	0	112.2	K1107 L1108 S1109 S1186 P1227 T1229	K1107-N1188 WeakPolarHBondContact CB-ND2 3.5Å; L1108-N1188 PolarHBondContact O-ND2 3.43Å; L1108-N1188 PolarHBondContact O-OD1 3.12Å; S1109-N1188 VanDerWaalsContact CA-OD1 3.28Å; S1109-N1188 WeakPolarHBondContact CA-OD1 3.27Å; S1109-N1188 PolarHBondContact N-OD1 2.9Å; S1186-N1188 PolarHBondContact O-N 3.23Å; N1188-P1227 HydrophobicContact CB-CG 4.11Å; N1188-P1227 WeakPolarHBondContact O-CD 3.46Å; N1188-P1227 VanDerWaalsContact O-CG 3.32Å; N1188-P1227 WeakPolarHBondContact O-CG 3.42Å; N1188-T1229 VanDerWaalsContact C-CG2 3.5Å; N1188-T1229 HydrophobicContact CB-CG2 4.39Å; N1188-T1229 VanDerWaalsContact O-CG2 3.32Å; N1188-T1229 WeakPolarHBondContact O-CG2 3.45Å
1189	G	50.1	Low	45.1	Very low	12.4 Å²	12.4	87.2 Å²	87.2	13%	0.128	46%	0.458	C	S	.	.			trans	-96.5	133.5	-176.1	0	0	0	0	0	113.3	L1110 E1111 R1112 S1187	L1110-G1189 PolarHBondContact O-N 2.86Å; E1111-G1189 WeakPolarHBondContact CA-O 3.3Å; E1111-G1189 WeakPolarHBondContact CG-O 3.37Å; R1112-G1189 WeakPolarHBondContact CG-O 3.35Å; R1112-G1189 PolarHBondContact N-O 3.06Å; R1112-G1189 VanDerWaalsContact N-O 3.16Å; R1112-G1189 PolarHBondContact NE-O 3.47Å; R1112-G1189 VanDerWaalsContact NE-O 3.12Å; S1187-G1189 VanDerWaalsContact C-N 3.29Å; S1187-G1189 PolarHBondContact O-N 3.14Å
1190	W	55.7	Low	47.5	Very low	99.2 Å²	99.2	83.9 Å²	83.9	38%	0.376	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	130.6	164.3	-64.3	73.5	0	0	0	108.8	F1106 L1108 S1109 L1110 E1111 R1112 I1114 Q1224 Y1225 P1227	F1106-W1190 AromaticContact CD1-CH2 3.5Å; F1106-W1190 HydrophobicContact CD1-CH2 3.5Å; F1106-W1190 HydrophobicContact CD1-CZ3 4.01Å; F1106-W1190 AromaticContact CE1-CH2 3.58Å; F1106-W1190 HydrophobicContact CE1-CH2 3.58Å; F1106-W1190 AromaticContact CE1-CZ3 3.56Å; F1106-W1190 HydrophobicContact CE1-CZ3 3.56Å; F1106-W1190 HydrophobicContact CG-CH2 4.5Å; F1106-W1190 HydrophobicContact CZ-CZ3 4.36Å; L1108-W1190 WeakPolarHBondContact O-CH2 3.37Å; L1108-W1190 WeakPolarHBondContact O-CZ3 3.42Å; S1109-W1190 VanDerWaalsContact C-CZ3 3.42Å; S1109-W1190 VanDerWaalsContact CA-CZ3 3.5Å; L1110-W1190 VanDerWaalsContact CA-CZ3 3.4Å; L1110-W1190 HydrophobicContact CB-CZ3 4.03Å; L1110-W1190 VanDerWaalsContact O-CH2 3.3Å; L1110-W1190 WeakPolarHBondContact O-CH2 3.44Å; L1110-W1190 WeakPolarHBondContact O-CZ3 3.43Å; E1111-W1190 HydrophobicContact CG-CH2 4.4Å; E1111-W1190 HydrophobicContact CG-CZ2 4.34Å; R1112-W1190 HydrophobicContact CB-CD2 4.19Å; R1112-W1190 HydrophobicContact CB-CE3 4.04Å; R1112-W1190 HydrophobicContact CB-CZ3 4.24Å; R1112-W1190 VanDerWaalsContact NH1-CZ2 3.3Å; R1112-W1190 CarbonylContact O-C 3.53Å; R1112-W1190 VanDerWaalsContact O-CA 3.27Å; R1112-W1190 WeakPolarHBondContact O-CA 3.32Å; I1114-W1190 HydrophobicContact CD1-CE3 3.92Å; I1114-W1190 HydrophobicContact CD1-CZ3 3.93Å; I1114-W1190 HydrophobicContact CG1-CE3 4.1Å; I1114-W1190 HydrophobicContact CG1-CZ3 4.1Å; W1190-Q1224 WeakPolarHBondContact O-CA 3.48Å; W1190-Y1225 PolarHBondContact N-O 3.27Å; W1190-Y1225 CarbonylContact O-C 3.53Å; W1190-Y1225 PolarHBondContact O-N 3.19Å; W1190-P1227 HydrophobicContact CB-CG 3.98Å; W1190-P1227 HydrophobicContact CG-CG 4.02Å; W1190-P1227 WeakPolarHBondContact O-CD 3.29Å
1191	H	58.8	Low	50	Low	63.6 Å²	63.6	79.4 Å²	79.4	29%	0.294	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	110.9	175.2	-173.7	-39.9	0	0	0	109.6	R1112 S1113 I1114 S1193 Q1224 T1226	R1112-H1191 HydrophobicContact CG-CB 4.39Å; R1112-H1191 WeakPolarHBondContact O-CA 3.35Å; R1112-H1191 PolarHBondContact O-N 2.99Å; R1112-H1191 VanDerWaalsContact O-O 3.08Å; S1113-H1191 CarbonylContact C-O 3.48Å; S1113-H1191 VanDerWaalsContact CA-O 3.3Å; S1113-H1191 WeakPolarHBondContact CA-O 3.4Å; S1113-H1191 PolarHBondContact N-O 3.45Å; I1114-H1191 PolarHBondContact N-O 3.25Å; H1191-S1193 PolarHBondContact CE1-OG 2.86Å; H1191-Q1224 PolarHBondContact CD2-NE2 3.26Å; H1191-Q1224 VanDerWaalsContact CD2-NE2 3.31Å; H1191-Q1224 WeakPolarHBondContact NE2-CG 3.48Å; H1191-Q1224 PolarHBondContact NE2-NE2 3.17Å; H1191-T1226 WeakPolarHBondContact ND1-CG2 3.39Å
1192	L	62.2	Low	52.8	Low	52.2 Å²	52.2	74.3 Å²	74.3	27%	0.273	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	110.9	174	173.4	63.7	0	0	0	108.3	I1114 I1116 I1194 F1223 Q1224 Y1225	I1114-L1192 HydrophobicContact CB-CD1 3.78Å; I1114-L1192 HydrophobicContact CD1-CD1 4.13Å; I1114-L1192 HydrophobicContact CG1-CD1 4.45Å; I1114-L1192 HydrophobicContact CG2-CD1 3.65Å; I1114-L1192 VanDerWaalsContact CG2-CD1 3.46Å; I1114-L1192 CarbonylContact O-C 3.5Å; I1114-L1192 WeakPolarHBondContact O-CA 3.41Å; I1116-L1192 HydrophobicContact CD1-CD1 3.91Å; I1116-L1192 HydrophobicContact CG1-CD1 4.15Å; L1192-I1194 HydrophobicContact CD1-CG1 4.25Å; L1192-I1194 HydrophobicContact CD2-CD1 4.41Å; L1192-I1194 HydrophobicContact CG-CD1 4.49Å; L1192-I1194 HydrophobicContact CG-CG1 4.28Å; L1192-F1223 CarbonylContact C-O 3.57Å; L1192-F1223 WeakPolarHBondContact CA-O 3.21Å; L1192-F1223 HydrophobicContact CB-CB 4.23Å; L1192-F1223 HydrophobicContact CB-CD1 4.12Å; L1192-F1223 HydrophobicContact CB-CG 4.49Å; L1192-F1223 HydrophobicContact CD2-CB 4.48Å; L1192-F1223 HydrophobicContact CD2-CD1 4.12Å; L1192-F1223 HydrophobicContact CD2-CE1 4.02Å; L1192-F1223 HydrophobicContact CG-CD1 4.12Å; L1192-F1223 HydrophobicContact CG-CE1 4.37Å; L1192-F1223 PolarHBondContact N-O 2.94Å; L1192-F1223 CarbonylContact O-C 3.43Å; L1192-F1223 VanDerWaalsContact O-CA 3.31Å; L1192-F1223 WeakPolarHBondContact O-CA 3.44Å; L1192-F1223 WeakPolarHBondContact O-CB 3.44Å; L1192-F1223 PolarHBondContact O-N 3.18Å; L1192-Q1224 CarbonylContact O-C 3.58Å; L1192-Q1224 VanDerWaalsContact O-CA 3.3Å; L1192-Q1224 WeakPolarHBondContact O-CA 3.38Å; L1192-Y1225 PolarHBondContact N-O 2.86Å; L1192-Y1225 PolarHBondContact O-N 3.45Å
1193	S	63.8	Low	55.7	Low	7.8 Å²	7.8	70.9 Å²	70.9	6%	0.055	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	114.7	174.3	141.5	0	0	0	0	110.4	I1114 E1115 I1116 H1191 K1195 F1223	I1114-S1193 CarbonylContact O-C 3.54Å; I1114-S1193 WeakPolarHBondContact O-CA 3.4Å; I1114-S1193 PolarHBondContact O-N 3.11Å; I1114-S1193 PolarHBondContact O-OG 3.33Å; E1115-S1193 CarbonylContact C-O 3.55Å; E1115-S1193 VanDerWaalsContact CA-O 3.3Å; E1115-S1193 WeakPolarHBondContact CA-O 3.29Å; E1115-S1193 WeakPolarHBondContact OE1-CB 3.43Å; E1115-S1193 PolarHBondContact OE1-OG 3.2Å; E1115-S1193 WeakPolarHBondContact OE2-CB 3.42Å; E1115-S1193 PolarHBondContact OE2-OG 3.2Å; I1116-S1193 PolarHBondContact N-O 3.11Å; H1191-S1193 PolarHBondContact CE1-OG 2.86Å; S1193-K1195 PolarHBondContact O-N 3.2Å; S1193-K1195 WeakPolarHBondContact OG-CE 3.27Å; S1193-K1195 WeakPolarHBondContact OG-CG 3.23Å; S1193-F1223 CarbonylContact C-O 3.58Å; S1193-F1223 VanDerWaalsContact CA-O 3.24Å; S1193-F1223 WeakPolarHBondContact CA-O 3.31Å
1194	I	65	Low	58.6	Low	29.6 Å²	29.6	66.4 Å²	66.4	15%	0.152	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	107.7	173	-50.1	179.9	0	0	0	106.6	I1116 L1192 P1196 F1201 T1221 S1222 F1223	I1116-I1194 HydrophobicContact CB-CB 4.48Å; I1116-I1194 HydrophobicContact CB-CG1 4.32Å; I1116-I1194 HydrophobicContact CB-CG2 4.19Å; I1116-I1194 HydrophobicContact CD1-CD1 4.25Å; I1116-I1194 HydrophobicContact CD1-CG1 4.23Å; I1116-I1194 HydrophobicContact CG1-CG1 4.4Å; I1116-I1194 HydrophobicContact CG2-CG2 4.37Å; I1116-I1194 CarbonylContact O-C 3.33Å; I1116-I1194 WeakPolarHBondContact O-CA 3.3Å; L1192-I1194 HydrophobicContact CD1-CG1 4.25Å; L1192-I1194 HydrophobicContact CD2-CD1 4.41Å; L1192-I1194 HydrophobicContact CG-CD1 4.49Å; L1192-I1194 HydrophobicContact CG-CG1 4.28Å; I1194-P1196 VanDerWaalsContact C-CD 3.46Å; I1194-P1196 VanDerWaalsContact O-CD 3.26Å; I1194-P1196 WeakPolarHBondContact O-CD 3.31Å; I1194-F1201 HydrophobicContact CG2-CD2 4.2Å; I1194-F1201 HydrophobicContact CG2-CE2 3.37Å; I1194-F1201 HydrophobicContact CG2-CZ 3.62Å; I1194-T1221 CarbonylContact C-O 3.52Å; I1194-T1221 WeakPolarHBondContact CB-O 3.25Å; I1194-T1221 WeakPolarHBondContact CB-OG1 3.44Å; I1194-T1221 PolarHBondContact N-O 3.33Å; I1194-T1221 CarbonylContact O-C 3.47Å; I1194-T1221 PolarHBondContact O-N 3.38Å; I1194-S1222 VanDerWaalsContact O-CA 3.27Å; I1194-S1222 WeakPolarHBondContact O-CA 3.38Å; I1194-F1223 HydrophobicContact CB-CB 4.22Å; I1194-F1223 HydrophobicContact CD1-CB 4.39Å; I1194-F1223 HydrophobicContact CD1-CD1 4.02Å; I1194-F1223 HydrophobicContact CD1-CG 4.38Å; I1194-F1223 HydrophobicContact CG1-CB 4.43Å; I1194-F1223 HydrophobicContact CG1-CD1 4.19Å; I1194-F1223 PolarHBondContact N-O 3.06Å; I1194-F1223 PolarHBondContact O-N 3.12Å
1195	K	61.9	Low	61.4	Low	104 Å²	104	62.6 Å²	62.6	45%	0.452	31%	0.31	S	S	.	.			trans	-117.9	86.5	179.2	-66.6	-171.8	-161.4	135.2	0	109.6	E1115 I1116 S1193 I1197	E1115-K1195 VanDerWaalsContact OE1-CD 3.3Å; E1115-K1195 WeakPolarHBondContact OE1-CD 3.3Å; E1115-K1195 VanDerWaalsContact OE1-CE 3.26Å; E1115-K1195 WeakPolarHBondContact OE1-CE 3.48Å; E1115-K1195 WeakPolarHBondContact OE1-CG 3.25Å; E1115-K1195 IonicContact OE1-NZ 3.17Å; E1115-K1195 PolarHBondContact OE1-NZ 3.06Å; E1115-K1195 WeakPolarHBondContact OE2-CE 3.26Å; E1115-K1195 IonicContact OE2-NZ 3Å; E1115-K1195 PolarHBondContact OE2-NZ 2.76Å; I1116-K1195 CarbonylContact O-C 3.35Å; I1116-K1195 PolarHBondContact O-N 3.15Å; I1116-K1195 VanDerWaalsContact O-N 3.12Å; I1116-K1195 VanDerWaalsContact O-O 3.09Å; S1193-K1195 PolarHBondContact O-N 3.2Å; S1193-K1195 WeakPolarHBondContact OG-CE 3.27Å; S1193-K1195 WeakPolarHBondContact OG-CG 3.23Å; K1195-I1197 PolarHBondContact O-N 3.06Å
1196	P	59.4	Low	64	Low	7.2 Å²	7.2	61.9 Å²	61.9	5%	0.047	30%	0.3	C	S	.	.			trans	-67.3	124.5	172	29.9	-33.1	0	0	0	109.6	P1118 I1194 Q1198 S1199 F1201 N1220 T1221	P1118-P1196 HydrophobicContact CG-CB 3.84Å; I1194-P1196 VanDerWaalsContact C-CD 3.46Å; I1194-P1196 VanDerWaalsContact O-CD 3.26Å; I1194-P1196 WeakPolarHBondContact O-CD 3.31Å; P1196-Q1198 VanDerWaalsContact C-N 3.32Å; P1196-Q1198 PolarHBondContact O-N 3.12Å; P1196-S1199 VanDerWaalsContact CB-O 3.24Å; P1196-S1199 WeakPolarHBondContact CB-O 3.36Å; P1196-S1199 WeakPolarHBondContact CB-OG 3.32Å; P1196-S1199 VanDerWaalsContact CG-O 3.27Å; P1196-S1199 WeakPolarHBondContact CG-O 3.2Å; P1196-F1201 HydrophobicContact CB-CE2 3.97Å; P1196-F1201 HydrophobicContact CB-CZ 4.27Å; P1196-F1201 HydrophobicContact CG-CD2 4.37Å; P1196-F1201 HydrophobicContact CG-CE2 4.02Å; P1196-N1220 WeakPolarHBondContact CD-OD1 3.33Å; P1196-N1220 PolarHBondContact O-OD1 3.24Å; P1196-T1221 WeakPolarHBondContact CD-O 3.29Å; P1196-T1221 WeakPolarHBondContact CG-O 3.48Å
1197	I	54.8	Low	66.4	Low	111 Å²	111	59.5 Å²	59.5	57%	0.569	28%	0.283	S	S	*	.	S	Bend	trans	-75.2	2.6	-179	-56.8	170.7	0	0	0	108.8	N1120 K1195 S1199	N1120-I1197 VanDerWaalsContact OD1-C 3.28Å; N1120-I1197 WeakPolarHBondContact OD1-CG2 3.28Å; N1120-I1197 PolarHBondContact OD1-O 3.14Å; K1195-I1197 PolarHBondContact O-N 3.06Å; I1197-S1199 PolarHBondContact O-N 2.86Å; I1197-S1199 PolarHBondContact O-OG 3.09Å
1198	Q	55.6	Low	68.2	Low	147.6 Å²	147.6	58.9 Å²	58.9	69%	0.69	27%	0.274	S	S	*	.	S	Bend	trans	-157.3	-1.4	174.8	-63.4	-176.8	-19.4	0	0	115.6	N1120 P1196 K1219	N1120-Q1198 PolarHBondContact ND2-OE1 2.91Å; N1120-Q1198 WeakPolarHBondContact OD1-CB 3.15Å; N1120-Q1198 PolarHBondContact OD1-OE1 3.14Å; P1196-Q1198 VanDerWaalsContact C-N 3.32Å; P1196-Q1198 PolarHBondContact O-N 3.12Å; Q1198-K1219 PolarHBondContact O-NZ 3.14Å
1199	S	62.1	Low	69.4	Low	7.6 Å²	7.6	58.5 Å²	58.5	5%	0.053	27%	0.274	C	S	.	.			trans	-94.9	163.5	-175.1	11.3	0	0	0	0	113.1	P1118 N1119 N1120 Q1121 P1196 I1197 K1219	P1118-S1199 WeakPolarHBondContact CG-OG 3.24Å; P1118-S1199 PolarHBondContact O-OG 3.36Å; N1119-S1199 PolarHBondContact O-OG 2.9Å; N1119-S1199 VanDerWaalsContact O-OG 3.04Å; N1120-S1199 WeakPolarHBondContact CA-OG 3.39Å; Q1121-S1199 VanDerWaalsContact C-OG 3.27Å; Q1121-S1199 PolarHBondContact N-OG 2.78Å; Q1121-S1199 VanDerWaalsContact N-OG 3.11Å; Q1121-S1199 VanDerWaalsContact O-CB 3.24Å; Q1121-S1199 WeakPolarHBondContact O-CB 3.41Å; Q1121-S1199 PolarHBondContact O-OG 3.14Å; P1196-S1199 VanDerWaalsContact CB-O 3.24Å; P1196-S1199 WeakPolarHBondContact CB-O 3.36Å; P1196-S1199 WeakPolarHBondContact CB-OG 3.32Å; P1196-S1199 VanDerWaalsContact CG-O 3.27Å; P1196-S1199 WeakPolarHBondContact CG-O 3.2Å; I1197-S1199 PolarHBondContact O-N 2.86Å; I1197-S1199 PolarHBondContact O-OG 3.09Å; S1199-K1219 WeakPolarHBondContact O-CE 3.34Å
1200	Y	74.9	Confident	70.3	Confident	85.6 Å²	85.6	65.6 Å²	65.6	34%	0.336	31%	0.309	S	S	.	.			trans	-113.5	146.8	169.6	40.2	-98.1	0	0	0	109.6	S1122 C1123 Q1202 R1217 V1218	S1122-Y1200 VanDerWaalsContact CB-CE2 3.48Å; S1122-Y1200 VanDerWaalsContact CB-OH 3.22Å; S1122-Y1200 WeakPolarHBondContact CB-OH 3.34Å; S1122-Y1200 PolarHBondContact OG-OH 3.02Å; C1123-Y1200 PolarHBondContact N-O 3.24Å; Y1200-Q1202 HydrophobicContact CD2-CG 3.67Å; Y1200-Q1202 HydrophobicContact CE2-CG 3.82Å; Y1200-Q1202 VanDerWaalsContact CE2-CG 3.41Å; Y1200-Q1202 VanDerWaalsContact CE2-NE2 3.25Å; Y1200-R1217 HydrophobicContact CD1-CG 4.33Å; Y1200-R1217 HydrophobicContact CD2-CG 3.96Å; Y1200-R1217 HydrophobicContact CG-CG 3.86Å; Y1200-V1218 CarbonylContact C-O 3.5Å; Y1200-V1218 VanDerWaalsContact CA-O 3.31Å; Y1200-V1218 WeakPolarHBondContact CA-O 3.38Å
1201	F	76.6	Confident	71.3	Confident	41 Å²	41	68.7 Å²	68.7	18%	0.18	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	136.2	165.8	-87.1	-80.7	0	0	0	109.4	L1077 L1079 P1118 C1123 F1125 I1194 P1196 F1203 R1217 V1218	L1077-F1201 HydrophobicContact CD1-CZ 4.41Å; L1079-F1201 HydrophobicContact CD2-CE2 3.65Å; L1079-F1201 HydrophobicContact CD2-CZ 3.94Å; P1118-F1201 HydrophobicContact CG-CE2 4.24Å; P1118-F1201 HydrophobicContact CG-CZ 3.94Å; C1123-F1201 HydrophobicContact CB-CD1 3.42Å; C1123-F1201 VanDerWaalsContact CB-CD1 3.43Å; C1123-F1201 HydrophobicContact CB-CD2 3.54Å; C1123-F1201 HydrophobicContact CB-CE1 3.41Å; C1123-F1201 HydrophobicContact CB-CE2 3.53Å; C1123-F1201 HydrophobicContact CB-CG 4.28Å; C1123-F1201 HydrophobicContact CB-CZ 4.17Å; C1123-F1201 CarbonylContact O-C 3.5Å; C1123-F1201 WeakPolarHBondContact O-CA 3.34Å; F1125-F1201 HydrophobicContact CB-CE1 3.98Å; I1194-F1201 HydrophobicContact CG2-CD2 4.2Å; I1194-F1201 HydrophobicContact CG2-CE2 3.37Å; I1194-F1201 HydrophobicContact CG2-CZ 3.62Å; P1196-F1201 HydrophobicContact CB-CE2 3.97Å; P1196-F1201 HydrophobicContact CB-CZ 4.27Å; P1196-F1201 HydrophobicContact CG-CD2 4.37Å; P1196-F1201 HydrophobicContact CG-CE2 4.02Å; F1201-F1203 HydrophobicContact CB-CE2 3.98Å; F1201-F1203 HydrophobicContact CB-CZ 4.23Å; F1201-F1203 HydrophobicContact CD1-CD1 4.16Å; F1201-F1203 AromaticContact CD1-CD2 3.91Å; F1201-F1203 HydrophobicContact CD1-CD2 3.91Å; F1201-F1203 AromaticContact CD1-CE1 3.73Å; F1201-F1203 HydrophobicContact CD1-CE1 3.73Å; F1201-F1203 AromaticContact CD1-CE2 3.45Å; F1201-F1203 HydrophobicContact CD1-CE2 3.45Å; F1201-F1203 VanDerWaalsContact CD1-CE2 3.45Å; F1201-F1203 HydrophobicContact CD1-CG 4.24Å; F1201-F1203 AromaticContact CD1-CZ 3.34Å; F1201-F1203 HydrophobicContact CD1-CZ 3.34Å; F1201-F1203 AromaticContact CE1-CD1 3.97Å; F1201-F1203 HydrophobicContact CE1-CD1 3.97Å; F1201-F1203 AromaticContact CE1-CE1 3.49Å; F1201-F1203 HydrophobicContact CE1-CE1 3.49Å; F1201-F1203 VanDerWaalsContact CE1-CE1 3.49Å; F1201-F1203 HydrophobicContact CE1-CE2 4.12Å; F1201-F1203 HydrophobicContact CE1-CG 4.46Å; F1201-F1203 AromaticContact CE1-CZ 3.57Å; F1201-F1203 HydrophobicContact CE1-CZ 3.57Å; F1201-F1203 HydrophobicContact CG-CE2 4.13Å; F1201-F1203 HydrophobicContact CG-CZ 4.1Å; F1201-F1203 HydrophobicContact CZ-CE1 4.4Å; F1201-F1203 HydrophobicContact CZ-CZ 4.46Å; F1201-R1217 CarbonylContact O-C 3.54Å; F1201-R1217 VanDerWaalsContact O-CA 3.3Å; F1201-R1217 WeakPolarHBondContact O-CA 3.24Å; F1201-V1218 HydrophobicContact CB-CB 4.47Å; F1201-V1218 HydrophobicContact CB-CG2 3.68Å; F1201-V1218 HydrophobicContact CD2-CG2 4.37Å; F1201-V1218 HydrophobicContact CG-CG2 4.46Å; F1201-V1218 PolarHBondContact N-O 3.14Å; F1201-V1218 PolarHBondContact O-N 2.98Å
1202	Q	82.3	Confident	72.6	Confident	22.6 Å²	22.6	67.2 Å²	67.2	11%	0.106	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	123.3	172.1	-79.5	-178.9	-18.2	0	0	110.2	C1123 E1124 F1125 Y1200 Y1204 M1215 V1216 R1217	C1123-Q1202 PolarHBondContact O-N 3.24Å; E1124-Q1202 WeakPolarHBondContact CA-O 3.28Å; E1124-Q1202 HydrophobicContact CG-CB 4.38Å; F1125-Q1202 PolarHBondContact N-O 3.06Å; Y1200-Q1202 HydrophobicContact CD2-CG 3.67Å; Y1200-Q1202 HydrophobicContact CE2-CG 3.82Å; Y1200-Q1202 VanDerWaalsContact CE2-CG 3.41Å; Y1200-Q1202 VanDerWaalsContact CE2-NE2 3.25Å; Q1202-Y1204 HydrophobicContact CB-CD2 4.29Å; Q1202-Y1204 HydrophobicContact CB-CE2 3.77Å; Q1202-Y1204 VanDerWaalsContact OE1-CE2 3.3Å; Q1202-Y1204 VanDerWaalsContact OE1-CZ 3.24Å; Q1202-Y1204 PolarHBondContact OE1-OH 3.1Å; Q1202-M1215 HydrophobicContact CB-CG 4.48Å; Q1202-M1215 HydrophobicContact CB-SD 4.04Å; Q1202-M1215 HydrophobicContact CG-CE 4.06Å; Q1202-M1215 HydrophobicContact CG-SD 3.88Å; Q1202-M1215 PolarHBondContact NE2-SD 3.23Å; Q1202-M1215 VanDerWaalsContact NE2-SD 3.41Å; Q1202-V1216 CarbonylContact C-O 3.55Å; Q1202-V1216 WeakPolarHBondContact CA-O 3.21Å; Q1202-R1217 HydrophobicContact CG-CB 4.35Å; Q1202-R1217 HydrophobicContact CG-CG 4.12Å; Q1202-R1217 VanDerWaalsContact NE2-NE 3.13Å; Q1202-R1217 VanDerWaalsContact NE2-NH2 3.13Å; Q1202-R1217 VanDerWaalsContact OE1-CZ 3.26Å
1203	F	85	Confident	73.7	Confident	64.8 Å²	64.8	67.3 Å²	67.3	28%	0.284	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	113.5	173	-56.4	-89.6	0	0	0	108.8	F1125 F1201 F1205 M1215 V1216 V1218	F1125-F1203 HydrophobicContact CB-CD1 3.92Å; F1125-F1203 HydrophobicContact CB-CE1 4.28Å; F1125-F1203 AromaticContact CD1-CD1 3.68Å; F1125-F1203 HydrophobicContact CD1-CD1 3.68Å; F1125-F1203 HydrophobicContact CD1-CE1 4.39Å; F1125-F1203 HydrophobicContact CE1-CD1 4.49Å; F1125-F1203 HydrophobicContact CG-CD1 4.13Å; F1125-F1203 CarbonylContact O-C 3.51Å; F1125-F1203 WeakPolarHBondContact O-CA 3.2Å; F1201-F1203 HydrophobicContact CB-CE2 3.98Å; F1201-F1203 HydrophobicContact CB-CZ 4.23Å; F1201-F1203 HydrophobicContact CD1-CD1 4.16Å; F1201-F1203 AromaticContact CD1-CD2 3.91Å; F1201-F1203 HydrophobicContact CD1-CD2 3.91Å; F1201-F1203 AromaticContact CD1-CE1 3.73Å; F1201-F1203 HydrophobicContact CD1-CE1 3.73Å; F1201-F1203 AromaticContact CD1-CE2 3.45Å; F1201-F1203 HydrophobicContact CD1-CE2 3.45Å; F1201-F1203 VanDerWaalsContact CD1-CE2 3.45Å; F1201-F1203 HydrophobicContact CD1-CG 4.24Å; F1201-F1203 AromaticContact CD1-CZ 3.34Å; F1201-F1203 HydrophobicContact CD1-CZ 3.34Å; F1201-F1203 AromaticContact CE1-CD1 3.97Å; F1201-F1203 HydrophobicContact CE1-CD1 3.97Å; F1201-F1203 AromaticContact CE1-CE1 3.49Å; F1201-F1203 HydrophobicContact CE1-CE1 3.49Å; F1201-F1203 VanDerWaalsContact CE1-CE1 3.49Å; F1201-F1203 HydrophobicContact CE1-CE2 4.12Å; F1201-F1203 HydrophobicContact CE1-CG 4.46Å; F1201-F1203 AromaticContact CE1-CZ 3.57Å; F1201-F1203 HydrophobicContact CE1-CZ 3.57Å; F1201-F1203 HydrophobicContact CG-CE2 4.13Å; F1201-F1203 HydrophobicContact CG-CZ 4.1Å; F1201-F1203 HydrophobicContact CZ-CE1 4.4Å; F1201-F1203 HydrophobicContact CZ-CZ 4.46Å; F1203-F1205 HydrophobicContact CB-CD2 4.42Å; F1203-F1205 HydrophobicContact CB-CE2 3.57Å; F1203-F1205 HydrophobicContact CB-CZ 3.91Å; F1203-F1205 HydrophobicContact CG-CZ 4.42Å; F1203-F1205 WeakPolarHBondContact O-CD2 3.37Å; F1203-F1205 WeakPolarHBondContact O-CE2 3.4Å; F1203-M1215 CarbonylContact O-C 3.54Å; F1203-M1215 VanDerWaalsContact O-CA 3.31Å; F1203-M1215 WeakPolarHBondContact O-CA 3.45Å; F1203-V1216 HydrophobicContact CB-CB 4.31Å; F1203-V1216 HydrophobicContact CD2-CB 4.35Å; F1203-V1216 PolarHBondContact N-O 3.2Å; F1203-V1216 PolarHBondContact O-N 3.02Å; F1203-V1218 HydrophobicContact CD2-CG2 4.15Å; F1203-V1218 HydrophobicContact CE2-CG2 3.94Å
1204	Y	85	Confident	75	Confident	67 Å²	67	68.1 Å²	68.1	26%	0.263	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	126.2	174.5	-82	-92.3	0	0	0	109.6	E1124 F1125 I1126 W1127 Q1202 K1206 F1213 I1214 M1215	E1124-Y1204 HydrophobicContact CB-CE2 4.43Å; E1124-Y1204 HydrophobicContact CG-CE2 4.28Å; F1125-Y1204 PolarHBondContact O-N 3.11Å; I1126-Y1204 CarbonylContact C-O 3.59Å; I1126-Y1204 HydrophobicContact CG1-CD2 4.17Å; I1126-Y1204 HydrophobicContact CG1-CG 4.32Å; W1127-Y1204 WeakPolarHBondContact CA-O 3.41Å; W1127-Y1204 WeakPolarHBondContact CB-O 3.41Å; W1127-Y1204 PolarHBondContact N-O 3.14Å; Q1202-Y1204 HydrophobicContact CB-CD2 4.29Å; Q1202-Y1204 HydrophobicContact CB-CE2 3.77Å; Q1202-Y1204 VanDerWaalsContact OE1-CE2 3.3Å; Q1202-Y1204 VanDerWaalsContact OE1-CZ 3.24Å; Q1202-Y1204 PolarHBondContact OE1-OH 3.1Å; Y1204-K1206 HydrophobicContact CD1-CG 4.3Å; Y1204-K1206 HydrophobicContact CE1-CG 3.71Å; Y1204-F1213 HydrophobicContact CD1-CD2 4.33Å; Y1204-F1213 HydrophobicContact CD1-CE2 4.4Å; Y1204-F1213 HydrophobicContact CE1-CB 3.95Å; Y1204-F1213 HydrophobicContact CE1-CD2 4.35Å; Y1204-F1213 HydrophobicContact CE1-CE2 4.48Å; Y1204-F1213 HydrophobicContact CE1-CG 4.32Å; Y1204-F1213 AromaticContact CE2-CD2 3.66Å; Y1204-F1213 HydrophobicContact CE2-CD2 3.66Å; Y1204-F1213 AromaticContact CE2-CE2 3.96Å; Y1204-F1213 HydrophobicContact CE2-CE2 3.96Å; Y1204-F1213 HydrophobicContact CE2-CG 4.34Å; Y1204-F1213 AromaticContact CZ-CD2 3.52Å; Y1204-F1213 AromaticContact CZ-CG 3.73Å; Y1204-F1213 VanDerWaalsContact OH-CD2 3.31Å; Y1204-F1213 WeakPolarHBondContact OH-CD2 3.23Å; Y1204-F1213 WeakPolarHBondContact OH-CG 3.35Å; Y1204-I1214 CarbonylContact C-O 3.53Å; Y1204-M1215 HydrophobicContact CD1-CB 4.05Å; Y1204-M1215 HydrophobicContact CD1-CG 3.7Å; Y1204-M1215 VanDerWaalsContact CD1-CG 3.48Å; Y1204-M1215 HydrophobicContact CD1-SD 3.64Å; Y1204-M1215 HydrophobicContact CD2-CG 3.94Å; Y1204-M1215 VanDerWaalsContact CD2-CG 3.48Å; Y1204-M1215 HydrophobicContact CD2-SD 3.62Å; Y1204-M1215 HydrophobicContact CE1-CB 4.15Å; Y1204-M1215 HydrophobicContact CE1-CE 4.06Å; Y1204-M1215 HydrophobicContact CE1-CG 3.62Å; Y1204-M1215 VanDerWaalsContact CE1-CG 3.49Å; Y1204-M1215 HydrophobicContact CE1-SD 3.52Å; Y1204-M1215 WeakPolarHBondContact CE1-SD 3.34Å; Y1204-M1215 HydrophobicContact CE2-CG 4.12Å; Y1204-M1215 HydrophobicContact CE2-SD 4.12Å; Y1204-M1215 HydrophobicContact CG-CB 4.38Å; Y1204-M1215 HydrophobicContact CG-CG 4.16Å
1205	F	85.9	Confident	76.1	Confident	63 Å²	63	67.2 Å²	67.2	28%	0.276	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	104.6	176.9	-60.5	-88.1	0	0	0	108.9	W1127 F1203 F1213 I1214 V1216	W1127-F1205 HydrophobicContact CB-CD1 3.69Å; W1127-F1205 HydrophobicContact CB-CE1 4.04Å; W1127-F1205 HydrophobicContact CB-CG 4.41Å; W1127-F1205 AromaticContact CD2-CD1 3.88Å; W1127-F1205 HydrophobicContact CD2-CD1 3.88Å; W1127-F1205 HydrophobicContact CD2-CE1 4.45Å; W1127-F1205 HydrophobicContact CE3-CB 4.29Å; W1127-F1205 AromaticContact CE3-CD1 3.85Å; W1127-F1205 HydrophobicContact CE3-CD1 3.85Å; W1127-F1205 HydrophobicContact CE3-CG 4.48Å; W1127-F1205 AromaticContact CG-CD1 3.84Å; W1127-F1205 HydrophobicContact CG-CD1 3.84Å; W1127-F1205 HydrophobicContact CG-CE1 4.13Å; F1203-F1205 HydrophobicContact CB-CD2 4.42Å; F1203-F1205 HydrophobicContact CB-CE2 3.57Å; F1203-F1205 HydrophobicContact CB-CZ 3.91Å; F1203-F1205 HydrophobicContact CG-CZ 4.42Å; F1203-F1205 WeakPolarHBondContact O-CD2 3.37Å; F1203-F1205 WeakPolarHBondContact O-CE2 3.4Å; F1205-F1213 CarbonylContact O-C 3.54Å; F1205-F1213 VanDerWaalsContact O-CA 3.28Å; F1205-F1213 WeakPolarHBondContact O-CA 3.32Å; F1205-I1214 HydrophobicContact CB-CB 4.38Å; F1205-I1214 PolarHBondContact N-O 3.34Å; F1205-I1214 PolarHBondContact O-N 3.28Å; F1205-V1216 HydrophobicContact CD2-CG2 4.25Å; F1205-V1216 HydrophobicContact CE2-CB 4.36Å; F1205-V1216 HydrophobicContact CE2-CG2 3.81Å
1206	K	83.5	Confident	77.4	Confident	115.4 Å²	115.4	63.4 Å²	63.4	50%	0.502	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	132	169.3	-66.9	-176.9	177.6	177.9	0	109.1	I1126 W1127 Y1204 N1210	I1126-K1206 HydrophobicContact CG2-CD 4.21Å; I1126-K1206 HydrophobicContact CG2-CG 4.41Å; W1127-K1206 WeakPolarHBondContact CZ3-O 3.36Å; W1127-K1206 PolarHBondContact O-N 3.12Å; Y1204-K1206 HydrophobicContact CD1-CG 4.3Å; Y1204-K1206 HydrophobicContact CE1-CG 3.71Å; K1206-N1210 WeakPolarHBondContact CD-OD1 3.41Å
1207	L	84.6	Confident	78.7	Confident	18.2 Å²	18.2	66.9 Å²	66.9	10%	0.095	31%	0.313	C	S	.	.			trans	-90.1	-155.2	-179.3	-64.1	177.5	0	0	0	111.4	T1209 N1210 H1212 I1214 V1343 E1346 A1347 V1350	L1207-T1209 VanDerWaalsContact C-N 3.31Å; L1207-T1209 PolarHBondContact O-N 2.93Å; L1207-N1210 PolarHBondContact O-N 3.19Å; L1207-H1212 HydrophobicContact CB-CB 4.38Å; L1207-H1212 WeakPolarHBondContact CB-O 3.28Å; L1207-H1212 HydrophobicContact CD1-CB 3.93Å; L1207-H1212 PolarHBondContact N-O 3.2Å; L1207-I1214 HydrophobicContact CD1-CD1 4.21Å; L1207-I1214 HydrophobicContact CD1-CG1 4.17Å; L1207-I1214 HydrophobicContact CD2-CD1 4.3Å; L1207-V1343 HydrophobicContact CD1-CG1 3.73Å; L1207-E1346 HydrophobicContact CB-CB 4.1Å; L1207-E1346 VanDerWaalsContact CB-OE2 3.28Å; L1207-E1346 WeakPolarHBondContact CB-OE2 3.28Å; L1207-E1346 HydrophobicContact CD1-CB 4.08Å; L1207-A1347 HydrophobicContact CD1-CB 4.42Å; L1207-A1347 HydrophobicContact CD2-CB 4.1Å; L1207-V1350 HydrophobicContact CD2-CG2 4.3Å
1208	L	77.6	Confident	80.2	Confident	51.2 Å²	51.2	62.4 Å²	62.4	27%	0.268	29%	0.29	S	S	.	.	S	Bend	trans	-76.5	-38.5	-174.2	-70.3	158.5	0	0	0	112.2	E1346 C1349 V1350 V1617 I1619	L1208-E1346 WeakPolarHBondContact CA-OE2 3.27Å; L1208-E1346 HydrophobicContact CB-CB 4.46Å; L1208-E1346 HydrophobicContact CB-CG 4.32Å; L1208-E1346 WeakPolarHBondContact CB-OE2 3.38Å; L1208-E1346 HydrophobicContact CD1-CB 4.39Å; L1208-E1346 HydrophobicContact CD1-CG 4.39Å; L1208-E1346 HydrophobicContact CG-CB 4.46Å; L1208-E1346 PolarHBondContact N-OE2 3.03Å; L1208-C1349 HydrophobicContact CD1-CB 3.57Å; L1208-V1350 HydrophobicContact CD1-CG2 3.93Å; L1208-V1350 VanDerWaalsContact CD1-CG2 3.42Å; L1208-V1350 HydrophobicContact CD2-CG2 3.93Å; L1208-V1350 HydrophobicContact CG-CG2 3.78Å; L1208-V1617 HydrophobicContact CD1-CG1 4.42Å; L1208-I1619 HydrophobicContact CD1-CD1 4.15Å; L1208-I1619 HydrophobicContact CD1-CG1 3.99Å; L1208-I1619 HydrophobicContact CD2-CB 4.19Å; L1208-I1619 HydrophobicContact CD2-CD1 4.28Å; L1208-I1619 HydrophobicContact CD2-CG1 3.88Å; L1208-I1619 HydrophobicContact CD2-CG2 3.71Å
1209	T	71.7	Confident	81.5	Confident	58 Å²	58	59.8 Å²	59.8	36%	0.356	28%	0.277	S	S	.	.	S	Bend	trans	-94.5	139.1	174.2	63.7	0	0	0	0	111	L1207 K1211 H1212 E1346	L1207-T1209 VanDerWaalsContact C-N 3.31Å; L1207-T1209 PolarHBondContact O-N 2.93Å; T1209-K1211 PolarHBondContact O-N 3.07Å; T1209-K1211 VanDerWaalsContact O-N 3.09Å; T1209-K1211 WeakPolarHBondContact OG1-CB 3.36Å; T1209-K1211 PolarHBondContact OG1-N 3.4Å; T1209-H1212 PolarHBondContact O-N 3Å; T1209-H1212 PolarHBondContact OG1-CD2 3.23Å; T1209-H1212 VanDerWaalsContact OG1-CD2 3.25Å; T1209-E1346 WeakPolarHBondContact CB-OE1 3.42Å; T1209-E1346 WeakPolarHBondContact CG2-OE1 3.27Å; T1209-E1346 PolarHBondContact N-OE2 3.13Å; T1209-E1346 PolarHBondContact OG1-OE1 3.13Å; T1209-E1346 PolarHBondContact OG1-OE2 3.19Å
1210	N	70.4	Confident	82.3	Confident	161.2 Å²	161.2	62.9 Å²	62.9	86%	0.862	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	0.6	177.5	-69.4	-25.1	0	0	0	113.7	K1206 L1207	K1206-N1210 WeakPolarHBondContact CD-OD1 3.41Å; L1207-N1210 PolarHBondContact O-N 3.19Å
1211	K	77.1	Confident	82.5	Confident	163.6 Å²	163.6	60 Å²	60	71%	0.711	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-41.3	178.5	-62.8	-176.7	178.4	-177	0	111.6	T1209	T1209-K1211 PolarHBondContact O-N 3.07Å; T1209-K1211 VanDerWaalsContact O-N 3.09Å; T1209-K1211 WeakPolarHBondContact OG1-CB 3.36Å; T1209-K1211 PolarHBondContact OG1-N 3.4Å
1212	H	84.9	Confident	82.6	Confident	33.2 Å²	33.2	59.6 Å²	59.6	15%	0.154	29%	0.286	C	S	.	.			trans	-105	136	-171.4	-59.5	-53.6	0	0	0	111.8	L1207 T1209 E1285 V1343 E1346	L1207-H1212 HydrophobicContact CB-CB 4.38Å; L1207-H1212 WeakPolarHBondContact CB-O 3.28Å; L1207-H1212 HydrophobicContact CD1-CB 3.93Å; L1207-H1212 PolarHBondContact N-O 3.2Å; T1209-H1212 PolarHBondContact O-N 3Å; T1209-H1212 PolarHBondContact OG1-CD2 3.23Å; T1209-H1212 VanDerWaalsContact OG1-CD2 3.25Å; H1212-E1285 IonicContact CE1-OE1 3.06Å; H1212-E1285 PolarHBondContact CE1-OE1 3.17Å; H1212-E1285 IonicContact CG-OE1 3.39Å; H1212-E1285 IonicContact ND1-OE1 3.21Å; H1212-E1285 PolarHBondContact ND1-OE1 3.04Å; H1212-E1285 IonicContact ND1-OE2 3.15Å; H1212-V1343 HydrophobicContact CB-CB 4.48Å; H1212-V1343 HydrophobicContact CB-CG1 4.44Å; H1212-V1343 HydrophobicContact CB-CG2 4.12Å; H1212-E1346 IonicContact CD2-OE1 3.14Å; H1212-E1346 PolarHBondContact CD2-OE1 3.01Å
1213	F	86.6	Confident	82.5	Confident	53.6 Å²	53.6	61.4 Å²	61.4	24%	0.235	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	151.5	173.5	65.4	-86.8	0	0	0	111.3	Y1204 F1205 M1215 C1284 E1285	Y1204-F1213 HydrophobicContact CD1-CD2 4.33Å; Y1204-F1213 HydrophobicContact CD1-CE2 4.4Å; Y1204-F1213 HydrophobicContact CE1-CB 3.95Å; Y1204-F1213 HydrophobicContact CE1-CD2 4.35Å; Y1204-F1213 HydrophobicContact CE1-CE2 4.48Å; Y1204-F1213 HydrophobicContact CE1-CG 4.32Å; Y1204-F1213 AromaticContact CE2-CD2 3.66Å; Y1204-F1213 HydrophobicContact CE2-CD2 3.66Å; Y1204-F1213 AromaticContact CE2-CE2 3.96Å; Y1204-F1213 HydrophobicContact CE2-CE2 3.96Å; Y1204-F1213 HydrophobicContact CE2-CG 4.34Å; Y1204-F1213 AromaticContact CZ-CD2 3.52Å; Y1204-F1213 AromaticContact CZ-CG 3.73Å; Y1204-F1213 VanDerWaalsContact OH-CD2 3.31Å; Y1204-F1213 WeakPolarHBondContact OH-CD2 3.23Å; Y1204-F1213 WeakPolarHBondContact OH-CG 3.35Å; F1205-F1213 CarbonylContact O-C 3.54Å; F1205-F1213 VanDerWaalsContact O-CA 3.28Å; F1205-F1213 WeakPolarHBondContact O-CA 3.32Å; F1213-M1215 HydrophobicContact CD2-CG 3.96Å; F1213-M1215 HydrophobicContact CE2-CE 4.14Å; F1213-M1215 HydrophobicContact CE2-CG 3.99Å; F1213-M1215 HydrophobicContact CE2-SD 3.98Å; F1213-C1284 WeakPolarHBondContact O-CA 3.36Å; F1213-E1285 HydrophobicContact CD1-CG 4.26Å; F1213-E1285 HydrophobicContact CE1-CB 4.31Å; F1213-E1285 HydrophobicContact CE1-CG 4.28Å; F1213-E1285 VanDerWaalsContact CZ-CA 3.47Å; F1213-E1285 HydrophobicContact CZ-CB 4.23Å; F1213-E1285 PolarHBondContact O-N 3.1Å; F1213-E1285 VanDerWaalsContact O-N 3.13Å
1214	I	89.3	Confident	82.1	Confident	25.6 Å²	25.6	61.1 Å²	61.1	13%	0.131	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	127.5	174.5	-58.2	174.9	0	0	0	107.7	Y1204 F1205 L1207 V1216 I1282 M1283 V1343 A1347	Y1204-I1214 CarbonylContact C-O 3.53Å; F1205-I1214 HydrophobicContact CB-CB 4.38Å; F1205-I1214 PolarHBondContact N-O 3.34Å; F1205-I1214 PolarHBondContact O-N 3.28Å; L1207-I1214 HydrophobicContact CD1-CD1 4.21Å; L1207-I1214 HydrophobicContact CD1-CG1 4.17Å; L1207-I1214 HydrophobicContact CD2-CD1 4.3Å; I1214-V1216 HydrophobicContact CG2-CG2 4.4Å; I1214-I1282 HydrophobicContact CG2-CG2 3.83Å; I1214-M1283 CarbonylContact C-O 3.54Å; I1214-M1283 WeakPolarHBondContact CA-O 3.24Å; I1214-M1283 WeakPolarHBondContact CG2-O 3.43Å; I1214-V1343 HydrophobicContact CD1-CG1 4.08Å; I1214-V1343 HydrophobicContact CG1-CG1 3.87Å; I1214-A1347 HydrophobicContact CD1-CB 4.01Å
1215	M	88.5	Confident	81.7	Confident	9.2 Å²	9.2	61.7 Å²	61.7	5%	0.045	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	133	172.9	-131.3	-137.2	-67.3	0	0	110.3	Q1202 F1203 Y1204 F1213 R1217 I1282 M1283 E1285 D1286	Q1202-M1215 HydrophobicContact CB-CG 4.48Å; Q1202-M1215 HydrophobicContact CB-SD 4.04Å; Q1202-M1215 HydrophobicContact CG-CE 4.06Å; Q1202-M1215 HydrophobicContact CG-SD 3.88Å; Q1202-M1215 PolarHBondContact NE2-SD 3.23Å; Q1202-M1215 VanDerWaalsContact NE2-SD 3.41Å; F1203-M1215 CarbonylContact O-C 3.54Å; F1203-M1215 VanDerWaalsContact O-CA 3.31Å; F1203-M1215 WeakPolarHBondContact O-CA 3.45Å; Y1204-M1215 HydrophobicContact CD1-CB 4.05Å; Y1204-M1215 HydrophobicContact CD1-CG 3.7Å; Y1204-M1215 VanDerWaalsContact CD1-CG 3.48Å; Y1204-M1215 HydrophobicContact CD1-SD 3.64Å; Y1204-M1215 HydrophobicContact CD2-CG 3.94Å; Y1204-M1215 VanDerWaalsContact CD2-CG 3.48Å; Y1204-M1215 HydrophobicContact CD2-SD 3.62Å; Y1204-M1215 HydrophobicContact CE1-CB 4.15Å; Y1204-M1215 HydrophobicContact CE1-CE 4.06Å; Y1204-M1215 HydrophobicContact CE1-CG 3.62Å; Y1204-M1215 VanDerWaalsContact CE1-CG 3.49Å; Y1204-M1215 HydrophobicContact CE1-SD 3.52Å; Y1204-M1215 WeakPolarHBondContact CE1-SD 3.34Å; Y1204-M1215 HydrophobicContact CE2-CG 4.12Å; Y1204-M1215 HydrophobicContact CE2-SD 4.12Å; Y1204-M1215 HydrophobicContact CG-CB 4.38Å; Y1204-M1215 HydrophobicContact CG-CG 4.16Å; F1213-M1215 HydrophobicContact CD2-CG 3.96Å; F1213-M1215 HydrophobicContact CE2-CE 4.14Å; F1213-M1215 HydrophobicContact CE2-CG 3.99Å; F1213-M1215 HydrophobicContact CE2-SD 3.98Å; M1215-R1217 HydrophobicContact CE-CB 4.14Å; M1215-R1217 HydrophobicContact SD-CB 4.02Å; M1215-I1282 CarbonylContact O-C 3.55Å; M1215-I1282 WeakPolarHBondContact O-CA 3.47Å; M1215-M1283 HydrophobicContact CB-CB 4.37Å; M1215-M1283 HydrophobicContact CB-CE 4.2Å; M1215-M1283 HydrophobicContact CE-CB 4.21Å; M1215-M1283 HydrophobicContact CE-CE 3.8Å; M1215-M1283 VanDerWaalsContact CE-CE 3.41Å; M1215-M1283 HydrophobicContact CE-CG 4.27Å; M1215-M1283 HydrophobicContact CE-SD 3.76Å; M1215-M1283 VanDerWaalsContact CE-SD 3.52Å; M1215-M1283 WeakPolarHBondContact CE-SD 3.23Å; M1215-M1283 HydrophobicContact CG-CE 4.12Å; M1215-M1283 PolarHBondContact N-O 2.99Å; M1215-M1283 PolarHBondContact O-N 2.97Å; M1215-M1283 HydrophobicContact SD-CB 4.4Å; M1215-M1283 HydrophobicContact SD-CE 3.09Å; M1215-M1283 WeakPolarHBondContact SD-CE 3.46Å; M1215-M1283 HydrophobicContact SD-CG 4.3Å; M1215-M1283 HydrophobicContact SD-SD 3.74Å; M1215-E1285 VanDerWaalsContact CE-O 3.24Å; M1215-E1285 WeakPolarHBondContact CE-O 3.31Å; M1215-D1286 WeakPolarHBondContact CE-OD1 3.2Å
1216	V	88.7	Confident	81	Confident	25.6 Å²	25.6	60.5 Å²	60.5	16%	0.155	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	111.6	173.9	-174.7	0	0	0	0	108.6	Q1202 F1203 F1205 I1214 V1218 V1281 I1282	Q1202-V1216 CarbonylContact C-O 3.55Å; Q1202-V1216 WeakPolarHBondContact CA-O 3.21Å; F1203-V1216 HydrophobicContact CB-CB 4.31Å; F1203-V1216 HydrophobicContact CD2-CB 4.35Å; F1203-V1216 PolarHBondContact N-O 3.2Å; F1203-V1216 PolarHBondContact O-N 3.02Å; F1205-V1216 HydrophobicContact CD2-CG2 4.25Å; F1205-V1216 HydrophobicContact CE2-CB 4.36Å; F1205-V1216 HydrophobicContact CE2-CG2 3.81Å; I1214-V1216 HydrophobicContact CG2-CG2 4.4Å; V1216-V1218 HydrophobicContact CG1-CG1 4.14Å; V1216-V1218 HydrophobicContact CG1-CG2 3.9Å; V1216-V1281 CarbonylContact C-O 3.54Å; V1216-V1281 WeakPolarHBondContact CA-O 3.43Å; V1216-I1282 HydrophobicContact CG1-CG1 4.38Å; V1216-I1282 HydrophobicContact CG2-CG1 4.28Å; V1216-I1282 HydrophobicContact CG2-CG2 4.48Å
1217	R	87.1	Confident	80	Confident	80.6 Å²	80.6	56.8 Å²	56.8	30%	0.304	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	128.7	177.4	-173.4	179.9	-65.4	155.4	-1.6	109.5	Y1200 F1201 Q1202 M1215 A1280 V1281 M1283	Y1200-R1217 HydrophobicContact CD1-CG 4.33Å; Y1200-R1217 HydrophobicContact CD2-CG 3.96Å; Y1200-R1217 HydrophobicContact CG-CG 3.86Å; F1201-R1217 CarbonylContact O-C 3.54Å; F1201-R1217 VanDerWaalsContact O-CA 3.3Å; F1201-R1217 WeakPolarHBondContact O-CA 3.24Å; Q1202-R1217 HydrophobicContact CG-CB 4.35Å; Q1202-R1217 HydrophobicContact CG-CG 4.12Å; Q1202-R1217 VanDerWaalsContact NE2-NE 3.13Å; Q1202-R1217 VanDerWaalsContact NE2-NH2 3.13Å; Q1202-R1217 VanDerWaalsContact OE1-CZ 3.26Å; M1215-R1217 HydrophobicContact CE-CB 4.14Å; M1215-R1217 HydrophobicContact SD-CB 4.02Å; R1217-A1280 CarbonylContact O-C 3.54Å; R1217-A1280 VanDerWaalsContact O-CA 3.28Å; R1217-A1280 WeakPolarHBondContact O-CA 3.34Å; R1217-V1281 HydrophobicContact CB-CB 4.46Å; R1217-V1281 PolarHBondContact N-O 3.18Å; R1217-V1281 PolarHBondContact O-N 3.03Å; R1217-M1283 HydrophobicContact CB-CE 4.21Å
1218	V	86.4	Confident	78.8	Confident	15.2 Å²	15.2	61.6 Å²	61.6	9%	0.092	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	131	-175	-142.7	0	0	0	0	110.6	Y1200 F1201 F1203 V1216 T1221 C1277 H1279 A1280	Y1200-V1218 CarbonylContact C-O 3.5Å; Y1200-V1218 VanDerWaalsContact CA-O 3.31Å; Y1200-V1218 WeakPolarHBondContact CA-O 3.38Å; F1201-V1218 HydrophobicContact CB-CB 4.47Å; F1201-V1218 HydrophobicContact CB-CG2 3.68Å; F1201-V1218 HydrophobicContact CD2-CG2 4.37Å; F1201-V1218 HydrophobicContact CG-CG2 4.46Å; F1201-V1218 PolarHBondContact N-O 3.14Å; F1201-V1218 PolarHBondContact O-N 2.98Å; F1203-V1218 HydrophobicContact CD2-CG2 4.15Å; F1203-V1218 HydrophobicContact CE2-CG2 3.94Å; V1216-V1218 HydrophobicContact CG1-CG1 4.14Å; V1216-V1218 HydrophobicContact CG1-CG2 3.9Å; V1218-T1221 HydrophobicContact CB-CG2 3.98Å; V1218-T1221 HydrophobicContact CG1-CG2 3.3Å; V1218-T1221 WeakPolarHBondContact CG1-OG1 3.47Å; V1218-C1277 HydrophobicContact CG1-CB 4.17Å; V1218-C1277 WeakPolarHBondContact CG1-SG 3.32Å; V1218-H1279 WeakPolarHBondContact CA-O 3.2Å; V1218-A1280 HydrophobicContact CG1-CB 4.11Å; V1218-A1280 HydrophobicContact CG2-CB 4.4Å
1219	K	83.3	Confident	77.4	Confident	94.2 Å²	94.2	61.4 Å²	61.4	41%	0.41	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	145.6	177.5	-64.8	-171.8	174.2	-172.2	0	111.1	Q1198 S1199 T1221 C1277 E1278 H1279	Q1198-K1219 PolarHBondContact O-NZ 3.14Å; S1199-K1219 WeakPolarHBondContact O-CE 3.34Å; K1219-T1221 VanDerWaalsContact C-N 3.34Å; K1219-T1221 PolarHBondContact O-N 3.3Å; K1219-T1221 PolarHBondContact O-OG1 2.97Å; K1219-C1277 PolarHBondContact O-SG 3.27Å; K1219-C1277 VanDerWaalsContact O-SG 3.4Å; K1219-E1278 PolarHBondContact O-N 3.41Å; K1219-H1279 HydrophobicContact CB-CB 4.34Å; K1219-H1279 HydrophobicContact CD-CB 4.49Å; K1219-H1279 PolarHBondContact N-O 3.09Å
1220	N	79.5	Confident	76	Confident	73 Å²	73	64.8 Å²	64.8	39%	0.39	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	46.7	62.5	174	-66.2	-12.2	0	0	0	113.5	P1196 C1277 E1278	P1196-N1220 WeakPolarHBondContact CD-OD1 3.33Å; P1196-N1220 PolarHBondContact O-OD1 3.24Å; N1220-C1277 WeakPolarHBondContact O-CA 3.49Å; N1220-E1278 HydrophobicContact CB-CB 4.02Å; N1220-E1278 VanDerWaalsContact CB-CD 3.44Å; N1220-E1278 HydrophobicContact CB-CG 3.87Å; N1220-E1278 VanDerWaalsContact CB-OE2 3.25Å; N1220-E1278 WeakPolarHBondContact CB-OE2 3.44Å; N1220-E1278 PolarHBondContact ND2-OE2 2.98Å; N1220-E1278 PolarHBondContact O-N 2.88Å
1221	T	78	Confident	74.4	Confident	24.8 Å²	24.8	60.5 Å²	60.5	15%	0.152	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	122.2	-177	24.8	0	0	0	0	112.1	I1194 P1196 V1218 K1219 V1275 N1276 C1277	I1194-T1221 CarbonylContact C-O 3.52Å; I1194-T1221 WeakPolarHBondContact CB-O 3.25Å; I1194-T1221 WeakPolarHBondContact CB-OG1 3.44Å; I1194-T1221 PolarHBondContact N-O 3.33Å; I1194-T1221 CarbonylContact O-C 3.47Å; I1194-T1221 PolarHBondContact O-N 3.38Å; P1196-T1221 WeakPolarHBondContact CD-O 3.29Å; P1196-T1221 WeakPolarHBondContact CG-O 3.48Å; V1218-T1221 HydrophobicContact CB-CG2 3.98Å; V1218-T1221 HydrophobicContact CG1-CG2 3.3Å; V1218-T1221 WeakPolarHBondContact CG1-OG1 3.47Å; K1219-T1221 VanDerWaalsContact C-N 3.34Å; K1219-T1221 PolarHBondContact O-N 3.3Å; K1219-T1221 PolarHBondContact O-OG1 2.97Å; T1221-V1275 HydrophobicContact CG2-CG1 4.04Å; T1221-N1276 CarbonylContact C-O 3.55Å; T1221-N1276 VanDerWaalsContact CA-O 3.29Å; T1221-N1276 WeakPolarHBondContact CA-O 3.42Å; T1221-C1277 HydrophobicContact CG2-CB 4.16Å; T1221-C1277 PolarHBondContact OG1-SG 2.85Å; T1221-C1277 VanDerWaalsContact OG1-SG 3.36Å
1222	S	80.3	Confident	72.2	Confident	31.8 Å²	31.8	58.1 Å²	58.1	22%	0.222	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	127.5	168.7	54.5	0	0	0	0	110.4	I1194 V1275 N1276	I1194-S1222 VanDerWaalsContact O-CA 3.27Å; I1194-S1222 WeakPolarHBondContact O-CA 3.38Å; S1222-V1275 CarbonylContact O-C 3.57Å; S1222-V1275 VanDerWaalsContact O-CA 3.3Å; S1222-V1275 WeakPolarHBondContact O-CA 3.39Å; S1222-N1276 PolarHBondContact N-O 3.08Å; S1222-N1276 PolarHBondContact O-N 3.08Å; S1222-N1276 WeakPolarHBondContact OG-CB 3.37Å; S1222-N1276 PolarHBondContact OG-ND2 3.03Å; S1222-N1276 VanDerWaalsContact OG-ND2 3.1Å; S1222-N1276 PolarHBondContact OG-O 3Å
1223	F	78.3	Confident	69.6	Low	59.6 Å²	59.6	61.2 Å²	61.2	26%	0.261	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	129.7	174.7	178.3	-84.6	0	0	0	109.5	L1192 S1193 I1194 Y1225 L1273 K1274 V1275	L1192-F1223 CarbonylContact C-O 3.57Å; L1192-F1223 WeakPolarHBondContact CA-O 3.21Å; L1192-F1223 HydrophobicContact CB-CB 4.23Å; L1192-F1223 HydrophobicContact CB-CD1 4.12Å; L1192-F1223 HydrophobicContact CB-CG 4.49Å; L1192-F1223 HydrophobicContact CD2-CB 4.48Å; L1192-F1223 HydrophobicContact CD2-CD1 4.12Å; L1192-F1223 HydrophobicContact CD2-CE1 4.02Å; L1192-F1223 HydrophobicContact CG-CD1 4.12Å; L1192-F1223 HydrophobicContact CG-CE1 4.37Å; L1192-F1223 PolarHBondContact N-O 2.94Å; L1192-F1223 CarbonylContact O-C 3.43Å; L1192-F1223 VanDerWaalsContact O-CA 3.31Å; L1192-F1223 WeakPolarHBondContact O-CA 3.44Å; L1192-F1223 WeakPolarHBondContact O-CB 3.44Å; L1192-F1223 PolarHBondContact O-N 3.18Å; S1193-F1223 CarbonylContact C-O 3.58Å; S1193-F1223 VanDerWaalsContact CA-O 3.24Å; S1193-F1223 WeakPolarHBondContact CA-O 3.31Å; I1194-F1223 HydrophobicContact CB-CB 4.22Å; I1194-F1223 HydrophobicContact CD1-CB 4.39Å; I1194-F1223 HydrophobicContact CD1-CD1 4.02Å; I1194-F1223 HydrophobicContact CD1-CG 4.38Å; I1194-F1223 HydrophobicContact CG1-CB 4.43Å; I1194-F1223 HydrophobicContact CG1-CD1 4.19Å; I1194-F1223 PolarHBondContact N-O 3.06Å; I1194-F1223 PolarHBondContact O-N 3.12Å; F1223-Y1225 VanDerWaalsContact CE1-CB 3.43Å; F1223-Y1225 VanDerWaalsContact CZ-CB 3.48Å; F1223-Y1225 HydrophobicContact CZ-CG 4.47Å; F1223-L1273 HydrophobicContact CD2-CD1 4.22Å; F1223-L1273 HydrophobicContact CE1-CD1 4.25Å; F1223-L1273 HydrophobicContact CE2-CD1 3.67Å; F1223-L1273 VanDerWaalsContact CE2-CD1 3.49Å; F1223-L1273 HydrophobicContact CE2-CD2 3.99Å; F1223-L1273 HydrophobicContact CE2-CG 4.12Å; F1223-L1273 HydrophobicContact CZ-CD1 3.73Å; F1223-L1273 VanDerWaalsContact CZ-CD1 3.46Å; F1223-L1273 HydrophobicContact CZ-CG 4.02Å; F1223-K1274 CarbonylContact C-O 3.58Å; F1223-V1275 HydrophobicContact CD2-CG2 3.8Å; F1223-V1275 HydrophobicContact CE2-CG2 4.3Å; F1223-V1275 HydrophobicContact CG-CG2 4.5Å
1224	Q	77.7	Confident	66.9	Low	59.8 Å²	59.8	65.2 Å²	65.2	28%	0.279	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	123.8	175.6	-163.2	-178.8	9.1	0	0	109	W1190 H1191 L1192 L1273 K1274	W1190-Q1224 WeakPolarHBondContact O-CA 3.48Å; H1191-Q1224 PolarHBondContact CD2-NE2 3.26Å; H1191-Q1224 VanDerWaalsContact CD2-NE2 3.31Å; H1191-Q1224 WeakPolarHBondContact NE2-CG 3.48Å; H1191-Q1224 PolarHBondContact NE2-NE2 3.17Å; L1192-Q1224 CarbonylContact O-C 3.58Å; L1192-Q1224 VanDerWaalsContact O-CA 3.3Å; L1192-Q1224 WeakPolarHBondContact O-CA 3.38Å; Q1224-L1273 CarbonylContact O-C 3.55Å; Q1224-L1273 WeakPolarHBondContact O-CA 3.39Å; Q1224-K1274 HydrophobicContact CB-CB 4.28Å; Q1224-K1274 PolarHBondContact N-O 3.1Å; Q1224-K1274 PolarHBondContact O-N 2.83Å; Q1224-K1274 VanDerWaalsContact O-O 3.09Å
1225	Y	76.7	Confident	64	Low	79.6 Å²	79.6	71.2 Å²	71.2	31%	0.312	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	128	175	176	-107.6	0	0	0	110.5	W1190 L1192 F1223 P1227 R1272 L1273	W1190-Y1225 PolarHBondContact N-O 3.27Å; W1190-Y1225 CarbonylContact O-C 3.53Å; W1190-Y1225 PolarHBondContact O-N 3.19Å; L1192-Y1225 PolarHBondContact N-O 2.86Å; L1192-Y1225 PolarHBondContact O-N 3.45Å; F1223-Y1225 VanDerWaalsContact CE1-CB 3.43Å; F1223-Y1225 VanDerWaalsContact CZ-CB 3.48Å; F1223-Y1225 HydrophobicContact CZ-CG 4.47Å; Y1225-P1227 HydrophobicContact CE1-CB 4.09Å; Y1225-P1227 WeakPolarHBondContact O-CD 3.36Å; Y1225-P1227 WeakPolarHBondContact OH-CA 3.46Å; Y1225-R1272 CarbonylContact C-O 3.59Å; Y1225-R1272 WeakPolarHBondContact CA-O 3.38Å; Y1225-R1272 VanDerWaalsContact CD2-O 3.27Å; Y1225-R1272 WeakPolarHBondContact CD2-O 3.41Å; Y1225-L1273 HydrophobicContact CD2-CB 4.36Å; Y1225-L1273 HydrophobicContact CD2-CD1 4.22Å; Y1225-L1273 HydrophobicContact CG-CD1 4.42Å
1226	T	70.4	Confident	61.2	Low	36.4 Å²	36.4	80.2 Å²	80.2	22%	0.223	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	117.6	173.1	42.3	0	0	0	0	108.8	H1191 S1271 R1272	H1191-T1226 WeakPolarHBondContact ND1-CG2 3.39Å; T1226-S1271 CarbonylContact O-C 3.46Å; T1226-S1271 VanDerWaalsContact O-CA 3.22Å; T1226-S1271 WeakPolarHBondContact O-CA 3.36Å; T1226-S1271 VanDerWaalsContact O-CB 3.26Å; T1226-S1271 WeakPolarHBondContact O-CB 3.31Å; T1226-S1271 PolarHBondContact OG1-O 2.93Å; T1226-R1272 PolarHBondContact N-O 3.05Å; T1226-R1272 PolarHBondContact O-N 2.87Å; T1226-R1272 VanDerWaalsContact O-N 3.11Å; T1226-R1272 WeakPolarHBondContact OG1-CA 3.49Å; T1226-R1272 VanDerWaalsContact OG1-CB 3.27Å; T1226-R1272 WeakPolarHBondContact OG1-CB 3.32Å; T1226-R1272 PolarHBondContact OG1-N 3.23Å; T1226-R1272 PolarHBondContact OG1-O 2.89Å
1227	P	63.2	Low	58.4	Low	37.4 Å²	37.4	86.6 Å²	86.6	24%	0.243	44%	0.444	C	S	.	.			trans	-68.6	163.5	178.1	29.7	-35	0	0	0	111.8	N1188 W1190 Y1225 T1229	N1188-P1227 HydrophobicContact CB-CG 4.11Å; N1188-P1227 WeakPolarHBondContact O-CD 3.46Å; N1188-P1227 VanDerWaalsContact O-CG 3.32Å; N1188-P1227 WeakPolarHBondContact O-CG 3.42Å; W1190-P1227 HydrophobicContact CB-CG 3.98Å; W1190-P1227 HydrophobicContact CG-CG 4.02Å; W1190-P1227 WeakPolarHBondContact O-CD 3.29Å; Y1225-P1227 HydrophobicContact CE1-CB 4.09Å; Y1225-P1227 WeakPolarHBondContact O-CD 3.36Å; Y1225-P1227 WeakPolarHBondContact OH-CA 3.46Å; P1227-T1229 PolarHBondContact O-N 2.93Å
1228	K	58.9	Low	55.6	Low	120.6 Å²	120.6	87.8 Å²	87.8	52%	0.524	47%	0.465	S	S	.	.			trans	-71.7	118.7	176.6	-157.4	179.8	-175	-174.9	0	109.8	I1230 I1268 V1269 S1270	K1228-I1230 PolarHBondContact O-N 2.76Å; K1228-I1268 HydrophobicContact CD-CG2 4.42Å; K1228-I1268 HydrophobicContact CG-CG2 4.42Å; K1228-V1269 WeakPolarHBondContact CA-O 3.38Å; K1228-V1269 WeakPolarHBondContact CG-O 3.4Å; K1228-S1270 WeakPolarHBondContact CE-OG 3.45Å; K1228-S1270 PolarHBondContact NZ-OG 2.91Å
1229	T	47.9	Very low	52.8	Low	45.6 Å²	45.6	92.5 Å²	92.5	28%	0.28	50%	0.498	S	S	.	.	B	Isolated β-bridge	trans	-92.7	130.1	167.6	38.3	0	0	0	0	109.5	N1188 P1227 T1231 V1269	N1188-T1229 VanDerWaalsContact C-CG2 3.5Å; N1188-T1229 HydrophobicContact CB-CG2 4.39Å; N1188-T1229 VanDerWaalsContact O-CG2 3.32Å; N1188-T1229 WeakPolarHBondContact O-CG2 3.45Å; P1227-T1229 PolarHBondContact O-N 2.93Å; T1229-T1231 PolarHBondContact O-N 3.28Å; T1229-T1231 VanDerWaalsContact O-N 3.13Å; T1229-V1269 PolarHBondContact N-O 3.06Å; T1229-V1269 VanDerWaalsContact N-O 3.1Å; T1229-V1269 PolarHBondContact O-N 3.08Å; T1229-V1269 VanDerWaalsContact O-N 3.14Å
1230	I	42.5	Very low	50.1	Low	130.8 Å²	130.8	93.3 Å²	93.3	67%	0.671	52%	0.515	S	S	*	.			trans	-99.2	110.9	172.3	-57.7	173	0	0	0	106.1	K1228 T1232	K1228-I1230 PolarHBondContact O-N 2.76Å; I1230-T1232 HydrophobicContact CG2-CG2 4.18Å; I1230-T1232 PolarHBondContact O-N 2.79Å; I1230-T1232 VanDerWaalsContact O-N 3.15Å
1231	T	36.6	Very low	47.6	Very low	70.2 Å²	70.2	97.5 Å²	97.5	43%	0.431	54%	0.538	S	S	.	.			trans	-89.5	104.3	170.9	52.1	0	0	0	0	108.8	S1186 T1229 T1233 G1266 C1267	S1186-T1231 WeakPolarHBondContact O-CG2 3.24Å; S1186-T1231 VanDerWaalsContact OG-CG2 3.31Å; S1186-T1231 WeakPolarHBondContact OG-CG2 3.33Å; T1229-T1231 PolarHBondContact O-N 3.28Å; T1229-T1231 VanDerWaalsContact O-N 3.13Å; T1231-T1233 VanDerWaalsContact C-N 3.32Å; T1231-T1233 PolarHBondContact O-N 3.16Å; T1231-T1233 VanDerWaalsContact O-N 3.09Å; T1231-G1266 WeakPolarHBondContact O-CA 3.49Å; T1231-C1267 PolarHBondContact N-O 3.15Å; T1231-C1267 PolarHBondContact OG1-N 2.91Å; T1231-C1267 PolarHBondContact OG1-O 2.79Å
1232	T	31	Very low	45.3	Very low	113.4 Å²	113.4	103.5 Å²	103.5	70%	0.696	57%	0.569	S	S	*	*			trans	-86.1	96.8	169.3	47.6	0	0	0	0	108.7	I1230 D1234	I1230-T1232 HydrophobicContact CG2-CG2 4.18Å; I1230-T1232 PolarHBondContact O-N 2.79Å; I1230-T1232 VanDerWaalsContact O-N 3.15Å; T1232-D1234 VanDerWaalsContact C-N 3.32Å; T1232-D1234 PolarHBondContact O-N 3Å
1233	T	31	Very low	42.7	Very low	99 Å²	99	112.9 Å²	112.9	61%	0.607	60%	0.6	S	S	*	*			trans	-88.9	96.4	167.3	49.9	0	0	0	0	109.1	T1231 N1235	T1231-T1233 VanDerWaalsContact C-N 3.32Å; T1231-T1233 PolarHBondContact O-N 3.16Å; T1231-T1233 VanDerWaalsContact O-N 3.09Å; T1233-N1235 VanDerWaalsContact C-N 3.26Å; T1233-N1235 PolarHBondContact O-N 3.06Å
1234	D	29.4	Very low	40.2	Very low	136.8 Å²	136.8	119.2 Å²	119.2	73%	0.732	63%	0.627	S	S	*	*			trans	-97.1	77.2	171.9	-76.4	-18.1	0	0	0	112.1	T1232 K1236	T1232-D1234 VanDerWaalsContact C-N 3.32Å; T1232-D1234 PolarHBondContact O-N 3Å; D1234-K1236 PolarHBondContact O-N 3.43Å
1235	N	29.2	Very low	37.7	Very low	150.8 Å²	150.8	123.8 Å²	123.8	81%	0.806	65%	0.654	S	S	*	*			trans	-96.2	76	170.2	-101.6	-2.8	0	0	0	111.9	T1233 I1237	T1233-N1235 VanDerWaalsContact C-N 3.26Å; T1233-N1235 PolarHBondContact O-N 3.06Å; N1235-I1237 PolarHBondContact O-N 3.02Å
1236	K	29.1	Very low	35.3	Very low	199.4 Å²	199.4	131.7 Å²	131.7	87%	0.867	68%	0.683	S	S	*	*			trans	-106.7	89.9	168.3	-84.7	179.9	178.5	176.4	0	110.8	D1234 S1238	D1234-K1236 PolarHBondContact O-N 3.43Å; K1236-S1238 PolarHBondContact O-N 3.42Å
1237	I	30.6	Very low	33	Very low	160 Å²	160	138.4 Å²	138.4	82%	0.821	71%	0.711	S	S	*	*			trans	-124.6	114.4	155.1	-67.4	172	0	0	0	107.9	N1235	N1235-I1237 PolarHBondContact O-N 3.02Å
1238	S	27.4	Very low	31.2	Very low	106 Å²	106	142.6 Å²	142.6	74%	0.741	74%	0.737	S	S	*	*			trans	-96.7	115.6	176.4	53	0	0	0	0	111.9	K1236 S1240	K1236-S1238 PolarHBondContact O-N 3.42Å; S1238-S1240 PolarHBondContact O-N 2.82Å; S1238-S1240 VanDerWaalsContact O-N 3.14Å
1239	S	27.3	Very low	29.6	Very low	113.4 Å²	113.4	144.2 Å²	144.2	79%	0.793	75%	0.75	S	S	*	*			trans	-88.8	113.1	164.8	52.1	0	0	0	0	112.6
1240	S	27.9	Very low	28.5	Very low	110.2 Å²	110.2	149.8 Å²	149.8	77%	0.771	78%	0.777	S	S	*	*			trans	-149.1	130.2	140	54.8	0	0	0	0	108.8	S1238 D1242	S1238-S1240 PolarHBondContact O-N 2.82Å; S1238-S1240 VanDerWaalsContact O-N 3.14Å; S1240-D1242 PolarHBondContact O-N 3.23Å; S1240-D1242 VanDerWaalsContact O-N 3.09Å
1241	N	26.8	Very low	27.7	Very low	161.2 Å²	161.2	148.8 Å²	148.8	86%	0.862	78%	0.777	S	S	*	*			trans	-62.5	115.1	175.5	-69	-37.7	0	0	0	110.6
1242	D	29.2	Very low	27.1	Very low	151.4 Å²	151.4	151.7 Å²	151.7	81%	0.81	79%	0.79	S	S	*	*			trans	-147.8	120.1	140.1	-107.6	-37.2	0	0	0	111.5	S1240 K1244	S1240-D1242 PolarHBondContact O-N 3.23Å; S1240-D1242 VanDerWaalsContact O-N 3.09Å; D1242-K1244 VanDerWaalsContact C-N 3.33Å; D1242-K1244 PolarHBondContact O-N 2.97Å; D1242-K1244 VanDerWaalsContact O-N 3.07Å
1243	R	25.3	Very low	26.8	Very low	230 Å²	230	153.5 Å²	153.5	87%	0.868	80%	0.796	S	S	*	*			trans	-69.9	111.5	169.3	-77.9	172.7	-175.2	175.2	-0.5	111.8
1244	K	26.4	Very low	26.6	Very low	191.4 Å²	191.4	154.6 Å²	154.6	83%	0.832	80%	0.802	S	S	*	*			trans	136.6	134.3	143.5	-80.7	167.5	-177.6	-176.1	0	112.4	D1242	D1242-K1244 VanDerWaalsContact C-N 3.33Å; D1242-K1244 PolarHBondContact O-N 2.97Å; D1242-K1244 VanDerWaalsContact O-N 3.07Å
1245	N	25.2	Very low	26.4	Very low	156.2 Å²	156.2	155.3 Å²	155.3	84%	0.835	81%	0.806	S	S	*	*			trans	93.3	69.5	167.8	-60.2	-5.4	0	0	0	116.6	E1247	N1245-E1247 PolarHBondContact O-N 2.86Å
1246	R	25.4	Very low	26.3	Very low	244.6 Å²	244.6	156.2 Å²	156.2	92%	0.923	81%	0.807	S	S	*	*			trans	-132	69.3	148.7	-135.9	174.8	177.2	158.2	-0.2	112.2
1247	E	23.1	Very low	26.2	Very low	177 Å²	177	153.4 Å²	153.4	83%	0.827	80%	0.802	S	S	*	*			trans	-94.2	149.5	156.1	-71.2	-179.7	149	0	0	107.8	N1245 L1249	N1245-E1247 PolarHBondContact O-N 2.86Å; E1247-L1249 VanDerWaalsContact C-N 3.29Å; E1247-L1249 PolarHBondContact O-N 3.23Å
1248	V	25.5	Very low	26.1	Very low	127.4 Å²	127.4	153.2 Å²	153.2	77%	0.772	80%	0.803	S	S	*	*			trans	58.7	91.4	173.6	-173.4	0	0	0	0	114.7	L1250	V1248-L1250 VanDerWaalsContact C-N 3.29Å; V1248-L1250 HydrophobicContact CG1-CD1 3.98Å; V1248-L1250 HydrophobicContact CG1-CG 3.95Å; V1248-L1250 PolarHBondContact O-N 2.65Å
1249	L	25.1	Very low	26.2	Very low	154 Å²	154	155.5 Å²	155.5	81%	0.806	81%	0.806	S	S	*	*			trans	-142.8	107.4	134.4	-151.1	87	0	0	0	110.5	E1247 T1251	E1247-L1249 VanDerWaalsContact C-N 3.29Å; E1247-L1249 PolarHBondContact O-N 3.23Å; L1249-T1251 PolarHBondContact O-N 2.86Å
1250	L	25.2	Very low	26.3	Very low	162.8 Å²	162.8	157.4 Å²	157.4	85%	0.852	81%	0.808	S	S	*	*			trans	-121.1	90.6	165.4	-79	169.1	0	0	0	110.1	V1248	V1248-L1250 VanDerWaalsContact C-N 3.29Å; V1248-L1250 HydrophobicContact CG1-CD1 3.98Å; V1248-L1250 HydrophobicContact CG1-CG 3.95Å; V1248-L1250 PolarHBondContact O-N 2.65Å
1251	T	24.1	Very low	26.4	Very low	109.4 Å²	109.4	158.6 Å²	158.6	67%	0.671	81%	0.806	S	S	*	*			trans	-137.3	132.2	168.3	44.8	0	0	0	0	110.6	L1249 N1253	L1249-T1251 PolarHBondContact O-N 2.86Å; T1251-N1253 VanDerWaalsContact C-N 3.25Å; T1251-N1253 PolarHBondContact O-N 3.07Å
1252	N	25.1	Very low	26.5	Very low	132 Å²	132	160.9 Å²	160.9	71%	0.706	81%	0.808	S	S	*	*			trans	-62.7	110.9	166.3	-71.7	-19.1	0	0	0	114	T1254 R1318	N1252-T1254 PolarHBondContact O-N 2.86Å; N1252-R1318 PolarHBondContact O-NH1 2.61Å
1253	N	25.3	Very low	26.6	Very low	150.6 Å²	150.6	159.4 Å²	159.4	81%	0.805	80%	0.8	S	S	*	*			trans	-126.5	107.4	143.9	-87.6	-8.1	0	0	0	112.5	T1251 N1255	T1251-N1253 VanDerWaalsContact C-N 3.25Å; T1251-N1253 PolarHBondContact O-N 3.07Å; N1253-N1255 PolarHBondContact O-N 3.02Å
1254	T	25.7	Very low	26.7	Very low	121 Å²	121	155 Å²	155	74%	0.742	79%	0.794	S	S	*	*			trans	-100.7	112	157.7	48.5	0	0	0	0	111.3	N1252	N1252-T1254 PolarHBondContact O-N 2.86Å
1255	N	25.7	Very low	27.1	Very low	152.2 Å²	152.2	153.2 Å²	153.2	81%	0.814	79%	0.791	S	S	*	*			trans	141.7	121.8	150.8	-78.2	-13.5	0	0	0	113.6	N1253 N1257	N1253-N1255 PolarHBondContact O-N 3.02Å; N1255-N1257 PolarHBondContact O-N 3.01Å
1256	M	26.1	Very low	27.3	Very low	169.2 Å²	169.2	147.8 Å²	147.8	83%	0.833	77%	0.773	S	S	*	*			trans	14.9	129.3	153.8	-64.6	-67.3	-151.4	0	0	116.3
1257	N	26.9	Very low	27.9	Very low	142.4 Å²	142.4	140.4 Å²	140.4	76%	0.761	76%	0.757	S	S	*	*			trans	81.5	114.4	154.4	-60.6	-4.3	0	0	0	113.6	N1255	N1255-N1257 PolarHBondContact O-N 3.01Å
1258	D	28.7	Very low	28.7	Very low	155 Å²	155	137.6 Å²	137.6	83%	0.829	75%	0.747	S	S	*	*				-165.2	126.1	106.1	-80.8	-32	0	0	0	112.6	N1260	D1258-N1260 PolarHBondContact O-N 3.18Å; D1258-N1260 VanDerWaalsContact O-N 3.1Å
1259	D	29.5	Very low	29.8	Very low	153.6 Å²	153.6	134.1 Å²	134.1	82%	0.821	73%	0.726	S	S	*	*			trans	-62.2	133.3	165.5	-87.5	-46.3	0	0	0	112.5
1260	N	30.5	Very low	31.3	Very low	153.8 Å²	153.8	128.4 Å²	128.4	82%	0.822	70%	0.699	S	S	*	*			trans	120.3	48.5	168	-66.4	-44	0	0	0	116.9	D1258	D1258-N1260 PolarHBondContact O-N 3.18Å; D1258-N1260 VanDerWaalsContact O-N 3.1Å
1261	N	29.5	Very low	33.1	Very low	135.4 Å²	135.4	121.7 Å²	121.7	72%	0.724	67%	0.666	S	S	*	*			trans	-143.5	70.6	156	-114.6	-27.5	0	0	0	113.3	N1263	N1261-N1263 PolarHBondContact O-N 3.21Å; N1261-N1263 PolarHBondContact OD1-ND2 2.92Å
1262	K	28.9	Very low	35.4	Very low	210.4 Å²	210.4	122 Å²	122	92%	0.915	65%	0.654	S	S	*	*			trans	-76	67.3	163.5	-80.3	-179.5	177.4	169.1	0	110.1	N1264	K1262-N1264 PolarHBondContact O-N 2.98Å
1263	N	30.9	Very low	38.2	Very low	119 Å²	119	117 Å²	117	64%	0.636	63%	0.628	S	S	*	*			trans	-97	107.6	169.9	-84.9	-27.3	0	0	0	110.6	N1261 I1265	N1261-N1263 PolarHBondContact O-N 3.21Å; N1261-N1263 PolarHBondContact OD1-ND2 2.92Å; N1263-I1265 WeakPolarHBondContact O-CG1 3.44Å; N1263-I1265 PolarHBondContact O-N 3.14Å
1264	N	28.8	Very low	41.1	Very low	138 Å²	138	113 Å²	113	74%	0.738	60%	0.603	S	S	*	*			trans	-29.8	79.5	165	-69.4	-25.4	0	0	0	113.7	K1262 G1266	K1262-N1264 PolarHBondContact O-N 2.98Å; N1264-G1266 VanDerWaalsContact C-N 3.28Å; N1264-G1266 PolarHBondContact O-N 3.03Å; N1264-G1266 VanDerWaalsContact O-N 3.08Å
1265	I	33.3	Very low	44	Very low	152.4 Å²	152.4	108.5 Å²	108.5	78%	0.782	58%	0.576	S	S	*	*			trans	-78.2	99.9	161.9	-59.6	173.6	0	0	0	107	N1263 C1267	N1263-I1265 WeakPolarHBondContact O-CG1 3.44Å; N1263-I1265 PolarHBondContact O-N 3.14Å; I1265-C1267 PolarHBondContact O-N 3.16Å; I1265-C1267 VanDerWaalsContact O-N 3.1Å
1266	G	31.1	Very low	47	Very low	42.8 Å²	42.8	102.8 Å²	102.8	44%	0.441	55%	0.545	S	S	.	.			trans	-57.5	114.8	170.4	0	0	0	0	0	109.7	T1231 N1264 I1268	T1231-G1266 WeakPolarHBondContact O-CA 3.49Å; N1264-G1266 VanDerWaalsContact C-N 3.28Å; N1264-G1266 PolarHBondContact O-N 3.03Å; N1264-G1266 VanDerWaalsContact O-N 3.08Å; G1266-I1268 VanDerWaalsContact C-N 3.35Å; G1266-I1268 PolarHBondContact O-N 2.96Å; G1266-I1268 VanDerWaalsContact O-N 3.15Å
1267	C	36.9	Very low	50	Low	89.4 Å²	89.4	95.1 Å²	95.1	60%	0.604	51%	0.507	S	S	*	.			trans	-71.3	100	-179.7	-173.5	0	0	0	0	109.4	T1231 I1265 V1269	T1231-C1267 PolarHBondContact N-O 3.15Å; T1231-C1267 PolarHBondContact OG1-N 2.91Å; T1231-C1267 PolarHBondContact OG1-O 2.79Å; I1265-C1267 PolarHBondContact O-N 3.16Å; I1265-C1267 VanDerWaalsContact O-N 3.1Å; C1267-V1269 VanDerWaalsContact C-N 3.3Å; C1267-V1269 PolarHBondContact O-N 2.96Å; C1267-V1269 VanDerWaalsContact O-N 3.08Å
1268	I	40.3	Very low	52.9	Low	118.4 Å²	118.4	93.2 Å²	93.2	61%	0.607	49%	0.494	S	S	*	.			trans	-73.4	96.4	173.3	-59.5	175.9	0	0	0	107.7	K1228 G1266 S1270	K1228-I1268 HydrophobicContact CD-CG2 4.42Å; K1228-I1268 HydrophobicContact CG-CG2 4.42Å; G1266-I1268 VanDerWaalsContact C-N 3.35Å; G1266-I1268 PolarHBondContact O-N 2.96Å; G1266-I1268 VanDerWaalsContact O-N 3.15Å; I1268-S1270 VanDerWaalsContact C-N 3.27Å; I1268-S1270 PolarHBondContact O-N 3.04Å; I1268-S1270 VanDerWaalsContact O-N 3.13Å
1269	V	48.6	Very low	55.9	Low	54.6 Å²	54.6	88.6 Å²	88.6	33%	0.331	47%	0.468	S	S	.	.	B	Isolated β-bridge	trans	-75.3	97.8	176.5	-173	0	0	0	0	108.9	K1228 T1229 C1267 S1271 P1301	K1228-V1269 WeakPolarHBondContact CA-O 3.38Å; K1228-V1269 WeakPolarHBondContact CG-O 3.4Å; T1229-V1269 PolarHBondContact N-O 3.06Å; T1229-V1269 VanDerWaalsContact N-O 3.1Å; T1229-V1269 PolarHBondContact O-N 3.08Å; T1229-V1269 VanDerWaalsContact O-N 3.14Å; C1267-V1269 VanDerWaalsContact C-N 3.3Å; C1267-V1269 PolarHBondContact O-N 2.96Å; C1267-V1269 VanDerWaalsContact O-N 3.08Å; V1269-S1271 PolarHBondContact O-N 2.86Å; V1269-P1301 HydrophobicContact CB-CG 4.32Å; V1269-P1301 HydrophobicContact CG1-CB 4.33Å; V1269-P1301 HydrophobicContact CG1-CG 3.28Å
1270	S	56	Low	58.8	Low	33.2 Å²	33.2	81.6 Å²	81.6	23%	0.232	43%	0.431	C	S	.	.			trans	-59	142.1	175.3	-96.9	0	0	0	0	111.8	K1228 I1268 R1272	K1228-S1270 WeakPolarHBondContact CE-OG 3.45Å; K1228-S1270 PolarHBondContact NZ-OG 2.91Å; I1268-S1270 VanDerWaalsContact C-N 3.27Å; I1268-S1270 PolarHBondContact O-N 3.04Å; I1268-S1270 VanDerWaalsContact O-N 3.13Å; S1270-R1272 WeakPolarHBondContact O-CG 3.34Å; S1270-R1272 PolarHBondContact O-N 3.15Å
1271	S	62.9	Low	61.8	Low	23.2 Å²	23.2	75 Å²	75	16%	0.162	40%	0.396	C	S	.	.			trans	-59	134.9	-177	54.8	0	0	0	0	111.7	T1226 V1269	T1226-S1271 CarbonylContact O-C 3.46Å; T1226-S1271 VanDerWaalsContact O-CA 3.22Å; T1226-S1271 WeakPolarHBondContact O-CA 3.36Å; T1226-S1271 VanDerWaalsContact O-CB 3.26Å; T1226-S1271 WeakPolarHBondContact O-CB 3.31Å; T1226-S1271 PolarHBondContact OG1-O 2.93Å; V1269-S1271 PolarHBondContact O-N 2.86Å
1272	R	73.3	Confident	64.8	Low	115.6 Å²	115.6	70.4 Å²	70.4	44%	0.436	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	127.5	-179.2	-53.4	-179.3	177.3	175.1	-1	110.1	Y1225 T1226 S1270 Q1299	Y1225-R1272 CarbonylContact C-O 3.59Å; Y1225-R1272 WeakPolarHBondContact CA-O 3.38Å; Y1225-R1272 VanDerWaalsContact CD2-O 3.27Å; Y1225-R1272 WeakPolarHBondContact CD2-O 3.41Å; T1226-R1272 PolarHBondContact N-O 3.05Å; T1226-R1272 PolarHBondContact O-N 2.87Å; T1226-R1272 VanDerWaalsContact O-N 3.11Å; T1226-R1272 WeakPolarHBondContact OG1-CA 3.49Å; T1226-R1272 VanDerWaalsContact OG1-CB 3.27Å; T1226-R1272 WeakPolarHBondContact OG1-CB 3.32Å; T1226-R1272 PolarHBondContact OG1-N 3.23Å; T1226-R1272 PolarHBondContact OG1-O 2.89Å; S1270-R1272 WeakPolarHBondContact O-CG 3.34Å; S1270-R1272 PolarHBondContact O-N 3.15Å; R1272-Q1299 HydrophobicContact CB-CB 4.47Å; R1272-Q1299 PolarHBondContact N-O 3.15Å
1273	L	83.1	Confident	67.8	Low	27 Å²	27	61.3 Å²	61.3	14%	0.141	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	134.2	172.9	-177	101.4	0	0	0	108.3	F1223 Q1224 Y1225 V1275 R1298 Q1299 W1323	F1223-L1273 HydrophobicContact CD2-CD1 4.22Å; F1223-L1273 HydrophobicContact CE1-CD1 4.25Å; F1223-L1273 HydrophobicContact CE2-CD1 3.67Å; F1223-L1273 VanDerWaalsContact CE2-CD1 3.49Å; F1223-L1273 HydrophobicContact CE2-CD2 3.99Å; F1223-L1273 HydrophobicContact CE2-CG 4.12Å; F1223-L1273 HydrophobicContact CZ-CD1 3.73Å; F1223-L1273 VanDerWaalsContact CZ-CD1 3.46Å; F1223-L1273 HydrophobicContact CZ-CG 4.02Å; Q1224-L1273 CarbonylContact O-C 3.55Å; Q1224-L1273 WeakPolarHBondContact O-CA 3.39Å; Y1225-L1273 HydrophobicContact CD2-CB 4.36Å; Y1225-L1273 HydrophobicContact CD2-CD1 4.22Å; Y1225-L1273 HydrophobicContact CG-CD1 4.42Å; L1273-V1275 HydrophobicContact CD1-CG2 4.21Å; L1273-V1275 HydrophobicContact CD2-CG2 3.93Å; L1273-V1275 HydrophobicContact CG-CG2 4.36Å; L1273-R1298 CarbonylContact O-C 3.54Å; L1273-R1298 VanDerWaalsContact O-CA 3.29Å; L1273-R1298 WeakPolarHBondContact O-CA 3.26Å; L1273-Q1299 HydrophobicContact CB-CB 4.03Å; L1273-Q1299 PolarHBondContact O-N 3.27Å; L1273-W1323 HydrophobicContact CD1-CH2 4.38Å; L1273-W1323 HydrophobicContact CD2-CH2 3.79Å; L1273-W1323 HydrophobicContact CD2-CZ3 3.9Å
1274	K	85.6	Confident	70.6	Confident	65.6 Å²	65.6	55.7 Å²	55.7	29%	0.285	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	122.2	174.1	177.2	-178	-179.4	-161	0	108.9	F1223 Q1224 N1276 I1297 R1298	F1223-K1274 CarbonylContact C-O 3.58Å; Q1224-K1274 HydrophobicContact CB-CB 4.28Å; Q1224-K1274 PolarHBondContact N-O 3.1Å; Q1224-K1274 PolarHBondContact O-N 2.83Å; Q1224-K1274 VanDerWaalsContact O-O 3.09Å; K1274-N1276 VanDerWaalsContact CE-OD1 3.32Å; K1274-N1276 WeakPolarHBondContact CE-OD1 3.45Å; K1274-I1297 CarbonylContact C-O 3.55Å; K1274-I1297 VanDerWaalsContact CA-O 3.3Å; K1274-I1297 WeakPolarHBondContact CA-O 3.37Å; K1274-R1298 HydrophobicContact CB-CG 4.38Å; K1274-R1298 HydrophobicContact CG-CG 4.16Å
1275	V	87.6	Confident	73.4	Confident	28 Å²	28	51.5 Å²	51.5	17%	0.17	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	132	171.4	-175.2	0	0	0	0	107.7	T1221 S1222 F1223 L1273 K1296 I1297	T1221-V1275 HydrophobicContact CG2-CG1 4.04Å; S1222-V1275 CarbonylContact O-C 3.57Å; S1222-V1275 VanDerWaalsContact O-CA 3.3Å; S1222-V1275 WeakPolarHBondContact O-CA 3.39Å; F1223-V1275 HydrophobicContact CD2-CG2 3.8Å; F1223-V1275 HydrophobicContact CE2-CG2 4.3Å; F1223-V1275 HydrophobicContact CG-CG2 4.5Å; L1273-V1275 HydrophobicContact CD1-CG2 4.21Å; L1273-V1275 HydrophobicContact CD2-CG2 3.93Å; L1273-V1275 HydrophobicContact CG-CG2 4.36Å; V1275-K1296 CarbonylContact O-C 3.46Å; V1275-K1296 VanDerWaalsContact O-CA 3.29Å; V1275-K1296 WeakPolarHBondContact O-CA 3.31Å; V1275-I1297 HydrophobicContact CB-CB 4.23Å; V1275-I1297 HydrophobicContact CG2-CB 4.29Å; V1275-I1297 PolarHBondContact N-O 3.03Å; V1275-I1297 PolarHBondContact O-N 2.98Å
1276	N	89.1	Confident	75.9	Confident	31.6 Å²	31.6	49.7 Å²	49.7	17%	0.169	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	136.1	168.4	-35.1	-79.2	0	0	0	108.4	T1221 S1222 K1274 L1295 K1296	T1221-N1276 CarbonylContact C-O 3.55Å; T1221-N1276 VanDerWaalsContact CA-O 3.29Å; T1221-N1276 WeakPolarHBondContact CA-O 3.42Å; S1222-N1276 PolarHBondContact N-O 3.08Å; S1222-N1276 PolarHBondContact O-N 3.08Å; S1222-N1276 WeakPolarHBondContact OG-CB 3.37Å; S1222-N1276 PolarHBondContact OG-ND2 3.03Å; S1222-N1276 VanDerWaalsContact OG-ND2 3.1Å; S1222-N1276 PolarHBondContact OG-O 3Å; K1274-N1276 VanDerWaalsContact CE-OD1 3.32Å; K1274-N1276 WeakPolarHBondContact CE-OD1 3.45Å; N1276-L1295 CarbonylContact C-O 3.53Å; N1276-L1295 WeakPolarHBondContact CA-O 3.33Å; N1276-K1296 HydrophobicContact CB-CG 4.16Å; N1276-K1296 WeakPolarHBondContact OD1-CG 3.42Å
1277	C	88	Confident	78.6	Confident	7 Å²	7	51.3 Å²	51.3	5%	0.047	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	127.4	179.7	170.3	0	0	0	0	108	V1218 K1219 N1220 T1221 H1279 N1294 L1295	V1218-C1277 HydrophobicContact CG1-CB 4.17Å; V1218-C1277 WeakPolarHBondContact CG1-SG 3.32Å; K1219-C1277 PolarHBondContact O-SG 3.27Å; K1219-C1277 VanDerWaalsContact O-SG 3.4Å; N1220-C1277 WeakPolarHBondContact O-CA 3.49Å; T1221-C1277 HydrophobicContact CG2-CB 4.16Å; T1221-C1277 PolarHBondContact OG1-SG 2.85Å; T1221-C1277 VanDerWaalsContact OG1-SG 3.36Å; C1277-H1279 VanDerWaalsContact SG-C 3.57Å; C1277-H1279 PolarHBondContact SG-N 3.17Å; C1277-H1279 VanDerWaalsContact SG-N 3.41Å; C1277-H1279 PolarHBondContact SG-O 2.87Å; C1277-H1279 VanDerWaalsContact SG-O 3.39Å; C1277-N1294 CarbonylContact O-C 3.46Å; C1277-N1294 VanDerWaalsContact O-C 3.32Å; C1277-N1294 VanDerWaalsContact O-CA 3.29Å; C1277-N1294 WeakPolarHBondContact O-CA 3.31Å; C1277-L1295 HydrophobicContact CB-CB 4.33Å; C1277-L1295 PolarHBondContact N-O 3.14Å; C1277-L1295 PolarHBondContact O-N 2.89Å
1278	E	88.9	Confident	81.3	Confident	103.6 Å²	103.6	49.5 Å²	49.5	48%	0.484	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	-42.7	178.9	-156.3	-178.1	165.5	0	0	111.6	K1219 N1220 Q1293 N1294	K1219-E1278 PolarHBondContact O-N 3.41Å; N1220-E1278 HydrophobicContact CB-CB 4.02Å; N1220-E1278 VanDerWaalsContact CB-CD 3.44Å; N1220-E1278 HydrophobicContact CB-CG 3.87Å; N1220-E1278 VanDerWaalsContact CB-OE2 3.25Å; N1220-E1278 WeakPolarHBondContact CB-OE2 3.44Å; N1220-E1278 PolarHBondContact ND2-OE2 2.98Å; N1220-E1278 PolarHBondContact O-N 2.88Å; E1278-Q1293 CarbonylContact O-C 3.58Å; E1278-Q1293 WeakPolarHBondContact O-CA 3.44Å; E1278-N1294 PolarHBondContact O-N 3.06Å
1279	H	90.6	Very high	83.8	Confident	59 Å²	59	44.2 Å²	44.2	27%	0.273	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	121.4	-177.9	-167.6	82.9	0	0	0	111.3	V1218 K1219 C1277 V1281 V1291 F1292	V1218-H1279 WeakPolarHBondContact CA-O 3.2Å; K1219-H1279 HydrophobicContact CB-CB 4.34Å; K1219-H1279 HydrophobicContact CD-CB 4.49Å; K1219-H1279 PolarHBondContact N-O 3.09Å; C1277-H1279 VanDerWaalsContact SG-C 3.57Å; C1277-H1279 PolarHBondContact SG-N 3.17Å; C1277-H1279 VanDerWaalsContact SG-N 3.41Å; C1277-H1279 PolarHBondContact SG-O 2.87Å; C1277-H1279 VanDerWaalsContact SG-O 3.39Å; H1279-V1281 VanDerWaalsContact NE2-CG2 3.31Å; H1279-V1281 WeakPolarHBondContact NE2-CG2 3.26Å; H1279-V1291 VanDerWaalsContact CE1-CG1 3.48Å; H1279-V1291 WeakPolarHBondContact CE1-CG1 3.25Å; H1279-F1292 WeakPolarHBondContact CA-O 3.34Å
1280	A	91	Very high	86	Confident	5.6 Å²	5.6	42 Å²	42	5%	0.046	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	139.7	173	0	0	0	0	0	111	R1217 V1218 V1291 F1292	R1217-A1280 CarbonylContact O-C 3.54Å; R1217-A1280 VanDerWaalsContact O-CA 3.28Å; R1217-A1280 WeakPolarHBondContact O-CA 3.34Å; V1218-A1280 HydrophobicContact CG1-CB 4.11Å; V1218-A1280 HydrophobicContact CG2-CB 4.4Å; A1280-V1291 CarbonylContact O-C 3.35Å; A1280-V1291 WeakPolarHBondContact O-CA 3.41Å; A1280-F1292 HydrophobicContact CB-CB 4.18Å; A1280-F1292 HydrophobicContact CB-CD2 4.34Å; A1280-F1292 PolarHBondContact N-O 2.88Å; A1280-F1292 PolarHBondContact O-N 3.05Å
1281	V	92.5	Very high	87.9	Confident	15 Å²	15	41.4 Å²	41.4	9%	0.091	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	130.8	180	-174.8	0	0	0	0	108.9	V1216 R1217 H1279 M1283 T1288 A1290 V1291	V1216-V1281 CarbonylContact C-O 3.54Å; V1216-V1281 WeakPolarHBondContact CA-O 3.43Å; R1217-V1281 HydrophobicContact CB-CB 4.46Å; R1217-V1281 PolarHBondContact N-O 3.18Å; R1217-V1281 PolarHBondContact O-N 3.03Å; H1279-V1281 VanDerWaalsContact NE2-CG2 3.31Å; H1279-V1281 WeakPolarHBondContact NE2-CG2 3.26Å; V1281-M1283 HydrophobicContact CG1-CG 3.91Å; V1281-M1283 HydrophobicContact CG1-SD 4.46Å; V1281-T1288 HydrophobicContact CG1-CG2 3.63Å; V1281-A1290 CarbonylContact C-O 3.54Å; V1281-A1290 WeakPolarHBondContact CA-O 3.35Å; V1281-V1291 HydrophobicContact CG1-CG2 4.28Å; V1281-V1291 HydrophobicContact CG2-CG1 4.43Å; V1281-V1291 HydrophobicContact CG2-CG2 4.4Å
1282	I	93	Very high	89.5	Confident	40 Å²	40	41.8 Å²	41.8	21%	0.205	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	119.4	170.6	-55.9	179.8	0	0	0	107.7	I1214 M1215 V1216 I1289 A1290 F1292	I1214-I1282 HydrophobicContact CG2-CG2 3.83Å; M1215-I1282 CarbonylContact O-C 3.55Å; M1215-I1282 WeakPolarHBondContact O-CA 3.47Å; V1216-I1282 HydrophobicContact CG1-CG1 4.38Å; V1216-I1282 HydrophobicContact CG2-CG1 4.28Å; V1216-I1282 HydrophobicContact CG2-CG2 4.48Å; I1282-I1289 PolarHBondContact O-N 3.09Å; I1282-A1290 HydrophobicContact CB-CB 4.23Å; I1282-A1290 HydrophobicContact CD1-CB 4.42Å; I1282-A1290 PolarHBondContact N-O 2.98Å; I1282-A1290 PolarHBondContact O-N 3.03Å; I1282-A1290 VanDerWaalsContact O-N 3.13Å; I1282-F1292 HydrophobicContact CD1-CE2 3.74Å; I1282-F1292 HydrophobicContact CD1-CZ 4.03Å; I1282-F1292 HydrophobicContact CG1-CE2 3.91Å
1283	M	91.5	Very high	90.5	Very high	18 Å²	18	39.8 Å²	39.8	9%	0.089	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	141.3	175.4	-57.9	171.2	49.1	0	0	109	I1214 M1215 R1217 V1281 D1286 Q1287	I1214-M1283 CarbonylContact C-O 3.54Å; I1214-M1283 WeakPolarHBondContact CA-O 3.24Å; I1214-M1283 WeakPolarHBondContact CG2-O 3.43Å; M1215-M1283 HydrophobicContact CB-CB 4.37Å; M1215-M1283 HydrophobicContact CB-CE 4.2Å; M1215-M1283 HydrophobicContact CE-CB 4.21Å; M1215-M1283 HydrophobicContact CE-CE 3.8Å; M1215-M1283 VanDerWaalsContact CE-CE 3.41Å; M1215-M1283 HydrophobicContact CE-CG 4.27Å; M1215-M1283 HydrophobicContact CE-SD 3.76Å; M1215-M1283 VanDerWaalsContact CE-SD 3.52Å; M1215-M1283 WeakPolarHBondContact CE-SD 3.23Å; M1215-M1283 HydrophobicContact CG-CE 4.12Å; M1215-M1283 PolarHBondContact N-O 2.99Å; M1215-M1283 PolarHBondContact O-N 2.97Å; M1215-M1283 HydrophobicContact SD-CB 4.4Å; M1215-M1283 HydrophobicContact SD-CE 3.09Å; M1215-M1283 WeakPolarHBondContact SD-CE 3.46Å; M1215-M1283 HydrophobicContact SD-CG 4.3Å; M1215-M1283 HydrophobicContact SD-SD 3.74Å; R1217-M1283 HydrophobicContact CB-CE 4.21Å; V1281-M1283 HydrophobicContact CG1-CG 3.91Å; V1281-M1283 HydrophobicContact CG1-SD 4.46Å; M1283-D1286 HydrophobicContact CE-CB 4.36Å; M1283-D1286 WeakPolarHBondContact CE-O 3.46Å; M1283-Q1287 CarbonylContact C-O 3.53Å; M1283-Q1287 WeakPolarHBondContact CA-O 3.29Å; M1283-Q1287 WeakPolarHBondContact CB-O 3.39Å
1284	C	90.3	Very high	91	Very high	2.6 Å²	2.6	41.3 Å²	41.3	2%	0.018	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	120	168.8	-61.2	0	0	0	0	106.5	F1213 D1286 Q1287 I1289 Y1338 V1343	F1213-C1284 WeakPolarHBondContact O-CA 3.36Å; C1284-D1286 VanDerWaalsContact C-N 3.28Å; C1284-D1286 PolarHBondContact O-N 3.02Å; C1284-Q1287 PolarHBondContact N-O 2.98Å; C1284-Q1287 WeakPolarHBondContact O-CB 3.35Å; C1284-Q1287 PolarHBondContact O-N 2.93Å; C1284-I1289 HydrophobicContact CB-CG1 3.9Å; C1284-Y1338 HydrophobicContact CB-CE1 4.23Å; C1284-Y1338 VanDerWaalsContact CB-OH 3.25Å; C1284-Y1338 WeakPolarHBondContact CB-OH 3.38Å; C1284-Y1338 PolarHBondContact O-OH 3.13Å; C1284-Y1338 VanDerWaalsContact O-OH 3.12Å; C1284-V1343 HydrophobicContact CB-CG1 4.2Å
1285	E	87	Confident	91.3	Very high	48.8 Å²	48.8	39.2 Å²	39.2	23%	0.228	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	32.5	-175.6	-55.6	169.9	139.3	0	0	111.8	H1212 F1213 M1215 Q1287 Y1338 V1343	H1212-E1285 IonicContact CE1-OE1 3.06Å; H1212-E1285 PolarHBondContact CE1-OE1 3.17Å; H1212-E1285 IonicContact CG-OE1 3.39Å; H1212-E1285 IonicContact ND1-OE1 3.21Å; H1212-E1285 PolarHBondContact ND1-OE1 3.04Å; H1212-E1285 IonicContact ND1-OE2 3.15Å; F1213-E1285 HydrophobicContact CD1-CG 4.26Å; F1213-E1285 HydrophobicContact CE1-CB 4.31Å; F1213-E1285 HydrophobicContact CE1-CG 4.28Å; F1213-E1285 VanDerWaalsContact CZ-CA 3.47Å; F1213-E1285 HydrophobicContact CZ-CB 4.23Å; F1213-E1285 PolarHBondContact O-N 3.1Å; F1213-E1285 VanDerWaalsContact O-N 3.13Å; M1215-E1285 VanDerWaalsContact CE-O 3.24Å; M1215-E1285 WeakPolarHBondContact CE-O 3.31Å; E1285-Q1287 PolarHBondContact O-N 3.11Å; E1285-Q1287 VanDerWaalsContact O-N 3.09Å; E1285-Y1338 HydrophobicContact CB-CE2 4.34Å; E1285-Y1338 VanDerWaalsContact OE2-CE2 3.28Å; E1285-Y1338 WeakPolarHBondContact OE2-CE2 3.4Å; E1285-Y1338 PolarHBondContact OE2-OH 3.15Å; E1285-Y1338 VanDerWaalsContact OE2-OH 3.05Å; E1285-V1343 WeakPolarHBondContact OE2-CG2 3.49Å
1286	D	86.1	Confident	91.6	Very high	115 Å²	115	41.7 Å²	41.7	62%	0.615	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	25.6	-3	-177.1	-57.9	-38.9	0	0	0	115.6	M1215 M1283 C1284 T1288	M1215-D1286 WeakPolarHBondContact CE-OD1 3.2Å; M1283-D1286 HydrophobicContact CE-CB 4.36Å; M1283-D1286 WeakPolarHBondContact CE-O 3.46Å; C1284-D1286 VanDerWaalsContact C-N 3.28Å; C1284-D1286 PolarHBondContact O-N 3.02Å; D1286-T1288 PolarHBondContact O-N 2.91Å
1287	Q	89.4	Confident	91.8	Very high	77 Å²	77	41.8 Å²	41.8	36%	0.36	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	128.2	176.7	-61.5	-71.2	-37.6	0	0	111.1	M1283 C1284 E1285 I1289 P1335 Y1338	M1283-Q1287 CarbonylContact C-O 3.53Å; M1283-Q1287 WeakPolarHBondContact CA-O 3.29Å; M1283-Q1287 WeakPolarHBondContact CB-O 3.39Å; C1284-Q1287 PolarHBondContact N-O 2.98Å; C1284-Q1287 WeakPolarHBondContact O-CB 3.35Å; C1284-Q1287 PolarHBondContact O-N 2.93Å; E1285-Q1287 PolarHBondContact O-N 3.11Å; E1285-Q1287 VanDerWaalsContact O-N 3.09Å; Q1287-I1289 HydrophobicContact CB-CD1 4.25Å; Q1287-I1289 PolarHBondContact O-N 3.09Å; Q1287-P1335 HydrophobicContact CB-CG 4.22Å; Q1287-P1335 HydrophobicContact CG-CG 4.37Å; Q1287-P1335 VanDerWaalsContact OE1-CB 3.26Å; Q1287-P1335 VanDerWaalsContact OE1-CG 3.3Å; Q1287-Y1338 HydrophobicContact CB-CD1 4.41Å; Q1287-Y1338 HydrophobicContact CB-CD2 4.39Å; Q1287-Y1338 HydrophobicContact CB-CE1 4.35Å; Q1287-Y1338 HydrophobicContact CB-CE2 4.36Å; Q1287-Y1338 HydrophobicContact CB-CG 4.41Å; Q1287-Y1338 HydrophobicContact CG-CD1 4.44Å; Q1287-Y1338 HydrophobicContact CG-CD2 3.75Å; Q1287-Y1338 HydrophobicContact CG-CE2 3.97Å; Q1287-Y1338 HydrophobicContact CG-CG 4.06Å; Q1287-Y1338 VanDerWaalsContact OE1-CD2 3.29Å; Q1287-Y1338 VanDerWaalsContact OE1-CG 3.28Å
1288	T	91.8	Very high	91.9	Very high	51.6 Å²	51.6	45.7 Å²	45.7	32%	0.317	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	120.5	173.2	-64.4	0	0	0	0	109.7	V1281 D1286 V1291 T1333	V1281-T1288 HydrophobicContact CG1-CG2 3.63Å; D1286-T1288 PolarHBondContact O-N 2.91Å; T1288-V1291 HydrophobicContact CG2-CG2 3.75Å; T1288-T1333 VanDerWaalsContact O-CG2 3.26Å; T1288-T1333 WeakPolarHBondContact O-CG2 3.38Å
1289	I	94.1	Very high	91.9	Very high	6.6 Å²	6.6	42.5 Å²	42.5	3%	0.034	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	-36.7	-177.1	-57.5	-57.7	0	0	0	112.1	I1282 C1284 Q1287 V1332 T1333 F1334 P1335 Y1338 F1340	I1282-I1289 PolarHBondContact O-N 3.09Å; C1284-I1289 HydrophobicContact CB-CG1 3.9Å; Q1287-I1289 HydrophobicContact CB-CD1 4.25Å; Q1287-I1289 PolarHBondContact O-N 3.09Å; I1289-V1332 CarbonylContact O-C 3.5Å; I1289-V1332 VanDerWaalsContact O-CA 3.25Å; I1289-V1332 WeakPolarHBondContact O-CA 3.38Å; I1289-V1332 WeakPolarHBondContact O-CG1 3.32Å; I1289-T1333 PolarHBondContact O-N 3.19Å; I1289-F1334 HydrophobicContact CG2-CD1 4.27Å; I1289-F1334 HydrophobicContact CG2-CE1 4.22Å; I1289-F1334 HydrophobicContact CG2-CZ 4.17Å; I1289-P1335 HydrophobicContact CD1-CG 4.45Å; I1289-Y1338 HydrophobicContact CD1-CD1 3.87Å; I1289-Y1338 HydrophobicContact CD1-CE1 3.77Å; I1289-Y1338 HydrophobicContact CG1-CE1 4.41Å; I1289-F1340 HydrophobicContact CB-CD2 4.5Å; I1289-F1340 HydrophobicContact CB-CE2 4.23Å; I1289-F1340 HydrophobicContact CD1-CD2 4.29Å; I1289-F1340 HydrophobicContact CG1-CD2 4.23Å; I1289-F1340 HydrophobicContact CG1-CE2 4.31Å; I1289-F1340 HydrophobicContact CG2-CD2 4.16Å; I1289-F1340 HydrophobicContact CG2-CE2 3.88Å; I1289-F1340 HydrophobicContact CG2-CZ 4.36Å
1290	A	94.7	Very high	91.6	Very high	7.6 Å²	7.6	43.2 Å²	43.2	6%	0.063	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	141.7	177.7	0	0	0	0	0	112.7	V1281 I1282 F1292 Y1331 V1332	V1281-A1290 CarbonylContact C-O 3.54Å; V1281-A1290 WeakPolarHBondContact CA-O 3.35Å; I1282-A1290 HydrophobicContact CB-CB 4.23Å; I1282-A1290 HydrophobicContact CD1-CB 4.42Å; I1282-A1290 PolarHBondContact N-O 2.98Å; I1282-A1290 PolarHBondContact O-N 3.03Å; I1282-A1290 VanDerWaalsContact O-N 3.13Å; A1290-F1292 HydrophobicContact CB-CE2 3.95Å; A1290-F1292 HydrophobicContact CB-CZ 4.4Å; A1290-Y1331 CarbonylContact C-O 3.54Å; A1290-Y1331 VanDerWaalsContact CA-O 3.27Å; A1290-Y1331 WeakPolarHBondContact CA-O 3.34Å; A1290-V1332 HydrophobicContact CB-CG2 4.3Å
1291	V	95.6	Very high	91.1	Very high	21.8 Å²	21.8	44.3 Å²	44.3	13%	0.132	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	131.5	177.7	-178.6	0	0	0	0	109.1	H1279 A1280 V1281 T1288 Q1293 L1330 Y1331	H1279-V1291 VanDerWaalsContact CE1-CG1 3.48Å; H1279-V1291 WeakPolarHBondContact CE1-CG1 3.25Å; A1280-V1291 CarbonylContact O-C 3.35Å; A1280-V1291 WeakPolarHBondContact O-CA 3.41Å; V1281-V1291 HydrophobicContact CG1-CG2 4.28Å; V1281-V1291 HydrophobicContact CG2-CG1 4.43Å; V1281-V1291 HydrophobicContact CG2-CG2 4.4Å; T1288-V1291 HydrophobicContact CG2-CG2 3.75Å; V1291-Q1293 HydrophobicContact CG1-CG 4.48Å; V1291-L1330 WeakPolarHBondContact O-CA 3.45Å; V1291-Y1331 HydrophobicContact CB-CD1 4.34Å; V1291-Y1331 HydrophobicContact CG2-CD1 4.24Å; V1291-Y1331 PolarHBondContact N-O 3.3Å; V1291-Y1331 PolarHBondContact O-N 3.11Å
1292	F	95.4	Very high	90.5	Very high	30.2 Å²	30.2	49.6 Å²	49.6	13%	0.132	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	129.6	178.5	-58.4	-102.5	0	0	0	109.1	H1279 A1280 I1282 A1290 L1295 M1327 L1329 L1330	H1279-F1292 WeakPolarHBondContact CA-O 3.34Å; A1280-F1292 HydrophobicContact CB-CB 4.18Å; A1280-F1292 HydrophobicContact CB-CD2 4.34Å; A1280-F1292 PolarHBondContact N-O 2.88Å; A1280-F1292 PolarHBondContact O-N 3.05Å; I1282-F1292 HydrophobicContact CD1-CE2 3.74Å; I1282-F1292 HydrophobicContact CD1-CZ 4.03Å; I1282-F1292 HydrophobicContact CG1-CE2 3.91Å; A1290-F1292 HydrophobicContact CB-CE2 3.95Å; A1290-F1292 HydrophobicContact CB-CZ 4.4Å; F1292-L1295 HydrophobicContact CB-CB 4.32Å; F1292-L1295 HydrophobicContact CB-CD2 4.47Å; F1292-L1295 HydrophobicContact CD1-CD1 4.43Å; F1292-L1295 HydrophobicContact CD1-CD2 4.3Å; F1292-L1295 HydrophobicContact CG-CD2 4.32Å; F1292-M1327 HydrophobicContact CD1-SD 3.96Å; F1292-M1327 HydrophobicContact CE1-SD 4.31Å; F1292-L1329 WeakPolarHBondContact CA-O 3.31Å; F1292-L1330 HydrophobicContact CD1-CD1 3.81Å; F1292-L1330 HydrophobicContact CD2-CD1 4.43Å; F1292-L1330 HydrophobicContact CE1-CB 4.44Å; F1292-L1330 HydrophobicContact CE1-CD1 3.47Å; F1292-L1330 VanDerWaalsContact CE1-CD1 3.43Å; F1292-L1330 HydrophobicContact CE1-CD2 4.26Å; F1292-L1330 HydrophobicContact CE1-CG 4.19Å; F1292-L1330 HydrophobicContact CE2-CD1 4.2Å; F1292-L1330 HydrophobicContact CG-CD1 4.31Å; F1292-L1330 HydrophobicContact CZ-CD1 3.68Å; F1292-L1330 HydrophobicContact CZ-CD2 4.32Å; F1292-L1330 HydrophobicContact CZ-CG 4.41Å
1293	Q	94.9	Very high	89.8	Confident	73.6 Å²	73.6	49.3 Å²	49.3	34%	0.344	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	133.6	171.8	-59.9	179.5	-12.2	0	0	110.5	E1278 V1291 L1295 D1328 L1329	E1278-Q1293 CarbonylContact O-C 3.58Å; E1278-Q1293 WeakPolarHBondContact O-CA 3.44Å; V1291-Q1293 HydrophobicContact CG1-CG 4.48Å; Q1293-L1295 VanDerWaalsContact C-N 3.3Å; Q1293-L1295 PolarHBondContact O-N 3.06Å; Q1293-D1328 PolarHBondContact O-N 3.08Å; Q1293-L1329 HydrophobicContact CB-CB 3.94Å; Q1293-L1329 HydrophobicContact CG-CB 4.01Å; Q1293-L1329 HydrophobicContact CG-CD2 4.24Å; Q1293-L1329 PolarHBondContact N-O 3.04Å; Q1293-L1329 PolarHBondContact O-N 2.97Å
1294	N	93.8	Very high	89.4	Confident	60 Å²	60	52.4 Å²	52.4	32%	0.321	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	52.8	43.7	179.7	-66	-32.7	0	0	0	114.2	C1277 E1278 K1296 D1328	C1277-N1294 CarbonylContact O-C 3.46Å; C1277-N1294 VanDerWaalsContact O-C 3.32Å; C1277-N1294 VanDerWaalsContact O-CA 3.29Å; C1277-N1294 WeakPolarHBondContact O-CA 3.31Å; E1278-N1294 PolarHBondContact O-N 3.06Å; N1294-K1296 PolarHBondContact O-N 3.07Å; N1294-D1328 HydrophobicContact CB-CB 4.17Å; N1294-D1328 VanDerWaalsContact CB-OD2 3.28Å; N1294-D1328 WeakPolarHBondContact CB-OD2 3.3Å; N1294-D1328 PolarHBondContact ND2-OD2 3.25Å
1295	L	92.9	Very high	89	Confident	21 Å²	21	58.7 Å²	58.7	11%	0.11	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	120.3	177.4	177.9	62.9	0	0	0	111.1	N1276 C1277 F1292 Q1293 I1297 Y1326 M1327	N1276-L1295 CarbonylContact C-O 3.53Å; N1276-L1295 WeakPolarHBondContact CA-O 3.33Å; C1277-L1295 HydrophobicContact CB-CB 4.33Å; C1277-L1295 PolarHBondContact N-O 3.14Å; C1277-L1295 PolarHBondContact O-N 2.89Å; F1292-L1295 HydrophobicContact CB-CB 4.32Å; F1292-L1295 HydrophobicContact CB-CD2 4.47Å; F1292-L1295 HydrophobicContact CD1-CD1 4.43Å; F1292-L1295 HydrophobicContact CD1-CD2 4.3Å; F1292-L1295 HydrophobicContact CG-CD2 4.32Å; Q1293-L1295 VanDerWaalsContact C-N 3.3Å; Q1293-L1295 PolarHBondContact O-N 3.06Å; L1295-I1297 HydrophobicContact CD1-CD1 4.08Å; L1295-I1297 HydrophobicContact CD1-CG1 4.07Å; L1295-I1297 HydrophobicContact CD2-CD1 4.25Å; L1295-I1297 HydrophobicContact CD2-CG1 4.47Å; L1295-I1297 HydrophobicContact CG-CD1 4.36Å; L1295-I1297 HydrophobicContact CG-CG1 4.14Å; L1295-Y1326 CarbonylContact C-O 3.56Å; L1295-Y1326 WeakPolarHBondContact CA-O 3.34Å; L1295-M1327 HydrophobicContact CB-CB 4.49Å; L1295-M1327 HydrophobicContact CD1-CB 4.31Å; L1295-M1327 HydrophobicContact CD1-CE 3.88Å; L1295-M1327 HydrophobicContact CD1-SD 4.33Å
1296	K	93.5	Very high	88.7	Confident	81 Å²	81	57.3 Å²	57.3	35%	0.352	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	120.1	175.8	-59.2	168.6	-171.2	165.1	0	108.7	V1275 N1276 N1294 F1325 Y1326	V1275-K1296 CarbonylContact O-C 3.46Å; V1275-K1296 VanDerWaalsContact O-CA 3.29Å; V1275-K1296 WeakPolarHBondContact O-CA 3.31Å; N1276-K1296 HydrophobicContact CB-CG 4.16Å; N1276-K1296 WeakPolarHBondContact OD1-CG 3.42Å; N1294-K1296 PolarHBondContact O-N 3.07Å; K1296-F1325 CarbonylContact O-C 3.54Å; K1296-F1325 WeakPolarHBondContact O-CA 3.39Å; K1296-Y1326 HydrophobicContact CB-CD1 4.44Å; K1296-Y1326 HydrophobicContact CD-CD1 3.92Å; K1296-Y1326 HydrophobicContact CD-CE1 4.46Å; K1296-Y1326 HydrophobicContact CG-CD1 4.28Å; K1296-Y1326 PolarHBondContact N-O 2.96Å; K1296-Y1326 PolarHBondContact O-N 3.08Å
1297	I	93	Very high	88.8	Confident	31.8 Å²	31.8	51.8 Å²	51.8	16%	0.163	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	128.2	179.1	-53.2	178.4	0	0	0	108	K1274 V1275 L1295 W1323 E1324 F1325	K1274-I1297 CarbonylContact C-O 3.55Å; K1274-I1297 VanDerWaalsContact CA-O 3.3Å; K1274-I1297 WeakPolarHBondContact CA-O 3.37Å; V1275-I1297 HydrophobicContact CB-CB 4.23Å; V1275-I1297 HydrophobicContact CG2-CB 4.29Å; V1275-I1297 PolarHBondContact N-O 3.03Å; V1275-I1297 PolarHBondContact O-N 2.98Å; L1295-I1297 HydrophobicContact CD1-CD1 4.08Å; L1295-I1297 HydrophobicContact CD1-CG1 4.07Å; L1295-I1297 HydrophobicContact CD2-CD1 4.25Å; L1295-I1297 HydrophobicContact CD2-CG1 4.47Å; L1295-I1297 HydrophobicContact CG-CD1 4.36Å; L1295-I1297 HydrophobicContact CG-CG1 4.14Å; I1297-W1323 HydrophobicContact CG2-CE3 3.8Å; I1297-W1323 HydrophobicContact CG2-CZ3 3.79Å; I1297-E1324 CarbonylContact C-O 3.52Å; I1297-E1324 WeakPolarHBondContact CA-O 3.29Å; I1297-F1325 HydrophobicContact CB-CD1 4.41Å; I1297-F1325 HydrophobicContact CB-CE1 4.48Å; I1297-F1325 HydrophobicContact CD1-CD1 4.19Å; I1297-F1325 HydrophobicContact CD1-CE1 4.15Å; I1297-F1325 HydrophobicContact CG1-CD1 3.87Å; I1297-F1325 HydrophobicContact CG1-CE1 4.19Å; I1297-F1325 HydrophobicContact CG1-CG 4.5Å; I1297-F1325 HydrophobicContact CG2-CD1 4Å; I1297-F1325 HydrophobicContact CG2-CE1 3.73Å; I1297-F1325 HydrophobicContact CG2-CG 4.45Å; I1297-F1325 HydrophobicContact CG2-CZ 4.36Å
1298	R	90.9	Very high	88.6	Confident	90.6 Å²	90.6	51.4 Å²	51.4	34%	0.342	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	132.8	-179	-56.7	179.3	112.2	172.8	1.2	111	L1273 K1274 W1323 E1324	L1273-R1298 CarbonylContact O-C 3.54Å; L1273-R1298 VanDerWaalsContact O-CA 3.29Å; L1273-R1298 WeakPolarHBondContact O-CA 3.26Å; K1274-R1298 HydrophobicContact CB-CG 4.38Å; K1274-R1298 HydrophobicContact CG-CG 4.16Å; R1298-W1323 CarbonylContact O-C 3.52Å; R1298-W1323 WeakPolarHBondContact O-CA 3.34Å; R1298-E1324 HydrophobicContact CB-CB 4.33Å; R1298-E1324 WeakPolarHBondContact CD-OE2 3.36Å; R1298-E1324 IonicContact CZ-OE2 3.62Å; R1298-E1324 PolarHBondContact N-O 3.19Å; R1298-E1324 IonicContact NE-OE2 3.58Å; R1298-E1324 IonicContact NH1-OE2 2.68Å; R1298-E1324 PolarHBondContact O-N 3.2Å
1299	Q	88.8	Confident	88	Confident	34.8 Å²	34.8	54.5 Å²	54.5	16%	0.163	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	116	164.2	-170.5	179.9	13.4	0	0	108.4	R1272 L1273 S1322 W1323	R1272-Q1299 HydrophobicContact CB-CB 4.47Å; R1272-Q1299 PolarHBondContact N-O 3.15Å; L1273-Q1299 HydrophobicContact CB-CB 4.03Å; L1273-Q1299 PolarHBondContact O-N 3.27Å; Q1299-S1322 CarbonylContact C-O 3.56Å; Q1299-S1322 WeakPolarHBondContact CA-O 3.23Å; Q1299-W1323 HydrophobicContact CB-CD2 4.18Å; Q1299-W1323 HydrophobicContact CB-CE3 4.2Å; Q1299-W1323 HydrophobicContact CB-CH2 4.01Å; Q1299-W1323 HydrophobicContact CB-CZ2 3.95Å; Q1299-W1323 HydrophobicContact CB-CZ3 4.12Å; Q1299-W1323 HydrophobicContact CG-CD2 4.3Å; Q1299-W1323 HydrophobicContact CG-CH2 4.46Å; Q1299-W1323 HydrophobicContact CG-CZ2 3.9Å
1300	R	82.8	Confident	87.6	Confident	75.4 Å²	75.4	54.4 Å²	54.4	29%	0.285	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	145.4	173.4	-68.3	-126.4	-173.7	161.5	13.5	110.8	P1321 S1322 E1324	R1300-P1321 WeakPolarHBondContact O-CB 3.4Å; R1300-S1322 WeakPolarHBondContact CB-OG 3.47Å; R1300-S1322 PolarHBondContact N-O 3.21Å; R1300-S1322 PolarHBondContact O-N 3.14Å; R1300-E1324 VanDerWaalsContact CD-OE1 3.23Å; R1300-E1324 WeakPolarHBondContact CD-OE1 3.36Å; R1300-E1324 HydrophobicContact CG-CG 4.28Å; R1300-E1324 WeakPolarHBondContact CG-OE1 3.11Å; R1300-E1324 VanDerWaalsContact CZ-CD 3.46Å; R1300-E1324 IonicContact CZ-OE1 3.22Å; R1300-E1324 IonicContact CZ-OE2 3.48Å; R1300-E1324 VanDerWaalsContact CZ-OE2 3.27Å; R1300-E1324 IonicContact NE-OE1 3.28Å; R1300-E1324 PolarHBondContact NE-OE1 3.14Å; R1300-E1324 IonicContact NE-OE2 3.34Å; R1300-E1324 PolarHBondContact NE-OE2 3.05Å; R1300-E1324 IonicContact NH1-OE1 3.36Å; R1300-E1324 PolarHBondContact NH1-OE1 2.84Å; R1300-E1324 VanDerWaalsContact NH2-CD 3.3Å; R1300-E1324 IonicContact NH2-OE1 3.68Å; R1300-E1324 PolarHBondContact NH2-OE1 3.38Å; R1300-E1324 VanDerWaalsContact NH2-OE1 3.13Å; R1300-E1324 IonicContact NH2-OE2 3.51Å; R1300-E1324 PolarHBondContact NH2-OE2 2.95Å
1301	P	81.8	Confident	86.9	Confident	27.6 Å²	27.6	56.5 Å²	56.5	18%	0.179	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	177.4	165.8	33.5	-36.4	0	0	0	110.5	V1269 N1303	V1269-P1301 HydrophobicContact CB-CG 4.32Å; V1269-P1301 HydrophobicContact CG1-CB 4.33Å; V1269-P1301 HydrophobicContact CG1-CG 3.28Å; P1301-N1303 PolarHBondContact O-N 3.3Å; P1301-N1303 VanDerWaalsContact O-N 3.14Å
1302	E	79.9	Confident	86	Confident	126.8 Å²	126.8	64.3 Å²	64.3	59%	0.593	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-52.3	123.9	174	-73.4	156.5	-142.8	0	0	111.2	A1319 P1321	E1302-A1319 HydrophobicContact CB-CB 4.36Å; E1302-P1321 HydrophobicContact CG-CB 4.41Å; E1302-P1321 VanDerWaalsContact CG-CD 3.43Å; E1302-P1321 HydrophobicContact CG-CG 3.97Å
1303	N	78.6	Confident	85.1	Confident	33.8 Å²	33.8	68 Å²	68	18%	0.181	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	144.3	-178.2	-167.5	-9.1	0	0	0	109.9	P1301 Q1305 H1306 N1320	P1301-N1303 PolarHBondContact O-N 3.3Å; P1301-N1303 VanDerWaalsContact O-N 3.14Å; N1303-Q1305 PolarHBondContact ND2-OE1 3.2Å; N1303-Q1305 WeakPolarHBondContact OD1-CB 3.35Å; N1303-Q1305 VanDerWaalsContact OD1-CG 3.3Å; N1303-Q1305 WeakPolarHBondContact OD1-CG 3.31Å; N1303-Q1305 PolarHBondContact OD1-N 3.09Å; N1303-H1306 PolarHBondContact O-CE1 3Å; N1303-H1306 VanDerWaalsContact O-CE1 3.26Å; N1303-N1320 PolarHBondContact N-O 3.04Å
1304	I	81.8	Confident	84.3	Confident	82 Å²	82	67.3 Å²	67.3	42%	0.421	33%	0.334	S	S	.	.	S	Bend	trans	-89.1	-26.9	176.3	-133.2	162.2	0	0	0	111.9	H1306 R1307 T1308 L1311 R1318 A1319	I1304-H1306 VanDerWaalsContact C-N 3.33Å; I1304-H1306 PolarHBondContact O-N 3.03Å; I1304-H1306 VanDerWaalsContact O-N 3.11Å; I1304-R1307 CarbonylContact O-C 3.51Å; I1304-R1307 WeakPolarHBondContact O-CA 3.43Å; I1304-R1307 WeakPolarHBondContact O-CB 3.39Å; I1304-R1307 PolarHBondContact O-N 3.06Å; I1304-T1308 HydrophobicContact CG2-CG2 4.19Å; I1304-T1308 PolarHBondContact O-N 3.07Å; I1304-T1308 PolarHBondContact O-OG1 2.87Å; I1304-T1308 VanDerWaalsContact O-OG1 3.11Å; I1304-L1311 HydrophobicContact CD1-CD1 3.87Å; I1304-L1311 HydrophobicContact CG1-CD1 3.85Å; I1304-L1311 HydrophobicContact CG2-CD1 4.05Å; I1304-R1318 HydrophobicContact CD1-CB 4.4Å; I1304-R1318 WeakPolarHBondContact CG1-O 3.44Å; I1304-A1319 HydrophobicContact CG1-CB 3.94Å
1305	Q	81.9	Confident	83.8	Confident	135.8 Å²	135.8	65 Å²	65	64%	0.635	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-54.7	-44.9	-167.2	-73.4	173.8	-23.7	0	0	113.9	N1303 R1307 T1308	N1303-Q1305 PolarHBondContact ND2-OE1 3.2Å; N1303-Q1305 WeakPolarHBondContact OD1-CB 3.35Å; N1303-Q1305 VanDerWaalsContact OD1-CG 3.3Å; N1303-Q1305 WeakPolarHBondContact OD1-CG 3.31Å; N1303-Q1305 PolarHBondContact OD1-N 3.09Å; Q1305-R1307 VanDerWaalsContact C-N 3.32Å; Q1305-R1307 PolarHBondContact O-N 2.83Å; Q1305-T1308 VanDerWaalsContact C-OG1 3.31Å; Q1305-T1308 WeakPolarHBondContact CA-OG1 3.31Å; Q1305-T1308 PolarHBondContact O-N 2.76Å; Q1305-T1308 PolarHBondContact O-OG1 3.09Å; Q1305-T1308 VanDerWaalsContact O-OG1 3.08Å
1306	H	81.6	Confident	83.3	Confident	19.2 Å²	19.2	69.2 Å²	69.2	9%	0.089	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-76.7	-12.6	-178.9	64.8	-82.7	0	0	0	113.8	N1303 I1304 D1426 I1428 K1530	N1303-H1306 PolarHBondContact O-CE1 3Å; N1303-H1306 VanDerWaalsContact O-CE1 3.26Å; I1304-H1306 VanDerWaalsContact C-N 3.33Å; I1304-H1306 PolarHBondContact O-N 3.03Å; I1304-H1306 VanDerWaalsContact O-N 3.11Å; H1306-D1426 IonicContact CD2-OD2 3.41Å; H1306-D1426 IonicContact CE1-OD2 3.21Å; H1306-D1426 IonicContact NE2-OD2 3.12Å; H1306-D1426 PolarHBondContact NE2-OD2 3.18Å; H1306-I1428 HydrophobicContact CB-CD1 3.82Å; H1306-K1530 PolarHBondContact O-NZ 2.81Å
1307	R	87.1	Confident	82.9	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-99.6	-14.2	-179.2	-61.8	-177.9	126.4	179.8	-6.4	113.6	I1304 Q1305 E1309 H1310 L1311 L1315 T1317 N1320 D1426 L1532 A1533 D1534	I1304-R1307 CarbonylContact O-C 3.51Å; I1304-R1307 WeakPolarHBondContact O-CA 3.43Å; I1304-R1307 WeakPolarHBondContact O-CB 3.39Å; I1304-R1307 PolarHBondContact O-N 3.06Å; Q1305-R1307 VanDerWaalsContact C-N 3.32Å; Q1305-R1307 PolarHBondContact O-N 2.83Å; R1307-E1309 VanDerWaalsContact C-N 3.28Å; R1307-E1309 PolarHBondContact O-N 3.14Å; R1307-E1309 VanDerWaalsContact O-N 3.12Å; R1307-H1310 WeakPolarHBondContact O-CA 3.34Å; R1307-H1310 WeakPolarHBondContact O-CB 3.39Å; R1307-H1310 PolarHBondContact O-N 3.23Å; R1307-L1311 HydrophobicContact CB-CG 4.4Å; R1307-L1311 WeakPolarHBondContact O-CG 3.32Å; R1307-L1311 PolarHBondContact O-N 2.73Å; R1307-L1311 VanDerWaalsContact O-N 3.1Å; R1307-L1315 HydrophobicContact CB-CD2 4.11Å; R1307-L1315 HydrophobicContact CG-CD2 4.29Å; R1307-L1315 VanDerWaalsContact NH2-CD2 3.28Å; R1307-T1317 VanDerWaalsContact CZ-O 3.26Å; R1307-T1317 PolarHBondContact NE-O 3.13Å; R1307-T1317 VanDerWaalsContact NH1-CB 3.32Å; R1307-T1317 VanDerWaalsContact NH1-CG2 3.3Å; R1307-T1317 PolarHBondContact NH1-O 3.07Å; R1307-T1317 VanDerWaalsContact NH2-CB 3.31Å; R1307-T1317 PolarHBondContact NH2-O 3.36Å; R1307-N1320 PolarHBondContact NH2-ND2 2.96Å; R1307-N1320 VanDerWaalsContact NH2-ND2 3.16Å; R1307-D1426 IonicContact CZ-OD1 3.34Å; R1307-D1426 IonicContact CZ-OD2 3.21Å; R1307-D1426 VanDerWaalsContact CZ-OD2 3.25Å; R1307-D1426 IonicContact NE-OD2 3.37Å; R1307-D1426 PolarHBondContact NE-OD2 3.26Å; R1307-D1426 IonicContact NH1-OD1 3.54Å; R1307-D1426 PolarHBondContact NH1-OD1 3.17Å; R1307-D1426 IonicContact NH1-OD2 2.75Å; R1307-D1426 PolarHBondContact NH1-OD2 2.78Å; R1307-D1426 IonicContact NH2-OD1 3.53Å; R1307-D1426 PolarHBondContact NH2-OD1 3.15Å; R1307-D1426 IonicContact NH2-OD2 3.11Å; R1307-D1426 PolarHBondContact NH2-OD2 3.17Å; R1307-L1532 HydrophobicContact CG-CD1 4.41Å; R1307-L1532 HydrophobicContact CG-CD2 4.46Å; R1307-A1533 PolarHBondContact NH1-O 3.08Å; R1307-A1533 PolarHBondContact NH2-O 2.92Å; R1307-D1534 IonicContact NH2-OD1 3.05Å
1308	T	84.7	Confident	82.5	Confident	69.2 Å²	69.2	72.3 Å²	72.3	43%	0.425	35%	0.352	S	S	.	.	H	α-helix	trans	-50.3	-40.9	-172.4	-26.5	0	0	0	0	114.4	I1304 Q1305 H1310 L1311	I1304-T1308 HydrophobicContact CG2-CG2 4.19Å; I1304-T1308 PolarHBondContact O-N 3.07Å; I1304-T1308 PolarHBondContact O-OG1 2.87Å; I1304-T1308 VanDerWaalsContact O-OG1 3.11Å; Q1305-T1308 VanDerWaalsContact C-OG1 3.31Å; Q1305-T1308 WeakPolarHBondContact CA-OG1 3.31Å; Q1305-T1308 PolarHBondContact O-N 2.76Å; Q1305-T1308 PolarHBondContact O-OG1 3.09Å; Q1305-T1308 VanDerWaalsContact O-OG1 3.08Å; T1308-H1310 VanDerWaalsContact C-N 3.29Å; T1308-H1310 PolarHBondContact O-N 3Å; T1308-L1311 PolarHBondContact O-N 2.82Å
1309	E	80.6	Confident	82.2	Confident	115.6 Å²	115.6	69.8 Å²	69.8	54%	0.54	35%	0.351	S	S	.	.	H	α-helix	trans	-64.7	-39	176.3	-66.4	162.3	167.7	0	0	112.2	R1307 K1312 K1530	R1307-E1309 VanDerWaalsContact C-N 3.28Å; R1307-E1309 PolarHBondContact O-N 3.14Å; R1307-E1309 VanDerWaalsContact O-N 3.12Å; E1309-K1312 WeakPolarHBondContact O-CB 3.27Å; E1309-K1312 PolarHBondContact O-N 2.85Å; E1309-K1530 IonicContact OE2-NZ 3.26Å; E1309-K1530 PolarHBondContact OE2-NZ 3.12Å
1310	H	84.1	Confident	82.2	Confident	4.6 Å²	4.6	68.4 Å²	68.4	2%	0.021	35%	0.345	C	S	.	.	H	α-helix	trans	-80.8	-25.4	-175.7	-62.4	29.7	0	0	0	112.6	R1307 T1308 K1312 M1313 G1314 L1315 K1530 L1532 T1573	R1307-H1310 WeakPolarHBondContact O-CA 3.34Å; R1307-H1310 WeakPolarHBondContact O-CB 3.39Å; R1307-H1310 PolarHBondContact O-N 3.23Å; T1308-H1310 VanDerWaalsContact C-N 3.29Å; T1308-H1310 PolarHBondContact O-N 3Å; H1310-K1312 VanDerWaalsContact C-N 3.26Å; H1310-K1312 PolarHBondContact O-N 3.16Å; H1310-M1313 PolarHBondContact ND1-SD 3.42Å; H1310-M1313 CarbonylContact O-C 3.57Å; H1310-M1313 WeakPolarHBondContact O-CA 3.34Å; H1310-M1313 WeakPolarHBondContact O-CB 3.38Å; H1310-M1313 PolarHBondContact O-N 2.91Å; H1310-G1314 PolarHBondContact O-N 2.82Å; H1310-L1315 HydrophobicContact CB-CB 4.21Å; H1310-L1315 HydrophobicContact CB-CD1 3.7Å; H1310-L1315 HydrophobicContact CB-CD2 3.92Å; H1310-L1315 HydrophobicContact CB-CG 4.43Å; H1310-L1315 VanDerWaalsContact O-CB 3.27Å; H1310-L1315 WeakPolarHBondContact O-CB 3.36Å; H1310-L1315 PolarHBondContact O-N 3.28Å; H1310-L1315 VanDerWaalsContact O-N 3.09Å; H1310-K1530 PolarHBondContact NE2-NZ 2.82Å; H1310-L1532 HydrophobicContact CB-CD1 3.94Å; H1310-L1532 WeakPolarHBondContact CD2-CD1 3.2Å; H1310-L1532 VanDerWaalsContact CG-CD1 3.47Å; H1310-T1573 VanDerWaalsContact CE1-CG2 3.4Å; H1310-T1573 WeakPolarHBondContact CE1-CG2 3.38Å; H1310-T1573 PolarHBondContact CE1-OG1 3.45Å; H1310-T1573 WeakPolarHBondContact NE2-CG2 3.39Å; H1310-T1573 PolarHBondContact NE2-OG1 3.13Å; H1310-T1573 VanDerWaalsContact NE2-OG1 3.12Å
1311	L	80.1	Confident	82.5	Confident	50.8 Å²	50.8	65.7 Å²	65.7	27%	0.266	34%	0.337	S	S	.	.	H	α-helix	trans	-61.6	-32.1	171.1	-64.2	174.4	0	0	0	111.6	I1304 R1307 T1308 M1313 G1314 L1315 R1318	I1304-L1311 HydrophobicContact CD1-CD1 3.87Å; I1304-L1311 HydrophobicContact CG1-CD1 3.85Å; I1304-L1311 HydrophobicContact CG2-CD1 4.05Å; R1307-L1311 HydrophobicContact CB-CG 4.4Å; R1307-L1311 WeakPolarHBondContact O-CG 3.32Å; R1307-L1311 PolarHBondContact O-N 2.73Å; R1307-L1311 VanDerWaalsContact O-N 3.1Å; T1308-L1311 PolarHBondContact O-N 2.82Å; L1311-M1313 VanDerWaalsContact C-N 3.34Å; L1311-M1313 PolarHBondContact O-N 3Å; L1311-G1314 PolarHBondContact O-N 2.96Å; L1311-L1315 HydrophobicContact CD2-CB 4.16Å; L1311-L1315 HydrophobicContact CD2-CD2 4Å; L1311-L1315 HydrophobicContact CD2-CG 4.36Å; L1311-L1315 WeakPolarHBondContact CD2-O 3.37Å; L1311-R1318 HydrophobicContact CD2-CG 4.36Å
1312	K	78.6	Confident	82.9	Confident	187.2 Å²	187.2	64.4 Å²	64.4	81%	0.814	33%	0.328	S	S	*	.	H	α-helix	trans	-70.7	-19.5	172	-61.3	-178.2	179.5	-177	0	113.1	E1309 H1310 G1314	E1309-K1312 WeakPolarHBondContact O-CB 3.27Å; E1309-K1312 PolarHBondContact O-N 2.85Å; H1310-K1312 VanDerWaalsContact C-N 3.26Å; H1310-K1312 PolarHBondContact O-N 3.16Å; K1312-G1314 VanDerWaalsContact C-N 3.33Å
1313	M	75	Confident	83.5	Confident	107.6 Å²	107.6	60.3 Å²	60.3	53%	0.53	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	11.7	178.3	-58.8	178.3	-179	0	0	112.9	H1310 L1311 W1599	H1310-M1313 PolarHBondContact ND1-SD 3.42Å; H1310-M1313 CarbonylContact O-C 3.57Å; H1310-M1313 WeakPolarHBondContact O-CA 3.34Å; H1310-M1313 WeakPolarHBondContact O-CB 3.38Å; H1310-M1313 PolarHBondContact O-N 2.91Å; L1311-M1313 VanDerWaalsContact C-N 3.34Å; L1311-M1313 PolarHBondContact O-N 3Å; M1313-W1599 HydrophobicContact CE-CG 4.24Å
1314	G	77.9	Confident	84.2	Confident	57.8 Å²	57.8	59.8 Å²	59.8	60%	0.596	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.4	13.9	175	0	0	0	0	0	116	H1310 L1311 K1312 L1316	H1310-G1314 PolarHBondContact O-N 2.82Å; L1311-G1314 PolarHBondContact O-N 2.96Å; K1312-G1314 VanDerWaalsContact C-N 3.33Å; G1314-L1316 PolarHBondContact O-N 3.2Å
1315	L	83.6	Confident	84.8	Confident	13.4 Å²	13.4	58.1 Å²	58.1	7%	0.07	29%	0.294	C	S	.	.			trans	-63.6	127.7	171.9	-175.1	91.9	0	0	0	110.6	R1307 H1310 L1311 T1317 L1532 D1534 I1571	R1307-L1315 HydrophobicContact CB-CD2 4.11Å; R1307-L1315 HydrophobicContact CG-CD2 4.29Å; R1307-L1315 VanDerWaalsContact NH2-CD2 3.28Å; H1310-L1315 HydrophobicContact CB-CB 4.21Å; H1310-L1315 HydrophobicContact CB-CD1 3.7Å; H1310-L1315 HydrophobicContact CB-CD2 3.92Å; H1310-L1315 HydrophobicContact CB-CG 4.43Å; H1310-L1315 VanDerWaalsContact O-CB 3.27Å; H1310-L1315 WeakPolarHBondContact O-CB 3.36Å; H1310-L1315 PolarHBondContact O-N 3.28Å; H1310-L1315 VanDerWaalsContact O-N 3.09Å; L1311-L1315 HydrophobicContact CD2-CB 4.16Å; L1311-L1315 HydrophobicContact CD2-CD2 4Å; L1311-L1315 HydrophobicContact CD2-CG 4.36Å; L1311-L1315 WeakPolarHBondContact CD2-O 3.37Å; L1315-T1317 WeakPolarHBondContact CD2-O 3.32Å; L1315-L1532 HydrophobicContact CD1-CB 4.44Å; L1315-L1532 HydrophobicContact CD2-CD1 4.22Å; L1315-D1534 HydrophobicContact CD1-CB 3.64Å; L1315-D1534 VanDerWaalsContact CD1-CG 3.42Å; L1315-D1534 VanDerWaalsContact CD1-OD1 3.28Å; L1315-D1534 WeakPolarHBondContact CD1-OD1 3.19Å; L1315-D1534 WeakPolarHBondContact CG-OD1 3.33Å; L1315-I1571 HydrophobicContact CD1-CD1 3.5Å; L1315-I1571 VanDerWaalsContact CD1-CD1 3.43Å
1316	L	83.6	Confident	85.5	Confident	107.8 Å²	107.8	54.9 Å²	54.9	56%	0.564	28%	0.276	S	S	*	.			trans	-78.8	-49.2	-175	-63	178	0	0	0	112.3	G1314 R1318 D1534	G1314-L1316 PolarHBondContact O-N 3.2Å; L1316-R1318 PolarHBondContact O-N 3.02Å; L1316-R1318 VanDerWaalsContact O-N 3.13Å; L1316-D1534 PolarHBondContact N-OD1 3.13Å; L1316-D1534 VanDerWaalsContact N-OD1 3.12Å
1317	T	84.4	Confident	86.2	Confident	5.4 Å²	5.4	54.4 Å²	54.4	3%	0.033	27%	0.274	C	S	.	.			trans	-74.2	110.7	-174.2	-57.5	0	0	0	0	110.3	R1307 L1315 A1319 N1320 I1423 D1534 E1535	R1307-T1317 VanDerWaalsContact CZ-O 3.26Å; R1307-T1317 PolarHBondContact NE-O 3.13Å; R1307-T1317 VanDerWaalsContact NH1-CB 3.32Å; R1307-T1317 VanDerWaalsContact NH1-CG2 3.3Å; R1307-T1317 PolarHBondContact NH1-O 3.07Å; R1307-T1317 VanDerWaalsContact NH2-CB 3.31Å; R1307-T1317 PolarHBondContact NH2-O 3.36Å; L1315-T1317 WeakPolarHBondContact CD2-O 3.32Å; T1317-A1319 WeakPolarHBondContact CG2-O 3.38Å; T1317-A1319 PolarHBondContact O-N 3.3Å; T1317-N1320 HydrophobicContact CG2-CB 4.45Å; T1317-I1423 HydrophobicContact CG2-CD1 3.69Å; T1317-D1534 WeakPolarHBondContact CB-OD1 3.23Å; T1317-D1534 PolarHBondContact N-OD1 3.01Å; T1317-D1534 PolarHBondContact OG1-OD1 3.06Å; T1317-E1535 WeakPolarHBondContact CA-OE1 3.04Å; T1317-E1535 VanDerWaalsContact CB-OE1 3.25Å; T1317-E1535 WeakPolarHBondContact CB-OE1 3.23Å; T1317-E1535 VanDerWaalsContact OG1-CD 3.29Å; T1317-E1535 VanDerWaalsContact OG1-CG 3.28Å; T1317-E1535 WeakPolarHBondContact OG1-CG 3.43Å; T1317-E1535 PolarHBondContact OG1-N 2.87Å; T1317-E1535 VanDerWaalsContact OG1-N 3.15Å; T1317-E1535 PolarHBondContact OG1-OE1 2.96Å
1318	R	84.4	Confident	86.7	Confident	173 Å²	173	56.1 Å²	56.1	65%	0.653	28%	0.283	S	S	*	.			trans	-68.7	-41.3	-174.4	-66.2	-176	-180	179.9	1.1	114.4	N1252 I1304 L1311 L1316	N1252-R1318 PolarHBondContact O-NH1 2.61Å; I1304-R1318 HydrophobicContact CD1-CB 4.4Å; I1304-R1318 WeakPolarHBondContact CG1-O 3.44Å; L1311-R1318 HydrophobicContact CD2-CG 4.36Å; L1316-R1318 PolarHBondContact O-N 3.02Å; L1316-R1318 VanDerWaalsContact O-N 3.13Å
1319	A	85.4	Confident	87.2	Confident	39 Å²	39	54.1 Å²	54.1	32%	0.322	27%	0.27	S	S	.	.			trans	-136.6	143.2	-178.4	0	0	0	0	0	110.8	E1302 I1304 T1317	E1302-A1319 HydrophobicContact CB-CB 4.36Å; I1304-A1319 HydrophobicContact CG1-CB 3.94Å; T1317-A1319 WeakPolarHBondContact CG2-O 3.38Å; T1317-A1319 PolarHBondContact O-N 3.3Å
1320	N	89	Confident	88	Confident	5.4 Å²	5.4	49.6 Å²	49.6	3%	0.029	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	147.7	178.5	-165.5	30.3	0	0	0	108.9	N1303 R1307 T1317 I1423 K1424 D1426	N1303-N1320 PolarHBondContact N-O 3.04Å; R1307-N1320 PolarHBondContact NH2-ND2 2.96Å; R1307-N1320 VanDerWaalsContact NH2-ND2 3.16Å; T1317-N1320 HydrophobicContact CG2-CB 4.45Å; N1320-I1423 WeakPolarHBondContact OD1-CG2 3.47Å; N1320-K1424 PolarHBondContact ND2-O 3.09Å; N1320-D1426 PolarHBondContact ND2-N 2.94Å; N1320-D1426 PolarHBondContact ND2-OD1 3.1Å
1321	P	88.8	Confident	88.6	Confident	17.2 Å²	17.2	51.9 Å²	51.9	11%	0.112	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	147.5	171	14	-9.9	0	0	0	110.7	R1300 E1302 Q1425 D1426	R1300-P1321 WeakPolarHBondContact O-CB 3.4Å; E1302-P1321 HydrophobicContact CG-CB 4.41Å; E1302-P1321 VanDerWaalsContact CG-CD 3.43Å; E1302-P1321 HydrophobicContact CG-CG 3.97Å; P1321-Q1425 HydrophobicContact CB-CG 4.03Å; P1321-Q1425 HydrophobicContact CG-CB 4.4Å; P1321-Q1425 HydrophobicContact CG-CG 3.81Å; P1321-Q1425 CarbonylContact O-C 3.54Å; P1321-Q1425 VanDerWaalsContact O-CA 3.3Å; P1321-Q1425 WeakPolarHBondContact O-CA 3.39Å; P1321-Q1425 WeakPolarHBondContact O-CB 3.2Å; P1321-D1426 PolarHBondContact O-N 2.95Å
1322	S	90.5	Very high	89.3	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	152.3	-177.2	69.5	0	0	0	0	112.9	Q1299 R1300 D1426	Q1299-S1322 CarbonylContact C-O 3.56Å; Q1299-S1322 WeakPolarHBondContact CA-O 3.23Å; R1300-S1322 WeakPolarHBondContact CB-OG 3.47Å; R1300-S1322 PolarHBondContact N-O 3.21Å; R1300-S1322 PolarHBondContact O-N 3.14Å; S1322-D1426 WeakPolarHBondContact CA-O 3.38Å
1323	W	92.1	Very high	90.1	Very high	40.8 Å²	40.8	42 Å²	42	16%	0.155	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	124.1	163.8	-76.4	79.8	0	0	0	109.7	L1273 I1297 R1298 Q1299 F1325 D1426 I1428	L1273-W1323 HydrophobicContact CD1-CH2 4.38Å; L1273-W1323 HydrophobicContact CD2-CH2 3.79Å; L1273-W1323 HydrophobicContact CD2-CZ3 3.9Å; I1297-W1323 HydrophobicContact CG2-CE3 3.8Å; I1297-W1323 HydrophobicContact CG2-CZ3 3.79Å; R1298-W1323 CarbonylContact O-C 3.52Å; R1298-W1323 WeakPolarHBondContact O-CA 3.34Å; Q1299-W1323 HydrophobicContact CB-CD2 4.18Å; Q1299-W1323 HydrophobicContact CB-CE3 4.2Å; Q1299-W1323 HydrophobicContact CB-CH2 4.01Å; Q1299-W1323 HydrophobicContact CB-CZ2 3.95Å; Q1299-W1323 HydrophobicContact CB-CZ3 4.12Å; Q1299-W1323 HydrophobicContact CG-CD2 4.3Å; Q1299-W1323 HydrophobicContact CG-CH2 4.46Å; Q1299-W1323 HydrophobicContact CG-CZ2 3.9Å; W1323-F1325 HydrophobicContact CB-CD2 4.4Å; W1323-F1325 HydrophobicContact CB-CE2 3.73Å; W1323-F1325 HydrophobicContact CB-CZ 4.27Å; W1323-F1325 HydrophobicContact CE3-CZ 4.44Å; W1323-D1426 PolarHBondContact N-O 2.86Å; W1323-I1428 PolarHBondContact O-N 3.26Å
1324	E	93.3	Very high	91	Very high	24.6 Å²	24.6	38.3 Å²	38.3	12%	0.115	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	129.5	175.7	-57.1	-178.2	155.7	0	0	109.9	I1297 R1298 R1300 Y1326 I1428	I1297-E1324 CarbonylContact C-O 3.52Å; I1297-E1324 WeakPolarHBondContact CA-O 3.29Å; R1298-E1324 HydrophobicContact CB-CB 4.33Å; R1298-E1324 WeakPolarHBondContact CD-OE2 3.36Å; R1298-E1324 IonicContact CZ-OE2 3.62Å; R1298-E1324 PolarHBondContact N-O 3.19Å; R1298-E1324 IonicContact NE-OE2 3.58Å; R1298-E1324 IonicContact NH1-OE2 2.68Å; R1298-E1324 PolarHBondContact O-N 3.2Å; R1300-E1324 VanDerWaalsContact CD-OE1 3.23Å; R1300-E1324 WeakPolarHBondContact CD-OE1 3.36Å; R1300-E1324 HydrophobicContact CG-CG 4.28Å; R1300-E1324 WeakPolarHBondContact CG-OE1 3.11Å; R1300-E1324 VanDerWaalsContact CZ-CD 3.46Å; R1300-E1324 IonicContact CZ-OE1 3.22Å; R1300-E1324 IonicContact CZ-OE2 3.48Å; R1300-E1324 VanDerWaalsContact CZ-OE2 3.27Å; R1300-E1324 IonicContact NE-OE1 3.28Å; R1300-E1324 PolarHBondContact NE-OE1 3.14Å; R1300-E1324 IonicContact NE-OE2 3.34Å; R1300-E1324 PolarHBondContact NE-OE2 3.05Å; R1300-E1324 IonicContact NH1-OE1 3.36Å; R1300-E1324 PolarHBondContact NH1-OE1 2.84Å; R1300-E1324 VanDerWaalsContact NH2-CD 3.3Å; R1300-E1324 IonicContact NH2-OE1 3.68Å; R1300-E1324 PolarHBondContact NH2-OE1 3.38Å; R1300-E1324 VanDerWaalsContact NH2-OE1 3.13Å; R1300-E1324 IonicContact NH2-OE2 3.51Å; R1300-E1324 PolarHBondContact NH2-OE2 2.95Å; E1324-Y1326 HydrophobicContact CB-CD2 4.23Å; E1324-Y1326 HydrophobicContact CB-CE2 3.49Å; E1324-Y1326 VanDerWaalsContact CB-CE2 3.49Å; E1324-Y1326 HydrophobicContact CG-CE2 4.37Å; E1324-Y1326 VanDerWaalsContact OE2-CE2 3.28Å; E1324-Y1326 WeakPolarHBondContact OE2-CE2 3.41Å; E1324-Y1326 PolarHBondContact OE2-OH 2.97Å; E1324-I1428 CarbonylContact C-O 3.45Å; E1324-I1428 VanDerWaalsContact CA-O 3.27Å; E1324-I1428 WeakPolarHBondContact CA-O 3.32Å; E1324-I1428 HydrophobicContact CB-CB 4.45Å; E1324-I1428 HydrophobicContact CG-CB 4.16Å; E1324-I1428 HydrophobicContact CG-CD1 4.19Å
1325	F	94.7	Very high	91.7	Very high	45.6 Å²	45.6	36.6 Å²	36.6	20%	0.2	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	122.6	171.3	-58.2	-96.6	0	0	0	107.5	K1296 I1297 W1323 M1327 I1428 I1429 H1430	K1296-F1325 CarbonylContact O-C 3.54Å; K1296-F1325 WeakPolarHBondContact O-CA 3.39Å; I1297-F1325 HydrophobicContact CB-CD1 4.41Å; I1297-F1325 HydrophobicContact CB-CE1 4.48Å; I1297-F1325 HydrophobicContact CD1-CD1 4.19Å; I1297-F1325 HydrophobicContact CD1-CE1 4.15Å; I1297-F1325 HydrophobicContact CG1-CD1 3.87Å; I1297-F1325 HydrophobicContact CG1-CE1 4.19Å; I1297-F1325 HydrophobicContact CG1-CG 4.5Å; I1297-F1325 HydrophobicContact CG2-CD1 4Å; I1297-F1325 HydrophobicContact CG2-CE1 3.73Å; I1297-F1325 HydrophobicContact CG2-CG 4.45Å; I1297-F1325 HydrophobicContact CG2-CZ 4.36Å; W1323-F1325 HydrophobicContact CB-CD2 4.4Å; W1323-F1325 HydrophobicContact CB-CE2 3.73Å; W1323-F1325 HydrophobicContact CB-CZ 4.27Å; W1323-F1325 HydrophobicContact CE3-CZ 4.44Å; F1325-M1327 HydrophobicContact CB-CE 4.2Å; F1325-I1428 PolarHBondContact N-O 3.12Å; F1325-I1429 HydrophobicContact CB-CG1 4.39Å; F1325-I1429 HydrophobicContact CB-CG2 4.45Å; F1325-I1429 HydrophobicContact CD2-CG1 4.11Å; F1325-I1429 CarbonylContact O-C 3.49Å; F1325-I1429 WeakPolarHBondContact O-CA 3.39Å; F1325-H1430 PolarHBondContact O-N 2.96Å
1326	Y	96.1	Very high	92	Very high	68.6 Å²	68.6	38.9 Å²	38.9	27%	0.269	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	135.9	174.4	-172.7	-81.1	0	0	0	108.6	L1295 K1296 E1324 D1328 H1430 K1432	L1295-Y1326 CarbonylContact C-O 3.56Å; L1295-Y1326 WeakPolarHBondContact CA-O 3.34Å; K1296-Y1326 HydrophobicContact CB-CD1 4.44Å; K1296-Y1326 HydrophobicContact CD-CD1 3.92Å; K1296-Y1326 HydrophobicContact CD-CE1 4.46Å; K1296-Y1326 HydrophobicContact CG-CD1 4.28Å; K1296-Y1326 PolarHBondContact N-O 2.96Å; K1296-Y1326 PolarHBondContact O-N 3.08Å; E1324-Y1326 HydrophobicContact CB-CD2 4.23Å; E1324-Y1326 HydrophobicContact CB-CE2 3.49Å; E1324-Y1326 VanDerWaalsContact CB-CE2 3.49Å; E1324-Y1326 HydrophobicContact CG-CE2 4.37Å; E1324-Y1326 VanDerWaalsContact OE2-CE2 3.28Å; E1324-Y1326 WeakPolarHBondContact OE2-CE2 3.41Å; E1324-Y1326 PolarHBondContact OE2-OH 2.97Å; Y1326-D1328 VanDerWaalsContact CE1-OD1 3.3Å; Y1326-D1328 WeakPolarHBondContact CE1-OD1 3.4Å; Y1326-D1328 PolarHBondContact OH-OD1 3.12Å; Y1326-H1430 CarbonylContact C-O 3.53Å; Y1326-H1430 VanDerWaalsContact CA-O 3.29Å; Y1326-H1430 WeakPolarHBondContact CA-O 3.4Å; Y1326-H1430 HydrophobicContact CD1-CB 3.4Å; Y1326-H1430 VanDerWaalsContact CD1-CB 3.4Å; Y1326-H1430 AromaticContact CD1-CG 3.7Å; Y1326-H1430 AromaticContact CD1-ND1 3.82Å; Y1326-H1430 HydrophobicContact CD2-CB 3.9Å; Y1326-H1430 HydrophobicContact CE1-CB 3.76Å; Y1326-H1430 AromaticContact CE1-CE1 3.76Å; Y1326-H1430 AromaticContact CE1-CG 3.46Å; Y1326-H1430 VanDerWaalsContact CE1-CG 3.46Å; Y1326-H1430 AromaticContact CE1-ND1 3.23Å; Y1326-H1430 WeakPolarHBondContact CE1-ND1 3.12Å; Y1326-H1430 HydrophobicContact CG-CB 4.26Å; Y1326-H1430 AromaticContact CZ-ND1 3.75Å; Y1326-K1432 VanDerWaalsContact OH-CE 3.24Å; Y1326-K1432 WeakPolarHBondContact OH-CE 3.44Å; Y1326-K1432 PolarHBondContact OH-NZ 3.2Å; Y1326-K1432 VanDerWaalsContact OH-NZ 3.15Å
1327	M	95.8	Very high	92.2	Very high	8.6 Å²	8.6	42.2 Å²	42.2	4%	0.042	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	151.7	170.7	64.3	-149.2	77	0	0	110.8	F1292 L1295 F1325 L1330 I1429 H1430 I1431 K1432	F1292-M1327 HydrophobicContact CD1-SD 3.96Å; F1292-M1327 HydrophobicContact CE1-SD 4.31Å; L1295-M1327 HydrophobicContact CB-CB 4.49Å; L1295-M1327 HydrophobicContact CD1-CB 4.31Å; L1295-M1327 HydrophobicContact CD1-CE 3.88Å; L1295-M1327 HydrophobicContact CD1-SD 4.33Å; F1325-M1327 HydrophobicContact CB-CE 4.2Å; M1327-L1330 HydrophobicContact CG-CB 4.39Å; M1327-L1330 HydrophobicContact SD-CB 3.83Å; M1327-L1330 HydrophobicContact SD-CD2 4.24Å; M1327-L1330 HydrophobicContact SD-CG 4.42Å; M1327-I1429 HydrophobicContact CE-CG2 4.32Å; M1327-H1430 PolarHBondContact N-O 3.09Å; M1327-I1431 HydrophobicContact CE-CD1 4.31Å; M1327-I1431 HydrophobicContact CE-CG1 4.17Å; M1327-I1431 HydrophobicContact CG-CB 4.18Å; M1327-I1431 HydrophobicContact CG-CD1 4.42Å; M1327-I1431 HydrophobicContact CG-CG1 3.92Å; M1327-I1431 HydrophobicContact CG-CG2 3.78Å; M1327-I1431 WeakPolarHBondContact O-CA 3.36Å; M1327-I1431 HydrophobicContact SD-CD1 3.97Å; M1327-I1431 HydrophobicContact SD-CG1 4.03Å; M1327-I1431 HydrophobicContact SD-CG2 4.43Å; M1327-K1432 PolarHBondContact O-N 3.18Å; M1327-K1432 VanDerWaalsContact O-N 3.07Å
1328	D	96.9	Very high	92.4	Very high	35 Å²	35	43.4 Å²	43.4	19%	0.187	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	-41.8	178.4	-72	-23.2	0	0	0	111.1	Q1293 N1294 Y1326 K1432 K1433	Q1293-D1328 PolarHBondContact O-N 3.08Å; N1294-D1328 HydrophobicContact CB-CB 4.17Å; N1294-D1328 VanDerWaalsContact CB-OD2 3.28Å; N1294-D1328 WeakPolarHBondContact CB-OD2 3.3Å; N1294-D1328 PolarHBondContact ND2-OD2 3.25Å; Y1326-D1328 VanDerWaalsContact CE1-OD1 3.3Å; Y1326-D1328 WeakPolarHBondContact CE1-OD1 3.4Å; Y1326-D1328 PolarHBondContact OH-OD1 3.12Å; D1328-K1432 HydrophobicContact CB-CD 4.35Å; D1328-K1432 WeakPolarHBondContact O-CB 3.35Å; D1328-K1432 VanDerWaalsContact OD1-CD 3.26Å; D1328-K1432 WeakPolarHBondContact OD1-CD 3.24Å; D1328-K1432 VanDerWaalsContact OD1-CE 3.27Å; D1328-K1432 WeakPolarHBondContact OD1-CE 3.32Å; D1328-K1432 IonicContact OD1-NZ 3.39Å; D1328-K1432 PolarHBondContact OD1-NZ 2.98Å; D1328-K1432 IonicContact OD2-NZ 3.24Å; D1328-K1433 PolarHBondContact O-N 3.33Å
1329	L	96.9	Very high	92.7	Very high	28 Å²	28	39.2 Å²	39.2	15%	0.147	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	132.5	173.6	-178.7	67	0	0	0	110	F1292 Q1293 K1433 I1435	F1292-L1329 WeakPolarHBondContact CA-O 3.31Å; Q1293-L1329 HydrophobicContact CB-CB 3.94Å; Q1293-L1329 HydrophobicContact CG-CB 4.01Å; Q1293-L1329 HydrophobicContact CG-CD2 4.24Å; Q1293-L1329 PolarHBondContact N-O 3.04Å; Q1293-L1329 PolarHBondContact O-N 2.97Å; L1329-K1433 CarbonylContact C-O 3.5Å; L1329-K1433 WeakPolarHBondContact CA-O 3.45Å; L1329-K1433 HydrophobicContact CD1-CB 3.95Å; L1329-K1433 HydrophobicContact CD1-CD 4.27Å; L1329-K1433 HydrophobicContact CD1-CG 4.09Å; L1329-I1435 HydrophobicContact CD1-CD1 3.98Å; L1329-I1435 HydrophobicContact CD1-CG1 4.25Å
1330	L	96.8	Very high	93	Very high	20.4 Å²	20.4	38.9 Å²	38.9	11%	0.107	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	111.1	157.1	173.7	54.4	0	0	0	107.9	V1291 F1292 M1327 V1332 I1431 K1433 F1434 I1435	V1291-L1330 WeakPolarHBondContact O-CA 3.45Å; F1292-L1330 HydrophobicContact CD1-CD1 3.81Å; F1292-L1330 HydrophobicContact CD2-CD1 4.43Å; F1292-L1330 HydrophobicContact CE1-CB 4.44Å; F1292-L1330 HydrophobicContact CE1-CD1 3.47Å; F1292-L1330 VanDerWaalsContact CE1-CD1 3.43Å; F1292-L1330 HydrophobicContact CE1-CD2 4.26Å; F1292-L1330 HydrophobicContact CE1-CG 4.19Å; F1292-L1330 HydrophobicContact CE2-CD1 4.2Å; F1292-L1330 HydrophobicContact CG-CD1 4.31Å; F1292-L1330 HydrophobicContact CZ-CD1 3.68Å; F1292-L1330 HydrophobicContact CZ-CD2 4.32Å; F1292-L1330 HydrophobicContact CZ-CG 4.41Å; M1327-L1330 HydrophobicContact CG-CB 4.39Å; M1327-L1330 HydrophobicContact SD-CB 3.83Å; M1327-L1330 HydrophobicContact SD-CD2 4.24Å; M1327-L1330 HydrophobicContact SD-CG 4.42Å; L1330-V1332 HydrophobicContact CD1-CG2 4.07Å; L1330-V1332 HydrophobicContact CG-CG2 4.26Å; L1330-I1431 HydrophobicContact CB-CD1 4.44Å; L1330-I1431 HydrophobicContact CB-CG2 4.13Å; L1330-I1431 HydrophobicContact CD2-CD1 4.02Å; L1330-K1433 PolarHBondContact N-O 3.26Å; L1330-F1434 HydrophobicContact CB-CD2 3.91Å; L1330-F1434 HydrophobicContact CD2-CD2 3.68Å; L1330-F1434 HydrophobicContact CD2-CE2 3.65Å; L1330-F1434 HydrophobicContact CD2-CZ 4.47Å; L1330-F1434 HydrophobicContact CG-CD2 3.65Å; L1330-F1434 HydrophobicContact CG-CE2 3.83Å; L1330-F1434 CarbonylContact O-C 3.58Å; L1330-F1434 WeakPolarHBondContact O-CA 3.27Å; L1330-I1435 PolarHBondContact O-N 3.11Å
1331	Y	96.5	Very high	93	Very high	53.2 Å²	53.2	41.6 Å²	41.6	21%	0.209	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	122.4	178	176	-94.4	0	0	0	109	A1290 V1291 T1333 I1435 E1437	A1290-Y1331 CarbonylContact C-O 3.54Å; A1290-Y1331 VanDerWaalsContact CA-O 3.27Å; A1290-Y1331 WeakPolarHBondContact CA-O 3.34Å; V1291-Y1331 HydrophobicContact CB-CD1 4.34Å; V1291-Y1331 HydrophobicContact CG2-CD1 4.24Å; V1291-Y1331 PolarHBondContact N-O 3.3Å; V1291-Y1331 PolarHBondContact O-N 3.11Å; Y1331-T1333 HydrophobicContact CD1-CG2 4.45Å; Y1331-T1333 HydrophobicContact CE1-CG2 3.83Å; Y1331-T1333 WeakPolarHBondContact CE1-OG1 3.4Å; Y1331-T1333 WeakPolarHBondContact OH-CB 3.22Å; Y1331-T1333 PolarHBondContact OH-OG1 3.19Å; Y1331-I1435 WeakPolarHBondContact CA-O 3.37Å; Y1331-I1435 HydrophobicContact CD2-CB 3.8Å; Y1331-I1435 HydrophobicContact CD2-CD1 4.18Å; Y1331-I1435 HydrophobicContact CD2-CG1 4.41Å; Y1331-I1435 HydrophobicContact CD2-CG2 3.74Å; Y1331-I1435 HydrophobicContact CE2-CB 4.34Å; Y1331-I1435 HydrophobicContact CE2-CD1 4.36Å; Y1331-I1435 HydrophobicContact CE2-CG2 3.9Å; Y1331-E1437 HydrophobicContact CE2-CB 4.32Å; Y1331-E1437 WeakPolarHBondContact CE2-OE2 3.39Å; Y1331-E1437 VanDerWaalsContact CZ-OE2 3.28Å; Y1331-E1437 VanDerWaalsContact OH-CD 3.28Å; Y1331-E1437 PolarHBondContact OH-OE1 3.37Å; Y1331-E1437 PolarHBondContact OH-OE2 2.87Å
1332	V	95.7	Very high	93	Very high	20.6 Å²	20.6	43.6 Å²	43.6	13%	0.125	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	130.8	178.7	-179.1	0	0	0	0	108.2	I1289 A1290 L1330 F1334 F1434 I1435 I1436 E1437	I1289-V1332 CarbonylContact O-C 3.5Å; I1289-V1332 VanDerWaalsContact O-CA 3.25Å; I1289-V1332 WeakPolarHBondContact O-CA 3.38Å; I1289-V1332 WeakPolarHBondContact O-CG1 3.32Å; A1290-V1332 HydrophobicContact CB-CG2 4.3Å; L1330-V1332 HydrophobicContact CD1-CG2 4.07Å; L1330-V1332 HydrophobicContact CG-CG2 4.26Å; V1332-F1334 HydrophobicContact CG1-CD2 4.46Å; V1332-F1334 HydrophobicContact CG1-CE2 3.75Å; V1332-F1334 HydrophobicContact CG1-CZ 3.82Å; V1332-F1434 HydrophobicContact CG2-CE2 4.33Å; V1332-I1435 PolarHBondContact N-O 3.12Å; V1332-I1436 HydrophobicContact CB-CG1 4.3Å; V1332-I1436 HydrophobicContact CB-CG2 4.34Å; V1332-I1436 HydrophobicContact CG1-CG2 4.37Å; V1332-I1436 CarbonylContact O-C 3.55Å; V1332-I1436 VanDerWaalsContact O-CA 3.28Å; V1332-I1436 WeakPolarHBondContact O-CA 3.28Å; V1332-E1437 PolarHBondContact O-N 3.04Å
1333	T	94.6	Very high	92.9	Very high	11 Å²	11	43.7 Å²	43.7	7%	0.067	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	141.5	-177.7	-154.9	0	0	0	0	111.3	T1288 I1289 Y1331 E1437	T1288-T1333 VanDerWaalsContact O-CG2 3.26Å; T1288-T1333 WeakPolarHBondContact O-CG2 3.38Å; I1289-T1333 PolarHBondContact O-N 3.19Å; Y1331-T1333 HydrophobicContact CD1-CG2 4.45Å; Y1331-T1333 HydrophobicContact CE1-CG2 3.83Å; Y1331-T1333 WeakPolarHBondContact CE1-OG1 3.4Å; Y1331-T1333 WeakPolarHBondContact OH-CB 3.22Å; Y1331-T1333 PolarHBondContact OH-OG1 3.19Å; T1333-E1437 CarbonylContact C-O 3.51Å; T1333-E1437 VanDerWaalsContact CA-O 3.31Å; T1333-E1437 WeakPolarHBondContact CA-O 3.39Å; T1333-E1437 PolarHBondContact OG1-OE2 2.85Å
1334	F	94.4	Very high	92.7	Very high	29.4 Å²	29.4	46.4 Å²	46.4	13%	0.129	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	102.1	176.1	-64.2	-73.6	0	0	0	109.8	I1289 V1332 F1340 I1436 E1437 I1438 K1439 R1668 I1672	I1289-F1334 HydrophobicContact CG2-CD1 4.27Å; I1289-F1334 HydrophobicContact CG2-CE1 4.22Å; I1289-F1334 HydrophobicContact CG2-CZ 4.17Å; V1332-F1334 HydrophobicContact CG1-CD2 4.46Å; V1332-F1334 HydrophobicContact CG1-CE2 3.75Å; V1332-F1334 HydrophobicContact CG1-CZ 3.82Å; F1334-F1340 HydrophobicContact CD1-CB 4.25Å; F1334-F1340 HydrophobicContact CD1-CD1 4.29Å; F1334-F1340 HydrophobicContact CD1-CG 4.16Å; F1334-F1340 HydrophobicContact CE1-CB 4.3Å; F1334-F1340 AromaticContact CE1-CD1 3.68Å; F1334-F1340 HydrophobicContact CE1-CD1 3.8Å; F1334-F1340 HydrophobicContact CE1-CD2 4.2Å; F1334-F1340 AromaticContact CE1-CE1 3.91Å; F1334-F1340 HydrophobicContact CE1-CE1 4.12Å; F1334-F1340 HydrophobicContact CE1-CE2 4.48Å; F1334-F1340 AromaticContact CE1-CG 3.75Å; F1334-F1340 HydrophobicContact CE1-CG 3.88Å; F1334-F1340 HydrophobicContact CE1-CZ 4.34Å; F1334-F1340 HydrophobicContact CZ-CD1 4.45Å; F1334-I1436 HydrophobicContact CD2-CG2 4.32Å; F1334-I1436 HydrophobicContact CE2-CG2 3.9Å; F1334-E1437 PolarHBondContact N-O 3.02Å; F1334-I1438 HydrophobicContact CB-CG1 4.26Å; F1334-I1438 HydrophobicContact CD2-CG1 4.06Å; F1334-I1438 HydrophobicContact CG-CG1 4.46Å; F1334-K1439 PolarHBondContact O-N 3.02Å; F1334-R1668 PolarHBondContact O-NH2 2.84Å; F1334-R1668 VanDerWaalsContact O-NH2 3.16Å; F1334-I1672 HydrophobicContact CB-CD1 3.74Å; F1334-I1672 HydrophobicContact CB-CG1 4.21Å; F1334-I1672 HydrophobicContact CD1-CD1 4.25Å; F1334-I1672 HydrophobicContact CD1-CG1 4.09Å; F1334-I1672 HydrophobicContact CD1-CG2 4.27Å; F1334-I1672 HydrophobicContact CD2-CD1 3.86Å; F1334-I1672 HydrophobicContact CD2-CG1 4.44Å; F1334-I1672 HydrophobicContact CE1-CG1 4.48Å; F1334-I1672 HydrophobicContact CE1-CG2 3.93Å; F1334-I1672 HydrophobicContact CE2-CD1 4.35Å; F1334-I1672 HydrophobicContact CE2-CG2 4.29Å; F1334-I1672 HydrophobicContact CG-CD1 3.66Å; F1334-I1672 HydrophobicContact CG-CG1 4.01Å; F1334-I1672 HydrophobicContact CZ-CG2 3.93Å
1335	P	92.6	Very high	92.4	Very high	21.4 Å²	21.4	48.1 Å²	48.1	14%	0.139	21%	0.212	C	C	.	.			trans	-62.7	158.2	-178.7	-25.4	36	0	0	0	113.8	Q1287 I1289 R1337 Y1338 R1668	Q1287-P1335 HydrophobicContact CB-CG 4.22Å; Q1287-P1335 HydrophobicContact CG-CG 4.37Å; Q1287-P1335 VanDerWaalsContact OE1-CB 3.26Å; Q1287-P1335 VanDerWaalsContact OE1-CG 3.3Å; I1289-P1335 HydrophobicContact CD1-CG 4.45Å; P1335-R1337 PolarHBondContact O-N 3.28Å; P1335-Y1338 WeakPolarHBondContact O-CB 3.4Å; P1335-Y1338 PolarHBondContact O-N 2.96Å; P1335-R1668 PolarHBondContact O-NH2 3.25Å
1336	Y	90.3	Very high	92	Very high	61 Å²	61	47.3 Å²	47.3	24%	0.239	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	130.3	-179.2	-178.7	-121.3	0	0	0	112.2	Y1338 D1440 D1441 P1442 W1664 R1862	Y1336-Y1338 PolarHBondContact O-N 3.14Å; Y1336-Y1338 VanDerWaalsContact O-N 3.12Å; Y1336-D1440 VanDerWaalsContact CB-O 3.31Å; Y1336-D1440 WeakPolarHBondContact CB-O 3.27Å; Y1336-D1440 WeakPolarHBondContact CD2-O 3.1Å; Y1336-D1440 VanDerWaalsContact CG-O 3.26Å; Y1336-D1441 HydrophobicContact CD1-CB 4.44Å; Y1336-D1441 HydrophobicContact CD2-CB 4.37Å; Y1336-D1441 HydrophobicContact CE1-CB 4.02Å; Y1336-D1441 VanDerWaalsContact CE1-CG 3.43Å; Y1336-D1441 WeakPolarHBondContact CE1-OD2 3.44Å; Y1336-D1441 HydrophobicContact CE2-CB 3.85Å; Y1336-D1441 VanDerWaalsContact CZ-CG 3.42Å; Y1336-D1441 VanDerWaalsContact CZ-OD2 3.29Å; Y1336-D1441 VanDerWaalsContact OH-CG 3.31Å; Y1336-D1441 PolarHBondContact OH-OD2 3.1Å; Y1336-P1442 VanDerWaalsContact CD1-CD 3.43Å; Y1336-P1442 HydrophobicContact CD1-CG 4.41Å; Y1336-W1664 HydrophobicContact CD2-CZ2 4.46Å; Y1336-W1664 AromaticContact CE2-CH2 3.91Å; Y1336-W1664 HydrophobicContact CE2-CH2 4.05Å; Y1336-W1664 AromaticContact CE2-CZ2 3.76Å; Y1336-W1664 HydrophobicContact CE2-CZ2 3.76Å; Y1336-R1862 PolarHBondContact OH-NH1 3.41Å
1337	R	86.5	Confident	91.6	Very high	178.6 Å²	178.6	45.3 Å²	45.3	67%	0.674	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	56	12.1	-176.5	-61.7	-179	113.9	-178.8	3	116.2	P1335 I1339 R1668	P1335-R1337 PolarHBondContact O-N 3.28Å; R1337-I1339 WeakPolarHBondContact O-CG1 3.42Å; R1337-I1339 PolarHBondContact O-N 3.08Å; R1337-R1668 VanDerWaalsContact N-NH1 3.17Å; R1337-R1668 VanDerWaalsContact N-NH2 3.2Å
1338	Y	90	Very high	91.1	Very high	30.4 Å²	30.4	45.8 Å²	45.8	12%	0.119	21%	0.211	C	C	.	.			trans	-76.2	119.3	174.5	-175	-113.6	0	0	0	111.3	C1284 E1285 Q1287 I1289 P1335 Y1336 F1340 V1343	C1284-Y1338 HydrophobicContact CB-CE1 4.23Å; C1284-Y1338 VanDerWaalsContact CB-OH 3.25Å; C1284-Y1338 WeakPolarHBondContact CB-OH 3.38Å; C1284-Y1338 PolarHBondContact O-OH 3.13Å; C1284-Y1338 VanDerWaalsContact O-OH 3.12Å; E1285-Y1338 HydrophobicContact CB-CE2 4.34Å; E1285-Y1338 VanDerWaalsContact OE2-CE2 3.28Å; E1285-Y1338 WeakPolarHBondContact OE2-CE2 3.4Å; E1285-Y1338 PolarHBondContact OE2-OH 3.15Å; E1285-Y1338 VanDerWaalsContact OE2-OH 3.05Å; Q1287-Y1338 HydrophobicContact CB-CD1 4.41Å; Q1287-Y1338 HydrophobicContact CB-CD2 4.39Å; Q1287-Y1338 HydrophobicContact CB-CE1 4.35Å; Q1287-Y1338 HydrophobicContact CB-CE2 4.36Å; Q1287-Y1338 HydrophobicContact CB-CG 4.41Å; Q1287-Y1338 HydrophobicContact CG-CD1 4.44Å; Q1287-Y1338 HydrophobicContact CG-CD2 3.75Å; Q1287-Y1338 HydrophobicContact CG-CE2 3.97Å; Q1287-Y1338 HydrophobicContact CG-CG 4.06Å; Q1287-Y1338 VanDerWaalsContact OE1-CD2 3.29Å; Q1287-Y1338 VanDerWaalsContact OE1-CG 3.28Å; I1289-Y1338 HydrophobicContact CD1-CD1 3.87Å; I1289-Y1338 HydrophobicContact CD1-CE1 3.77Å; I1289-Y1338 HydrophobicContact CG1-CE1 4.41Å; P1335-Y1338 WeakPolarHBondContact O-CB 3.4Å; P1335-Y1338 PolarHBondContact O-N 2.96Å; Y1336-Y1338 PolarHBondContact O-N 3.14Å; Y1336-Y1338 VanDerWaalsContact O-N 3.12Å; Y1338-F1340 VanDerWaalsContact C-N 3.29Å; Y1338-F1340 HydrophobicContact CD1-CB 3.92Å; Y1338-F1340 HydrophobicContact CE1-CB 3.9Å; Y1338-F1340 AromaticContact CE1-CD2 3.91Å; Y1338-F1340 HydrophobicContact CE1-CD2 4.16Å; Y1338-F1340 HydrophobicContact CE1-CG 4.3Å; Y1338-F1340 PolarHBondContact O-N 3.18Å; Y1338-F1340 VanDerWaalsContact O-N 3.08Å; Y1338-V1343 WeakPolarHBondContact OH-CG2 3.33Å
1339	I	89.8	Confident	90.5	Very high	84 Å²	84	45.1 Å²	45.1	43%	0.431	21%	0.209	S	C	.	.			trans	-85.9	65.7	-176.4	-47.6	178.7	0	0	0	109.9	R1337 R1341 D1342	R1337-I1339 WeakPolarHBondContact O-CG1 3.42Å; R1337-I1339 PolarHBondContact O-N 3.08Å; I1339-R1341 HydrophobicContact CG2-CB 4.35Å; I1339-R1341 VanDerWaalsContact CG2-NH2 3.32Å; I1339-R1341 PolarHBondContact O-N 3.06Å; I1339-R1341 VanDerWaalsContact O-N 3.13Å; I1339-D1342 HydrophobicContact CG2-CB 4.49Å; I1339-D1342 WeakPolarHBondContact CG2-OD2 3.36Å; I1339-D1342 PolarHBondContact O-N 3.16Å
1340	F	91.2	Very high	90	Very high	33.8 Å²	33.8	44.5 Å²	44.5	15%	0.148	21%	0.206	C	C	.	.	H	α-helix	trans	-54.9	-29.2	-179.9	174.8	-99	0	0	0	113.1	I1289 F1334 Y1338 D1342 V1343 Y1344 D1671 I1672	I1289-F1340 HydrophobicContact CB-CD2 4.5Å; I1289-F1340 HydrophobicContact CB-CE2 4.23Å; I1289-F1340 HydrophobicContact CD1-CD2 4.29Å; I1289-F1340 HydrophobicContact CG1-CD2 4.23Å; I1289-F1340 HydrophobicContact CG1-CE2 4.31Å; I1289-F1340 HydrophobicContact CG2-CD2 4.16Å; I1289-F1340 HydrophobicContact CG2-CE2 3.88Å; I1289-F1340 HydrophobicContact CG2-CZ 4.36Å; F1334-F1340 HydrophobicContact CD1-CB 4.25Å; F1334-F1340 HydrophobicContact CD1-CD1 4.29Å; F1334-F1340 HydrophobicContact CD1-CG 4.16Å; F1334-F1340 HydrophobicContact CE1-CB 4.3Å; F1334-F1340 AromaticContact CE1-CD1 3.68Å; F1334-F1340 HydrophobicContact CE1-CD1 3.8Å; F1334-F1340 HydrophobicContact CE1-CD2 4.2Å; F1334-F1340 AromaticContact CE1-CE1 3.91Å; F1334-F1340 HydrophobicContact CE1-CE1 4.12Å; F1334-F1340 HydrophobicContact CE1-CE2 4.48Å; F1334-F1340 AromaticContact CE1-CG 3.75Å; F1334-F1340 HydrophobicContact CE1-CG 3.88Å; F1334-F1340 HydrophobicContact CE1-CZ 4.34Å; F1334-F1340 HydrophobicContact CZ-CD1 4.45Å; Y1338-F1340 VanDerWaalsContact C-N 3.29Å; Y1338-F1340 HydrophobicContact CD1-CB 3.92Å; Y1338-F1340 HydrophobicContact CE1-CB 3.9Å; Y1338-F1340 AromaticContact CE1-CD2 3.91Å; Y1338-F1340 HydrophobicContact CE1-CD2 4.16Å; Y1338-F1340 HydrophobicContact CE1-CG 4.3Å; Y1338-F1340 PolarHBondContact O-N 3.18Å; Y1338-F1340 VanDerWaalsContact O-N 3.08Å; F1340-D1342 VanDerWaalsContact C-N 3.28Å; F1340-D1342 PolarHBondContact O-N 2.98Å; F1340-V1343 WeakPolarHBondContact O-CB 3.3Å; F1340-V1343 PolarHBondContact O-N 3.14Å; F1340-Y1344 HydrophobicContact CE1-CD2 4.25Å; F1340-Y1344 HydrophobicContact CE1-CG 4.34Å; F1340-Y1344 HydrophobicContact CZ-CD2 4.44Å; F1340-Y1344 WeakPolarHBondContact O-CB 3.28Å; F1340-Y1344 PolarHBondContact O-N 3.28Å; F1340-D1671 PolarHBondContact N-O 3.14Å; F1340-I1672 HydrophobicContact CD1-CG2 4.23Å
1341	R	89	Confident	89.4	Confident	61.6 Å²	61.6	50.4 Å²	50.4	23%	0.232	23%	0.227	C	C	.	.	H	α-helix	trans	-49.9	-41.7	179.5	178	-175	103.5	-158.1	-7.8	114.2	I1339 V1343 Y1344 Q1345 D1670 D1671 I1672 K1673 P1674 L1675	I1339-R1341 HydrophobicContact CG2-CB 4.35Å; I1339-R1341 VanDerWaalsContact CG2-NH2 3.32Å; I1339-R1341 PolarHBondContact O-N 3.06Å; I1339-R1341 VanDerWaalsContact O-N 3.13Å; R1341-V1343 VanDerWaalsContact C-N 3.34Å; R1341-Y1344 WeakPolarHBondContact O-CB 3.28Å; R1341-Y1344 PolarHBondContact O-N 3.22Å; R1341-Q1345 HydrophobicContact CG-CG 4.34Å; R1341-Q1345 VanDerWaalsContact NE-NE2 3.16Å; R1341-Q1345 VanDerWaalsContact O-CB 3.29Å; R1341-Q1345 WeakPolarHBondContact O-CB 3.4Å; R1341-Q1345 WeakPolarHBondContact O-CG 3.44Å; R1341-Q1345 PolarHBondContact O-N 3.08Å; R1341-D1670 PolarHBondContact NH1-O 3.16Å; R1341-D1671 VanDerWaalsContact CB-O 3.25Å; R1341-D1671 WeakPolarHBondContact CB-O 3.38Å; R1341-D1671 PolarHBondContact N-O 3.12Å; R1341-I1672 WeakPolarHBondContact CA-O 3.39Å; R1341-I1672 WeakPolarHBondContact CB-O 3.15Å; R1341-K1673 WeakPolarHBondContact CD-O 3.34Å; R1341-K1673 WeakPolarHBondContact CG-O 3Å; R1341-P1674 HydrophobicContact CG-CB 4.46Å; R1341-P1674 HydrophobicContact CG-CG 4.31Å; R1341-L1675 VanDerWaalsContact CZ-CG 3.44Å; R1341-L1675 VanDerWaalsContact NH1-CD2 3.32Å; R1341-L1675 VanDerWaalsContact NH1-CG 3.34Å
1342	D	88.6	Confident	88.8	Confident	59.8 Å²	59.8	50.8 Å²	50.8	32%	0.32	23%	0.23	S	C	.	.	H	α-helix	trans	-74.5	-42.3	-171	-64.5	-14.2	0	0	0	110	I1339 F1340 Y1344 Q1345 E1346	I1339-D1342 HydrophobicContact CG2-CB 4.49Å; I1339-D1342 WeakPolarHBondContact CG2-OD2 3.36Å; I1339-D1342 PolarHBondContact O-N 3.16Å; F1340-D1342 VanDerWaalsContact C-N 3.28Å; F1340-D1342 PolarHBondContact O-N 2.98Å; D1342-Y1344 VanDerWaalsContact C-N 3.33Å; D1342-Y1344 PolarHBondContact O-N 3Å; D1342-Q1345 WeakPolarHBondContact O-CB 3.22Å; D1342-Q1345 PolarHBondContact O-N 3.17Å; D1342-Q1345 VanDerWaalsContact O-N 3.14Å; D1342-E1346 PolarHBondContact O-N 3.22Å; D1342-E1346 VanDerWaalsContact O-N 3.11Å
1343	V	89.3	Confident	88.2	Confident	1.2 Å²	1.2	50.8 Å²	50.8	1%	0.007	23%	0.228	C	C	.	.	H	α-helix	trans	-56.4	-47	168.2	-176.8	0	0	0	0	111.2	L1207 H1212 I1214 C1284 E1285 Y1338 F1340 R1341 Q1345 E1346 A1347	L1207-V1343 HydrophobicContact CD1-CG1 3.73Å; H1212-V1343 HydrophobicContact CB-CB 4.48Å; H1212-V1343 HydrophobicContact CB-CG1 4.44Å; H1212-V1343 HydrophobicContact CB-CG2 4.12Å; I1214-V1343 HydrophobicContact CD1-CG1 4.08Å; I1214-V1343 HydrophobicContact CG1-CG1 3.87Å; C1284-V1343 HydrophobicContact CB-CG1 4.2Å; E1285-V1343 WeakPolarHBondContact OE2-CG2 3.49Å; Y1338-V1343 WeakPolarHBondContact OH-CG2 3.33Å; F1340-V1343 WeakPolarHBondContact O-CB 3.3Å; F1340-V1343 PolarHBondContact O-N 3.14Å; R1341-V1343 VanDerWaalsContact C-N 3.34Å; V1343-Q1345 VanDerWaalsContact C-N 3.33Å; V1343-Q1345 PolarHBondContact O-N 2.96Å; V1343-E1346 PolarHBondContact O-N 3.21Å; V1343-A1347 VanDerWaalsContact O-CB 3.28Å; V1343-A1347 WeakPolarHBondContact O-CB 3.31Å; V1343-A1347 PolarHBondContact O-N 3.14Å
1344	Y	88.5	Confident	87.7	Confident	98.2 Å²	98.2	51.9 Å²	51.9	39%	0.385	23%	0.234	S	C	.	.	H	α-helix	trans	-60.5	-42.1	177.4	172.2	-91.3	0	0	0	112.4	F1340 R1341 D1342 E1346 A1347 S1348 P1674	F1340-Y1344 HydrophobicContact CE1-CD2 4.25Å; F1340-Y1344 HydrophobicContact CE1-CG 4.34Å; F1340-Y1344 HydrophobicContact CZ-CD2 4.44Å; F1340-Y1344 WeakPolarHBondContact O-CB 3.28Å; F1340-Y1344 PolarHBondContact O-N 3.28Å; R1341-Y1344 WeakPolarHBondContact O-CB 3.28Å; R1341-Y1344 PolarHBondContact O-N 3.22Å; D1342-Y1344 VanDerWaalsContact C-N 3.33Å; D1342-Y1344 PolarHBondContact O-N 3Å; Y1344-E1346 VanDerWaalsContact C-N 3.32Å; Y1344-E1346 PolarHBondContact O-N 3.27Å; Y1344-A1347 PolarHBondContact O-N 2.86Å; Y1344-S1348 VanDerWaalsContact O-CB 3.24Å; Y1344-S1348 WeakPolarHBondContact O-CB 3.29Å; Y1344-S1348 PolarHBondContact O-N 3.12Å; Y1344-P1674 HydrophobicContact CD1-CG 3.71Å; Y1344-P1674 VanDerWaalsContact CD1-CG 3.49Å; Y1344-P1674 HydrophobicContact CE1-CG 3.65Å
1345	Q	85.8	Confident	87.1	Confident	60.6 Å²	60.6	55 Å²	55	28%	0.283	25%	0.251	S	S	.	.	H	α-helix	trans	-65.2	-43.3	-179.3	-137	139.1	-14.8	0	0	111.3	R1341 D1342 V1343 S1348 C1349	R1341-Q1345 HydrophobicContact CG-CG 4.34Å; R1341-Q1345 VanDerWaalsContact NE-NE2 3.16Å; R1341-Q1345 VanDerWaalsContact O-CB 3.29Å; R1341-Q1345 WeakPolarHBondContact O-CB 3.4Å; R1341-Q1345 WeakPolarHBondContact O-CG 3.44Å; R1341-Q1345 PolarHBondContact O-N 3.08Å; D1342-Q1345 WeakPolarHBondContact O-CB 3.22Å; D1342-Q1345 PolarHBondContact O-N 3.17Å; D1342-Q1345 VanDerWaalsContact O-N 3.14Å; V1343-Q1345 VanDerWaalsContact C-N 3.33Å; V1343-Q1345 PolarHBondContact O-N 2.96Å; Q1345-S1348 PolarHBondContact O-N 2.93Å; Q1345-C1349 PolarHBondContact O-N 2.96Å; Q1345-C1349 VanDerWaalsContact O-N 3.1Å; Q1345-C1349 PolarHBondContact O-SG 3.04Å; Q1345-C1349 VanDerWaalsContact O-SG 3.38Å
1346	E	87	Confident	86.4	Confident	27 Å²	27	58.5 Å²	58.5	13%	0.126	26%	0.264	C	S	.	.	H	α-helix	trans	-65.3	-47.6	174.4	-72.6	-163.8	-161.3	0	0	112	L1207 L1208 T1209 H1212 D1342 V1343 Y1344 S1348 C1349 V1350	L1207-E1346 HydrophobicContact CB-CB 4.1Å; L1207-E1346 VanDerWaalsContact CB-OE2 3.28Å; L1207-E1346 WeakPolarHBondContact CB-OE2 3.28Å; L1207-E1346 HydrophobicContact CD1-CB 4.08Å; L1208-E1346 WeakPolarHBondContact CA-OE2 3.27Å; L1208-E1346 HydrophobicContact CB-CB 4.46Å; L1208-E1346 HydrophobicContact CB-CG 4.32Å; L1208-E1346 WeakPolarHBondContact CB-OE2 3.38Å; L1208-E1346 HydrophobicContact CD1-CB 4.39Å; L1208-E1346 HydrophobicContact CD1-CG 4.39Å; L1208-E1346 HydrophobicContact CG-CB 4.46Å; L1208-E1346 PolarHBondContact N-OE2 3.03Å; T1209-E1346 WeakPolarHBondContact CB-OE1 3.42Å; T1209-E1346 WeakPolarHBondContact CG2-OE1 3.27Å; T1209-E1346 PolarHBondContact N-OE2 3.13Å; T1209-E1346 PolarHBondContact OG1-OE1 3.13Å; T1209-E1346 PolarHBondContact OG1-OE2 3.19Å; H1212-E1346 IonicContact CD2-OE1 3.14Å; H1212-E1346 PolarHBondContact CD2-OE1 3.01Å; D1342-E1346 PolarHBondContact O-N 3.22Å; D1342-E1346 VanDerWaalsContact O-N 3.11Å; V1343-E1346 PolarHBondContact O-N 3.21Å; Y1344-E1346 VanDerWaalsContact C-N 3.32Å; Y1344-E1346 PolarHBondContact O-N 3.27Å; E1346-S1348 VanDerWaalsContact C-N 3.28Å; E1346-S1348 PolarHBondContact O-N 3.05Å; E1346-C1349 CarbonylContact O-C 3.43Å; E1346-C1349 WeakPolarHBondContact O-CA 3.26Å; E1346-C1349 WeakPolarHBondContact O-CB 3.29Å; E1346-C1349 PolarHBondContact O-N 2.92Å; E1346-C1349 VanDerWaalsContact O-N 3.11Å; E1346-V1350 WeakPolarHBondContact O-CG2 3.38Å; E1346-V1350 PolarHBondContact O-N 2.95Å
1347	A	86.8	Confident	85.9	Confident	27.2 Å²	27.2	56.5 Å²	56.5	23%	0.225	26%	0.257	C	S	.	.	H	α-helix	trans	-59.4	-38.6	177.4	0	0	0	0	0	112.3	L1207 I1214 V1343 Y1344 C1349 V1350 R1351	L1207-A1347 HydrophobicContact CD1-CB 4.42Å; L1207-A1347 HydrophobicContact CD2-CB 4.1Å; I1214-A1347 HydrophobicContact CD1-CB 4.01Å; V1343-A1347 VanDerWaalsContact O-CB 3.28Å; V1343-A1347 WeakPolarHBondContact O-CB 3.31Å; V1343-A1347 PolarHBondContact O-N 3.14Å; Y1344-A1347 PolarHBondContact O-N 2.86Å; A1347-C1349 VanDerWaalsContact C-N 3.33Å; A1347-C1349 PolarHBondContact O-N 3.02Å; A1347-V1350 PolarHBondContact O-N 3.1Å; A1347-R1351 WeakPolarHBondContact O-CB 3.33Å; A1347-R1351 PolarHBondContact O-N 3.02Å
1348	S	85.6	Confident	85.4	Confident	19.2 Å²	19.2	53 Å²	53	13%	0.134	25%	0.249	C	C	.	.	H	α-helix	trans	-64.4	-37.7	173.3	-175.6	0	0	0	0	112.1	Y1344 Q1345 E1346 R1351 K1352 R1632	Y1344-S1348 VanDerWaalsContact O-CB 3.24Å; Y1344-S1348 WeakPolarHBondContact O-CB 3.29Å; Y1344-S1348 PolarHBondContact O-N 3.12Å; Q1345-S1348 PolarHBondContact O-N 2.93Å; E1346-S1348 VanDerWaalsContact C-N 3.28Å; E1346-S1348 PolarHBondContact O-N 3.05Å; S1348-R1351 PolarHBondContact O-N 3Å; S1348-K1352 WeakPolarHBondContact O-CG 3.29Å; S1348-K1352 PolarHBondContact O-N 3.22Å; S1348-K1352 VanDerWaalsContact O-N 3.1Å; S1348-R1632 PolarHBondContact O-NH1 3.4Å; S1348-R1632 PolarHBondContact OG-NH1 3.03Å; S1348-R1632 VanDerWaalsContact OG-NH1 3.07Å; S1348-R1632 PolarHBondContact OG-NH2 3.19Å
1349	C	85.1	Confident	84.5	Confident	21.2 Å²	21.2	54 Å²	54	14%	0.143	26%	0.26	C	S	.	.	H	α-helix	trans	-68.1	-46.2	174.9	-70.8	0	0	0	0	111.8	L1208 Q1345 E1346 A1347 R1351 K1352 F1353 L1630 R1632	L1208-C1349 HydrophobicContact CD1-CB 3.57Å; Q1345-C1349 PolarHBondContact O-N 2.96Å; Q1345-C1349 VanDerWaalsContact O-N 3.1Å; Q1345-C1349 PolarHBondContact O-SG 3.04Å; Q1345-C1349 VanDerWaalsContact O-SG 3.38Å; E1346-C1349 CarbonylContact O-C 3.43Å; E1346-C1349 WeakPolarHBondContact O-CA 3.26Å; E1346-C1349 WeakPolarHBondContact O-CB 3.29Å; E1346-C1349 PolarHBondContact O-N 2.92Å; E1346-C1349 VanDerWaalsContact O-N 3.11Å; A1347-C1349 VanDerWaalsContact C-N 3.33Å; A1347-C1349 PolarHBondContact O-N 3.02Å; C1349-R1351 VanDerWaalsContact C-N 3.33Å; C1349-R1351 PolarHBondContact O-N 3.09Å; C1349-K1352 PolarHBondContact O-N 2.87Å; C1349-F1353 WeakPolarHBondContact O-CB 3.33Å; C1349-F1353 PolarHBondContact O-N 3.02Å; C1349-L1630 HydrophobicContact CB-CD2 4.23Å; C1349-L1630 WeakPolarHBondContact O-CD2 3.48Å; C1349-R1632 VanDerWaalsContact SG-CZ 3.54Å; C1349-R1632 PolarHBondContact SG-NE 2.96Å
1350	V	85.4	Confident	82.8	Confident	15.2 Å²	15.2	57.1 Å²	57.1	9%	0.092	28%	0.277	C	S	.	.	H	α-helix	trans	-56.2	-49.3	173.4	174.8	0	0	0	0	110.3	W1127 L1207 L1208 E1346 A1347 K1352 F1353 L1354	W1127-V1350 HydrophobicContact CH2-CG1 3.66Å; W1127-V1350 HydrophobicContact CZ3-CG1 4.05Å; L1207-V1350 HydrophobicContact CD2-CG2 4.3Å; L1208-V1350 HydrophobicContact CD1-CG2 3.93Å; L1208-V1350 VanDerWaalsContact CD1-CG2 3.42Å; L1208-V1350 HydrophobicContact CD2-CG2 3.93Å; L1208-V1350 HydrophobicContact CG-CG2 3.78Å; E1346-V1350 WeakPolarHBondContact O-CG2 3.38Å; E1346-V1350 PolarHBondContact O-N 2.95Å; A1347-V1350 PolarHBondContact O-N 3.1Å; V1350-K1352 PolarHBondContact O-N 3.12Å; V1350-F1353 WeakPolarHBondContact O-CB 3.35Å; V1350-F1353 PolarHBondContact O-N 3.11Å; V1350-F1353 VanDerWaalsContact O-N 3.1Å; V1350-L1354 HydrophobicContact CG1-CD1 3.85Å; V1350-L1354 HydrophobicContact CG1-CG 4.19Å; V1350-L1354 WeakPolarHBondContact O-CB 3.43Å; V1350-L1354 VanDerWaalsContact O-CG 3.3Å; V1350-L1354 WeakPolarHBondContact O-CG 3.35Å; V1350-L1354 PolarHBondContact O-N 3.04Å
1351	R	85.7	Confident	80.7	Confident	144.4 Å²	144.4	62.2 Å²	62.2	55%	0.545	31%	0.306	S	S	.	.	H	α-helix	trans	-57.7	-47.5	177.5	178.1	-179.9	167.8	-132.7	-2.1	112.6	A1347 S1348 C1349 F1353 L1354 L1355	A1347-R1351 WeakPolarHBondContact O-CB 3.33Å; A1347-R1351 PolarHBondContact O-N 3.02Å; S1348-R1351 PolarHBondContact O-N 3Å; C1349-R1351 VanDerWaalsContact C-N 3.33Å; C1349-R1351 PolarHBondContact O-N 3.09Å; R1351-F1353 VanDerWaalsContact C-N 3.31Å; R1351-F1353 PolarHBondContact O-N 3.2Å; R1351-L1354 PolarHBondContact O-N 3.02Å; R1351-L1355 HydrophobicContact CG-CD1 4.09Å; R1351-L1355 HydrophobicContact CG-CG 4.4Å; R1351-L1355 WeakPolarHBondContact O-CB 3.28Å; R1351-L1355 VanDerWaalsContact O-CG 3.29Å; R1351-L1355 WeakPolarHBondContact O-CG 3.34Å; R1351-L1355 PolarHBondContact O-N 3.11Å
1352	K	82.5	Confident	78.5	Confident	60.6 Å²	60.6	62.8 Å²	62.8	26%	0.263	31%	0.313	S	S	.	.	H	α-helix	trans	-65.3	-35.5	178.8	-74	-160.8	-176.2	-168.4	0	111.7	S1348 C1349 V1350 L1355 K1356 E1606 L1630	S1348-K1352 WeakPolarHBondContact O-CG 3.29Å; S1348-K1352 PolarHBondContact O-N 3.22Å; S1348-K1352 VanDerWaalsContact O-N 3.1Å; C1349-K1352 PolarHBondContact O-N 2.87Å; V1350-K1352 PolarHBondContact O-N 3.12Å; K1352-L1355 HydrophobicContact CG-CD1 4.5Å; K1352-L1355 PolarHBondContact O-N 3.08Å; K1352-K1356 WeakPolarHBondContact O-CB 3.26Å; K1352-K1356 WeakPolarHBondContact O-CG 3.39Å; K1352-K1356 PolarHBondContact O-N 3.1Å; K1352-K1356 VanDerWaalsContact O-N 3.1Å; K1352-E1606 IonicContact NZ-OE1 3.09Å; K1352-E1606 PolarHBondContact NZ-OE1 3.23Å; K1352-E1606 IonicContact NZ-OE2 3.34Å; K1352-E1606 PolarHBondContact NZ-OE2 3.33Å; K1352-E1606 VanDerWaalsContact NZ-OE2 3.15Å; K1352-L1630 HydrophobicContact CB-CD1 4.24Å; K1352-L1630 HydrophobicContact CB-CD2 4.19Å
1353	F	83.9	Confident	75.9	Confident	21.2 Å²	21.2	65.2 Å²	65.2	9%	0.093	33%	0.33	C	S	.	.	H	α-helix	trans	-64.8	-49.6	173.2	174.3	-102	0	0	0	112.1	L1129 L1133 C1349 V1350 R1351 L1355 K1356 L1357 Y1364 I1619 P1621 Y1628 L1630	L1129-F1353 HydrophobicContact CD1-CD1 3.84Å; L1129-F1353 HydrophobicContact CD1-CE1 3.82Å; L1129-F1353 HydrophobicContact CD2-CD1 4.37Å; L1129-F1353 HydrophobicContact CD2-CE1 4.21Å; L1129-F1353 HydrophobicContact CG-CE1 4.39Å; L1133-F1353 HydrophobicContact CD2-CE1 4.3Å; L1133-F1353 HydrophobicContact CD2-CZ 4.35Å; C1349-F1353 WeakPolarHBondContact O-CB 3.33Å; C1349-F1353 PolarHBondContact O-N 3.02Å; V1350-F1353 WeakPolarHBondContact O-CB 3.35Å; V1350-F1353 PolarHBondContact O-N 3.11Å; V1350-F1353 VanDerWaalsContact O-N 3.1Å; R1351-F1353 VanDerWaalsContact C-N 3.31Å; R1351-F1353 PolarHBondContact O-N 3.2Å; F1353-L1355 VanDerWaalsContact C-N 3.33Å; F1353-L1355 PolarHBondContact O-N 2.96Å; F1353-K1356 PolarHBondContact O-N 2.93Å; F1353-K1356 VanDerWaalsContact O-N 3.14Å; F1353-L1357 HydrophobicContact CD1-CD1 4.46Å; F1353-L1357 HydrophobicContact CD2-CD1 4.45Å; F1353-L1357 HydrophobicContact CD2-CG 4.37Å; F1353-L1357 HydrophobicContact CE1-CB 4.47Å; F1353-L1357 HydrophobicContact CE1-CD1 3.79Å; F1353-L1357 HydrophobicContact CE1-CD2 4.43Å; F1353-L1357 HydrophobicContact CE2-CD1 3.85Å; F1353-L1357 HydrophobicContact CE2-CD2 4.17Å; F1353-L1357 HydrophobicContact CE2-CG 3.95Å; F1353-L1357 HydrophobicContact CZ-CD1 3.89Å; F1353-L1357 HydrophobicContact CZ-CD2 4.5Å; F1353-L1357 HydrophobicContact CZ-CG 4.17Å; F1353-L1357 WeakPolarHBondContact O-CB 3.39Å; F1353-L1357 PolarHBondContact O-N 3.02Å; F1353-L1357 VanDerWaalsContact O-N 3.15Å; F1353-Y1364 AromaticContact CD2-CE1 3.66Å; F1353-Y1364 HydrophobicContact CD2-CE1 3.84Å; F1353-Y1364 AromaticContact CD2-CZ 3.82Å; F1353-Y1364 WeakPolarHBondContact CD2-OH 3.43Å; F1353-Y1364 HydrophobicContact CE2-CD1 4.26Å; F1353-Y1364 AromaticContact CE2-CE1 3.51Å; F1353-Y1364 HydrophobicContact CE2-CE1 3.68Å; F1353-Y1364 VanDerWaalsContact CE2-CE1 3.48Å; F1353-Y1364 HydrophobicContact CE2-CE2 4.31Å; F1353-Y1364 AromaticContact CE2-CZ 3.54Å; F1353-Y1364 WeakPolarHBondContact CE2-OH 3.44Å; F1353-Y1364 PolarHBondContact O-OH 3.03Å; F1353-Y1364 VanDerWaalsContact O-OH 3.1Å; F1353-I1619 HydrophobicContact CB-CD1 3.55Å; F1353-I1619 HydrophobicContact CD1-CD1 4.45Å; F1353-I1619 HydrophobicContact CD1-CG2 4.08Å; F1353-I1619 HydrophobicContact CD2-CD1 3.88Å; F1353-I1619 HydrophobicContact CE1-CG2 4.09Å; F1353-I1619 HydrophobicContact CE2-CD1 4.43Å; F1353-I1619 HydrophobicContact CG-CD1 3.75Å; F1353-I1619 HydrophobicContact CG-CG2 4.33Å; F1353-I1619 HydrophobicContact CZ-CG2 4.35Å; F1353-P1621 HydrophobicContact CZ-CB 4.49Å; F1353-Y1628 AromaticContact CD2-CD1 3.4Å; F1353-Y1628 HydrophobicContact CD2-CD1 3.4Å; F1353-Y1628 HydrophobicContact CD2-CD2 4.42Å; F1353-Y1628 AromaticContact CD2-CE1 3.95Å; F1353-Y1628 HydrophobicContact CD2-CE1 3.95Å; F1353-Y1628 AromaticContact CD2-CG 3.68Å; F1353-Y1628 HydrophobicContact CD2-CG 3.68Å; F1353-Y1628 AromaticContact CE2-CD1 3.82Å; F1353-Y1628 HydrophobicContact CE2-CD1 4.02Å; F1353-Y1628 HydrophobicContact CE2-CD2 4.13Å; F1353-Y1628 AromaticContact CE2-CG 3.68Å; F1353-Y1628 HydrophobicContact CE2-CG 3.68Å; F1353-Y1628 HydrophobicContact CG-CD1 4.45Å; F1353-Y1628 HydrophobicContact CZ-CD1 4.41Å; F1353-Y1628 AromaticContact CZ-CD2 3.94Å; F1353-Y1628 HydrophobicContact CZ-CD2 3.94Å; F1353-Y1628 HydrophobicContact CZ-CE2 4.28Å; F1353-Y1628 AromaticContact CZ-CG 4Å; F1353-Y1628 HydrophobicContact CZ-CG 4.01Å; F1353-L1630 HydrophobicContact CB-CD2 4.4Å
1354	L	83.5	Confident	73.6	Confident	34.6 Å²	34.6	69.8 Å²	69.8	18%	0.181	35%	0.348	C	S	.	.	H	α-helix	trans	-59.9	-43.1	177.2	-66.8	176.1	0	0	0	111.4	W1127 L1129 H1132 V1350 R1351 K1356 L1357 H1358	W1127-L1354 HydrophobicContact CH2-CD1 4.11Å; W1127-L1354 HydrophobicContact CZ2-CD1 3.99Å; W1127-L1354 HydrophobicContact CZ2-CD2 4.33Å; L1129-L1354 HydrophobicContact CD1-CD2 4.23Å; H1132-L1354 VanDerWaalsContact CD2-CD2 3.42Å; H1132-L1354 WeakPolarHBondContact CD2-CD2 3.34Å; H1132-L1354 WeakPolarHBondContact NE2-CD2 3.44Å; V1350-L1354 HydrophobicContact CG1-CD1 3.85Å; V1350-L1354 HydrophobicContact CG1-CG 4.19Å; V1350-L1354 WeakPolarHBondContact O-CB 3.43Å; V1350-L1354 VanDerWaalsContact O-CG 3.3Å; V1350-L1354 WeakPolarHBondContact O-CG 3.35Å; V1350-L1354 PolarHBondContact O-N 3.04Å; R1351-L1354 PolarHBondContact O-N 3.02Å; L1354-K1356 VanDerWaalsContact C-N 3.31Å; L1354-K1356 PolarHBondContact O-N 3.17Å; L1354-K1356 VanDerWaalsContact O-N 3.09Å; L1354-L1357 HydrophobicContact CD2-CD2 4.48Å; L1354-L1357 WeakPolarHBondContact O-CB 3.34Å; L1354-L1357 PolarHBondContact O-N 3.14Å; L1354-L1357 VanDerWaalsContact O-N 3.07Å; L1354-H1358 PolarHBondContact O-CD2 2.86Å; L1354-H1358 VanDerWaalsContact O-CD2 3.24Å; L1354-H1358 PolarHBondContact O-N 2.78Å
1355	L	81.2	Confident	71.1	Confident	93.6 Å²	93.6	72.8 Å²	72.8	49%	0.49	36%	0.363	S	S	.	.	H	α-helix	trans	-56.9	-42.7	174.7	-92	155	0	0	0	112	R1351 K1352 F1353 H1358 S1359	R1351-L1355 HydrophobicContact CG-CD1 4.09Å; R1351-L1355 HydrophobicContact CG-CG 4.4Å; R1351-L1355 WeakPolarHBondContact O-CB 3.28Å; R1351-L1355 VanDerWaalsContact O-CG 3.29Å; R1351-L1355 WeakPolarHBondContact O-CG 3.34Å; R1351-L1355 PolarHBondContact O-N 3.11Å; K1352-L1355 HydrophobicContact CG-CD1 4.5Å; K1352-L1355 PolarHBondContact O-N 3.08Å; F1353-L1355 VanDerWaalsContact C-N 3.33Å; F1353-L1355 PolarHBondContact O-N 2.96Å; L1355-H1358 PolarHBondContact O-N 2.86Å; L1355-S1359 VanDerWaalsContact O-CB 3.29Å; L1355-S1359 WeakPolarHBondContact O-CB 3.37Å; L1355-S1359 PolarHBondContact O-N 3.08Å; L1355-S1359 PolarHBondContact O-OG 3.07Å
1356	K	79.2	Confident	68.7	Low	95.8 Å²	95.8	76.3 Å²	76.3	42%	0.417	38%	0.379	S	S	.	.	H	α-helix	trans	-70.7	-36.7	178.4	-156.3	149.8	177.7	176.5	0	112.6	K1352 F1353 L1354 H1358 S1359 N1361 T1363 Y1364 Y1628 L1630	K1352-K1356 WeakPolarHBondContact O-CB 3.26Å; K1352-K1356 WeakPolarHBondContact O-CG 3.39Å; K1352-K1356 PolarHBondContact O-N 3.1Å; K1352-K1356 VanDerWaalsContact O-N 3.1Å; F1353-K1356 PolarHBondContact O-N 2.93Å; F1353-K1356 VanDerWaalsContact O-N 3.14Å; L1354-K1356 VanDerWaalsContact C-N 3.31Å; L1354-K1356 PolarHBondContact O-N 3.17Å; L1354-K1356 VanDerWaalsContact O-N 3.09Å; K1356-H1358 VanDerWaalsContact C-N 3.29Å; K1356-H1358 PolarHBondContact O-N 3.29Å; K1356-S1359 WeakPolarHBondContact CA-OG 3.38Å; K1356-S1359 PolarHBondContact O-N 2.94Å; K1356-S1359 VanDerWaalsContact O-N 3.09Å; K1356-S1359 PolarHBondContact O-OG 3.07Å; K1356-N1361 VanDerWaalsContact CE-O 3.3Å; K1356-N1361 WeakPolarHBondContact CE-O 3.23Å; K1356-N1361 PolarHBondContact NZ-O 2.59Å; K1356-T1363 WeakPolarHBondContact CE-O 3.22Å; K1356-T1363 PolarHBondContact NZ-O 2.68Å; K1356-Y1364 WeakPolarHBondContact CB-OH 3.39Å; K1356-Y1364 HydrophobicContact CD-CE1 3.96Å; K1356-Y1364 HydrophobicContact CG-CE1 4.29Å; K1356-Y1628 VanDerWaalsContact CD-OH 3.3Å; K1356-Y1628 WeakPolarHBondContact CD-OH 3.48Å; K1356-Y1628 WeakPolarHBondContact CG-OH 3.21Å; K1356-L1630 HydrophobicContact CD-CD1 3.82Å
1357	L	79.3	Confident	66.2	Low	18.6 Å²	18.6	79.2 Å²	79.2	10%	0.097	40%	0.399	C	S	.	.	H	α-helix	trans	-65.2	-31	176.1	-161.8	105.4	0	0	0	113	L1133 Y1136 F1353 L1354 S1359 I1362 Y1364	L1133-L1357 HydrophobicContact CD2-CD1 3.9Å; L1133-L1357 VanDerWaalsContact CD2-CD1 3.46Å; L1133-L1357 HydrophobicContact CD2-CD2 3.82Å; Y1136-L1357 HydrophobicContact CD1-CD1 4.32Å; Y1136-L1357 HydrophobicContact CD1-CD2 4.38Å; Y1136-L1357 HydrophobicContact CD1-CG 4.48Å; Y1136-L1357 HydrophobicContact CD2-CD2 4.08Å; Y1136-L1357 HydrophobicContact CD2-CG 4.37Å; Y1136-L1357 HydrophobicContact CE1-CD1 4.18Å; Y1136-L1357 HydrophobicContact CE1-CG 4.36Å; Y1136-L1357 HydrophobicContact CE2-CD2 4.07Å; Y1136-L1357 HydrophobicContact CE2-CG 4.22Å; Y1136-L1357 HydrophobicContact CG-CD2 4.12Å; Y1136-L1357 HydrophobicContact CG-CG 4.45Å; Y1136-L1357 PolarHBondContact OH-O 3.04Å; F1353-L1357 HydrophobicContact CD1-CD1 4.46Å; F1353-L1357 HydrophobicContact CD2-CD1 4.45Å; F1353-L1357 HydrophobicContact CD2-CG 4.37Å; F1353-L1357 HydrophobicContact CE1-CB 4.47Å; F1353-L1357 HydrophobicContact CE1-CD1 3.79Å; F1353-L1357 HydrophobicContact CE1-CD2 4.43Å; F1353-L1357 HydrophobicContact CE2-CD1 3.85Å; F1353-L1357 HydrophobicContact CE2-CD2 4.17Å; F1353-L1357 HydrophobicContact CE2-CG 3.95Å; F1353-L1357 HydrophobicContact CZ-CD1 3.89Å; F1353-L1357 HydrophobicContact CZ-CD2 4.5Å; F1353-L1357 HydrophobicContact CZ-CG 4.17Å; F1353-L1357 WeakPolarHBondContact O-CB 3.39Å; F1353-L1357 PolarHBondContact O-N 3.02Å; F1353-L1357 VanDerWaalsContact O-N 3.15Å; L1354-L1357 HydrophobicContact CD2-CD2 4.48Å; L1354-L1357 WeakPolarHBondContact O-CB 3.34Å; L1354-L1357 PolarHBondContact O-N 3.14Å; L1354-L1357 VanDerWaalsContact O-N 3.07Å; L1357-S1359 VanDerWaalsContact C-N 3.34Å; L1357-I1362 HydrophobicContact CD2-CD1 4.23Å; L1357-Y1364 HydrophobicContact CD1-CE2 4.37Å; L1357-Y1364 PolarHBondContact N-OH 2.91Å; L1357-Y1364 VanDerWaalsContact N-OH 3.12Å
1358	H	77	Confident	63.6	Low	105.8 Å²	105.8	83.2 Å²	83.2	49%	0.49	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-2.2	178.3	-74.1	-62.5	0	0	0	113.9	H1132 Y1136 L1354 L1355 K1356	H1132-H1358 AromaticContact CE1-NE2 3.66Å; H1132-H1358 AromaticContact NE2-CD2 3.96Å; H1132-H1358 AromaticContact NE2-CE1 3.81Å; H1132-H1358 AromaticContact NE2-NE2 2.99Å; H1132-H1358 PolarHBondContact NE2-NE2 3.22Å; Y1136-H1358 AromaticContact CD2-CE1 3.62Å; Y1136-H1358 AromaticContact CD2-ND1 3.89Å; Y1136-H1358 AromaticContact CE2-CE1 3.97Å; Y1136-H1358 AromaticContact CE2-ND1 3.82Å; L1354-H1358 PolarHBondContact O-CD2 2.86Å; L1354-H1358 VanDerWaalsContact O-CD2 3.24Å; L1354-H1358 PolarHBondContact O-N 2.78Å; L1355-H1358 PolarHBondContact O-N 2.86Å; K1356-H1358 VanDerWaalsContact C-N 3.29Å; K1356-H1358 PolarHBondContact O-N 3.29Å
1359	S	70.3	Confident	60.9	Low	50.2 Å²	50.2	89.4 Å²	89.4	35%	0.351	45%	0.448	S	S	.	.	S	Bend	trans	-89	87.3	173.4	19.7	0	0	0	0	111.2	L1355 K1356 L1357 N1361 I1362	L1355-S1359 VanDerWaalsContact O-CB 3.29Å; L1355-S1359 WeakPolarHBondContact O-CB 3.37Å; L1355-S1359 PolarHBondContact O-N 3.08Å; L1355-S1359 PolarHBondContact O-OG 3.07Å; K1356-S1359 WeakPolarHBondContact CA-OG 3.38Å; K1356-S1359 PolarHBondContact O-N 2.94Å; K1356-S1359 VanDerWaalsContact O-N 3.09Å; K1356-S1359 PolarHBondContact O-OG 3.07Å; L1357-S1359 VanDerWaalsContact C-N 3.34Å; S1359-N1361 PolarHBondContact O-N 3.14Å; S1359-I1362 PolarHBondContact O-N 2.79Å
1360	D	54.2	Low	58.3	Low	148.4 Å²	148.4	96.1 Å²	96.1	79%	0.794	48%	0.477	S	S	*	.	S	Bend	trans	-45.4	-7.6	-177.4	-64.5	-37.9	0	0	0	115.1	I1362	D1360-I1362 VanDerWaalsContact C-N 3.28Å; D1360-I1362 PolarHBondContact O-N 3.13Å
1361	N	47.2	Very low	55.6	Low	141 Å²	141	101.5 Å²	101.5	75%	0.754	51%	0.511	S	S	*	.			trans	-86.2	53.1	174.8	-74.4	-22.1	0	0	0	113.1	K1356 S1359 T1363	K1356-N1361 VanDerWaalsContact CE-O 3.3Å; K1356-N1361 WeakPolarHBondContact CE-O 3.23Å; K1356-N1361 PolarHBondContact NZ-O 2.59Å; S1359-N1361 PolarHBondContact O-N 3.14Å; N1361-T1363 PolarHBondContact O-N 3.06Å
1362	I	41.7	Very low	52.7	Low	75.8 Å²	75.8	103.8 Å²	103.8	39%	0.389	53%	0.525	S	S	.	.			trans	-94.5	97.2	179.4	-56.1	175.7	0	0	0	110.6	L1357 S1359 D1360 Y1364	L1357-I1362 HydrophobicContact CD2-CD1 4.23Å; S1359-I1362 PolarHBondContact O-N 2.79Å; D1360-I1362 VanDerWaalsContact C-N 3.28Å; D1360-I1362 PolarHBondContact O-N 3.13Å; I1362-Y1364 VanDerWaalsContact C-N 3.34Å; I1362-Y1364 HydrophobicContact CB-CD2 4.43Å; I1362-Y1364 HydrophobicContact CB-CE2 4.3Å; I1362-Y1364 HydrophobicContact CD1-CE2 4.28Å; I1362-Y1364 HydrophobicContact CG1-CE2 3.96Å; I1362-Y1364 HydrophobicContact CG2-CD2 3.83Å; I1362-Y1364 HydrophobicContact CG2-CE1 4.21Å; I1362-Y1364 HydrophobicContact CG2-CE2 3.79Å; I1362-Y1364 VanDerWaalsContact CG2-CE2 3.49Å; I1362-Y1364 HydrophobicContact CG2-CG 4.3Å; I1362-Y1364 PolarHBondContact O-N 3.14Å
1363	T	35.1	Very low	50.1	Low	109.6 Å²	109.6	107.8 Å²	107.8	67%	0.672	55%	0.549	S	S	*	.			trans	-106	95.3	158.8	33.7	0	0	0	0	108.8	K1356 N1361 F1365	K1356-T1363 WeakPolarHBondContact CE-O 3.22Å; K1356-T1363 PolarHBondContact NZ-O 2.68Å; N1361-T1363 PolarHBondContact O-N 3.06Å; T1363-F1365 PolarHBondContact O-N 3.06Å
1364	Y	39.8	Very low	47.4	Very low	96.8 Å²	96.8	115 Å²	115	38%	0.38	58%	0.583	S	S	.	*			trans	-85	121.2	163.2	-70.1	-78.5	0	0	0	108.3	F1353 K1356 L1357 I1362 H1366 P1626 Y1628	F1353-Y1364 AromaticContact CD2-CE1 3.66Å; F1353-Y1364 HydrophobicContact CD2-CE1 3.84Å; F1353-Y1364 AromaticContact CD2-CZ 3.82Å; F1353-Y1364 WeakPolarHBondContact CD2-OH 3.43Å; F1353-Y1364 HydrophobicContact CE2-CD1 4.26Å; F1353-Y1364 AromaticContact CE2-CE1 3.51Å; F1353-Y1364 HydrophobicContact CE2-CE1 3.68Å; F1353-Y1364 VanDerWaalsContact CE2-CE1 3.48Å; F1353-Y1364 HydrophobicContact CE2-CE2 4.31Å; F1353-Y1364 AromaticContact CE2-CZ 3.54Å; F1353-Y1364 WeakPolarHBondContact CE2-OH 3.44Å; F1353-Y1364 PolarHBondContact O-OH 3.03Å; F1353-Y1364 VanDerWaalsContact O-OH 3.1Å; K1356-Y1364 WeakPolarHBondContact CB-OH 3.39Å; K1356-Y1364 HydrophobicContact CD-CE1 3.96Å; K1356-Y1364 HydrophobicContact CG-CE1 4.29Å; L1357-Y1364 HydrophobicContact CD1-CE2 4.37Å; L1357-Y1364 PolarHBondContact N-OH 2.91Å; L1357-Y1364 VanDerWaalsContact N-OH 3.12Å; I1362-Y1364 VanDerWaalsContact C-N 3.34Å; I1362-Y1364 HydrophobicContact CB-CD2 4.43Å; I1362-Y1364 HydrophobicContact CB-CE2 4.3Å; I1362-Y1364 HydrophobicContact CD1-CE2 4.28Å; I1362-Y1364 HydrophobicContact CG1-CE2 3.96Å; I1362-Y1364 HydrophobicContact CG2-CD2 3.83Å; I1362-Y1364 HydrophobicContact CG2-CE1 4.21Å; I1362-Y1364 HydrophobicContact CG2-CE2 3.79Å; I1362-Y1364 VanDerWaalsContact CG2-CE2 3.49Å; I1362-Y1364 HydrophobicContact CG2-CG 4.3Å; I1362-Y1364 PolarHBondContact O-N 3.14Å; Y1364-H1366 VanDerWaalsContact C-N 3.28Å; Y1364-H1366 PolarHBondContact O-N 3.04Å; Y1364-H1366 VanDerWaalsContact O-N 3.11Å; Y1364-P1626 HydrophobicContact CD1-CG 4.36Å; Y1364-P1626 HydrophobicContact CE1-CG 3.99Å; Y1364-Y1628 HydrophobicContact CD1-CD1 4.2Å; Y1364-Y1628 HydrophobicContact CD2-CD1 4.27Å; Y1364-Y1628 HydrophobicContact CD2-CE1 4.4Å; Y1364-Y1628 AromaticContact CG-CD1 3.76Å; Y1364-Y1628 HydrophobicContact CG-CD1 3.92Å; Y1364-Y1628 HydrophobicContact CG-CE1 4.3Å
1365	F	36.7	Very low	44.7	Very low	161.2 Å²	161.2	117.9 Å²	117.9	71%	0.707	61%	0.606	S	S	*	*			trans	-74.7	107.2	170.5	-70.1	-81.4	0	0	0	108.6	T1363 V1367	T1363-F1365 PolarHBondContact O-N 3.06Å; F1365-V1367 PolarHBondContact O-N 3.12Å
1366	H	35.3	Very low	42.1	Very low	134.6 Å²	134.6	123 Å²	123	62%	0.623	62%	0.624	S	S	*	*			trans	-67	118.6	169.4	-152.3	-91.6	0	0	0	107.9	Y1364 N1368 P1626	Y1364-H1366 VanDerWaalsContact C-N 3.28Å; Y1364-H1366 PolarHBondContact O-N 3.04Å; Y1364-H1366 VanDerWaalsContact O-N 3.11Å; H1366-N1368 VanDerWaalsContact C-N 3.31Å; H1366-N1368 PolarHBondContact CE1-OD1 3.21Å; H1366-N1368 PolarHBondContact ND1-OD1 3.26Å; H1366-N1368 PolarHBondContact O-N 3.2Å; H1366-N1368 VanDerWaalsContact O-N 3.11Å; H1366-P1626 VanDerWaalsContact NE2-CB 3.26Å; H1366-P1626 WeakPolarHBondContact NE2-CB 3.26Å; H1366-P1626 WeakPolarHBondContact NE2-CG 3.25Å
1367	V	34.4	Very low	39.6	Very low	87.6 Å²	87.6	128.2 Å²	128.2	53%	0.531	65%	0.647	S	S	.	*			trans	-76.5	93.4	169.6	-177.9	0	0	0	0	106.2	F1365 D1369 T1629	F1365-V1367 PolarHBondContact O-N 3.12Å; V1367-D1369 VanDerWaalsContact C-N 3.34Å; V1367-D1369 PolarHBondContact O-N 3.04Å; V1367-T1629 WeakPolarHBondContact CG2-OG1 3.35Å
1368	N	33	Very low	37	Very low	112.8 Å²	112.8	132.6 Å²	132.6	60%	0.603	68%	0.679	S	S	*	*			trans	-76.8	109.7	163	-76.4	4.8	0	0	0	107	H1366 Q1370	H1366-N1368 VanDerWaalsContact C-N 3.31Å; H1366-N1368 PolarHBondContact CE1-OD1 3.21Å; H1366-N1368 PolarHBondContact ND1-OD1 3.26Å; H1366-N1368 PolarHBondContact O-N 3.2Å; H1366-N1368 VanDerWaalsContact O-N 3.11Å; N1368-Q1370 HydrophobicContact CB-CG 4.4Å; N1368-Q1370 PolarHBondContact O-N 2.96Å
1369	D	28.5	Very low	34.6	Very low	149.4 Å²	149.4	133.3 Å²	133.3	80%	0.799	70%	0.696	S	S	*	*			trans	-64.6	83	163.9	-75.6	-38.4	0	0	0	109.7	V1367 T1371	V1367-D1369 VanDerWaalsContact C-N 3.34Å; V1367-D1369 PolarHBondContact O-N 3.04Å; D1369-T1371 VanDerWaalsContact C-N 3.3Å; D1369-T1371 PolarHBondContact O-N 3.15Å
1370	Q	30.2	Very low	32.5	Very low	161.2 Å²	161.2	138.6 Å²	138.6	75%	0.753	72%	0.72	S	S	*	*			trans	-95.3	94.6	164	-68.7	-172.9	-4.2	0	0	109	N1368 F1372	N1368-Q1370 HydrophobicContact CB-CG 4.4Å; N1368-Q1370 PolarHBondContact O-N 2.96Å; Q1370-F1372 PolarHBondContact O-N 3.15Å
1371	T	28.3	Very low	31.4	Very low	129.2 Å²	129.2	137 Å²	137	79%	0.793	72%	0.718	S	S	*	*			trans	4.5	90.8	149.3	50.9	0	0	0	0	112.9	D1369 D1373	D1369-T1371 VanDerWaalsContact C-N 3.3Å; D1369-T1371 PolarHBondContact O-N 3.15Å; T1371-D1373 VanDerWaalsContact C-N 3.3Å; T1371-D1373 PolarHBondContact O-N 2.97Å; T1371-D1373 VanDerWaalsContact O-N 3.17Å
1372	F	25.7	Very low	30.5	Very low	191.2 Å²	191.2	137 Å²	137	84%	0.839	72%	0.717	S	S	*	*			trans	-79.8	89.2	163.2	-139.5	-86	0	0	0	108.7	Q1370 Q1374	Q1370-F1372 PolarHBondContact O-N 3.15Å; F1372-Q1374 HydrophobicContact CD1-CG 4.33Å; F1372-Q1374 PolarHBondContact O-N 3.29Å; F1372-Q1374 VanDerWaalsContact O-N 3.09Å
1373	D	27.3	Very low	29.8	Very low	145.6 Å²	145.6	141.4 Å²	141.4	78%	0.779	74%	0.736	S	S	*	*			trans	-85.5	120	172.3	-122.7	-17.4	0	0	0	109.3	T1371 S1375	T1371-D1373 VanDerWaalsContact C-N 3.3Å; T1371-D1373 PolarHBondContact O-N 2.97Å; T1371-D1373 VanDerWaalsContact O-N 3.17Å; D1373-S1375 PolarHBondContact O-N 3.04Å
1374	Q	27.3	Very low	29.4	Very low	172 Å²	172	143 Å²	143	80%	0.804	74%	0.741	S	S	*	*			trans	-84.7	67.6	-174.6	-68.5	-175.1	0	0	0	113.1	F1372 K1376	F1372-Q1374 HydrophobicContact CD1-CG 4.33Å; F1372-Q1374 PolarHBondContact O-N 3.29Å; F1372-Q1374 VanDerWaalsContact O-N 3.09Å; Q1374-K1376 PolarHBondContact O-N 2.9Å
1375	S	26.6	Very low	29	Very low	94.8 Å²	94.8	144.3 Å²	144.3	66%	0.663	76%	0.759	S	S	*	*			trans	-139.2	76.1	168.7	64	0	0	0	0	115.1	D1373	D1373-S1375 PolarHBondContact O-N 3.04Å
1376	K	27.5	Very low	28.5	Very low	201.4 Å²	201.4	142.5 Å²	142.5	88%	0.876	76%	0.761	S	S	*	*			trans	-157.4	74	150.7	-78.4	-179.8	-179.9	173.9	0	114.2	Q1374	Q1374-K1376 PolarHBondContact O-N 2.9Å
1377	K	25.6	Very low	28.1	Very low	204 Å²	204	144.1 Å²	144.1	89%	0.887	77%	0.773	S	S	*	*			trans	-117.1	103.8	143.3	-84	-175.2	177.5	179.8	0	112.6
1378	S	24.5	Very low	27.8	Very low	111.8 Å²	111.8	145.4 Å²	145.4	78%	0.782	79%	0.786	S	S	*	*			trans	167.1	102	160.3	56.8	0	0	0	0	114.8
1379	S	28.1	Very low	27.6	Very low	121.4 Å²	121.4	147.2 Å²	147.2	85%	0.849	80%	0.796	S	S	*	*			trans	-163.2	103.3	142	37.6	0	0	0	0	109	P1381	S1379-P1381 WeakPolarHBondContact O-CD 3.43Å
1380	L	24.8	Very low	27.8	Very low	161.4 Å²	161.4	145.6 Å²	145.6	85%	0.845	79%	0.794	S	S	*	*			trans	-75.8	150.2	162.4	-101.3	102	0	0	0	107.9	N1382	L1380-N1382 PolarHBondContact O-N 2.92Å
1381	P	32.5	Very low	27.7	Very low	114.4 Å²	114.4	144.4 Å²	144.4	74%	0.743	80%	0.798	S	S	*	*			trans	-105.6	145.1	135.7	26.6	-10.9	0	0	0	112.1	S1379 E1383	S1379-P1381 WeakPolarHBondContact O-CD 3.43Å; P1381-E1383 PolarHBondContact O-N 3.02Å
1382	N	28.3	Very low	27.6	Very low	140 Å²	140	143.5 Å²	143.5	75%	0.749	80%	0.796	S	S	*	*			trans	-25.4	124.4	163.4	-69.1	0.4	0	0	0	114	L1380 D1384	L1380-N1382 PolarHBondContact O-N 2.92Å; N1382-D1384 PolarHBondContact O-N 3.01Å; N1382-D1384 VanDerWaalsContact O-N 3.17Å
1383	E	26.7	Very low	27.9	Very low	168 Å²	168	139.8 Å²	139.8	79%	0.785	79%	0.791	S	S	*	*			trans	-30	132	130.4	-77.2	175.2	164	0	0	115.2	P1381	P1381-E1383 PolarHBondContact O-N 3.02Å
1384	D	26.5	Very low	27.9	Very low	144.6 Å²	144.6	138.9 Å²	138.9	77%	0.773	79%	0.792	S	S	*	*			trans	96.4	119.7	145.6	-76.4	-11.5	0	0	0	118.4	N1382 T1386	N1382-D1384 PolarHBondContact O-N 3.01Å; N1382-D1384 VanDerWaalsContact O-N 3.17Å; D1384-T1386 PolarHBondContact O-N 2.96Å
1385	V	30.3	Very low	27.7	Very low	124.2 Å²	124.2	135.6 Å²	135.6	75%	0.753	79%	0.788	S	S	*	*			trans	169.1	123.9	140.9	163	0	0	0	0	114.5
1386	T	28	Very low	27.8	Very low	122.6 Å²	122.6	138.4 Å²	138.4	75%	0.752	79%	0.794	S	S	*	*			trans	54.1	122.5	160	51.4	0	0	0	0	119.4	D1384 S1388	D1384-T1386 PolarHBondContact O-N 2.96Å; T1386-S1388 PolarHBondContact O-N 2.85Å
1387	L	24.9	Very low	27.6	Very low	167.6 Å²	167.6	137.4 Å²	137.4	88%	0.877	79%	0.792	S	S	*	*			trans	-30.2	125.4	155.3	-118.5	74.6	0	0	0	114.7
1388	S	29.8	Very low	27.6	Very low	115.2 Å²	115.2	133.2 Å²	133.2	81%	0.806	79%	0.788	S	S	*	*			trans	-151.5	144.2	132.7	54.9	0	0	0	0	112.4	T1386	T1386-S1388 PolarHBondContact O-N 2.85Å
1389	N	27.4	Very low	27.6	Very low	150.2 Å²	150.2	133.1 Å²	133.1	80%	0.803	79%	0.787	S	S	*	*			trans	-81.5	165.1	-174.9	-92.8	-22.7	0	0	0	113
1390	P	32.8	Very low	27.7	Very low	116.4 Å²	116.4	132.9 Å²	132.9	76%	0.756	78%	0.783	S	S	*	*			trans	-100.7	152	-169.2	31.8	-21.9	0	0	0	111.8
1391	T	28.9	Very low	27.8	Very low	137.4 Å²	137.4	130.4 Å²	130.4	84%	0.843	78%	0.779	S	S	*	*			trans	-135.2	139.4	142.7	12.2	0	0	0	0	111.3	P1393	T1391-P1393 WeakPolarHBondContact O-CD 3.43Å
1392	S	26.2	Very low	27.4	Very low	108.4 Å²	108.4	131.4 Å²	131.4	76%	0.758	78%	0.784	S	S	*	*			trans	-89.4	156.6	172.4	47.1	0	0	0	0	111.8
1393	P	31.7	Very low	27.3	Very low	113.8 Å²	113.8	134 Å²	134	74%	0.739	79%	0.789	S	S	*	*			trans	-126.7	148.3	147.7	32.6	-18.4	0	0	0	114.7	T1391	T1391-P1393 WeakPolarHBondContact O-CD 3.43Å
1394	T	26.8	Very low	27.2	Very low	128 Å²	128	129 Å²	129	79%	0.785	78%	0.782	S	S	*	*			trans	39.1	127.2	150	35.9	0	0	0	0	116.9	I1396	T1394-I1396 PolarHBondContact O-N 3.14Å
1395	S	24.2	Very low	27.1	Very low	102.8 Å²	102.8	127.6 Å²	127.6	72%	0.719	78%	0.778	S	S	*	*				-61.1	135.1	129.8	55.3	0	0	0	0	114
1396	I	27.5	Very low	26.9	Very low	153.8 Å²	153.8	132.2 Å²	132.2	79%	0.789	78%	0.784	S	S	*	*			trans	170.2	133.8	147.1	-73.9	153.4	0	0	0	113	T1394	T1394-I1396 PolarHBondContact O-N 3.14Å
1397	Q	24.9	Very low	26.6	Very low	179.6 Å²	179.6	131.6 Å²	131.6	84%	0.839	78%	0.784	S	S	*	*			trans	-30	138.7	175.6	-67	154	-28.3	0	0	115.7	S1399	Q1397-S1399 PolarHBondContact O-N 3.29Å
1398	S	25.2	Very low	26.7	Very low	116.2 Å²	116.2	128.4 Å²	128.4	81%	0.813	78%	0.776	S	S	*	*			trans	-126.2	138	138.3	54	0	0	0	0	112.8
1399	S	24.4	Very low	26.4	Very low	108.2 Å²	108.2	128.6 Å²	128.6	76%	0.757	78%	0.778	S	S	*	*			trans	-115.1	135.4	162	56.4	0	0	0	0	110.9	Q1397 S1401	Q1397-S1399 PolarHBondContact O-N 3.29Å; S1399-S1401 PolarHBondContact O-N 3.25Å
1400	P	30.4	Very low	26.3	Very low	117.8 Å²	117.8	127.7 Å²	127.7	77%	0.765	78%	0.778	S	S	*	*			trans	-100.9	144.2	161	29.4	-19.1	0	0	0	112.5	T1402	P1400-T1402 PolarHBondContact O-N 3.14Å
1401	S	26.3	Very low	26	Very low	108.8 Å²	108.8	126.1 Å²	126.1	76%	0.761	77%	0.774	S	S	*	*			trans	-54.7	122.5	167.2	58.5	0	0	0	0	111.7	S1399 F1403	S1399-S1401 PolarHBondContact O-N 3.25Å; S1401-F1403 PolarHBondContact O-N 2.98Å
1402	T	24.7	Very low	25.7	Very low	136.6 Å²	136.6	130.3 Å²	130.3	84%	0.838	77%	0.774	S	S	*	*			trans	-20.3	101.3	158.9	-55.8	0	0	0	0	114	P1400 G1404	P1400-T1402 PolarHBondContact O-N 3.14Å; T1402-G1404 PolarHBondContact O-N 3.19Å
1403	F	25.8	Very low	25.8	Very low	194.6 Å²	194.6	132.1 Å²	132.1	85%	0.854	77%	0.774	S	S	*	*			trans	-98.1	110.4	161.9	-137.3	-91.2	0	0	0	110.7	S1401 V1405	S1401-F1403 PolarHBondContact O-N 2.98Å; F1403-V1405 VanDerWaalsContact C-N 3.28Å; F1403-V1405 HydrophobicContact CD1-CG2 4Å; F1403-V1405 HydrophobicContact CE1-CG2 3.73Å; F1403-V1405 PolarHBondContact O-N 2.88Å; F1403-V1405 VanDerWaalsContact O-N 3.08Å
1404	G	24.2	Very low	25.5	Very low	61.6 Å²	61.6	132.6 Å²	132.6	64%	0.635	77%	0.771	S	S	*	*			trans	-63.1	87.3	173	0	0	0	0	0	112.8	T1402 Y1406	T1402-G1404 PolarHBondContact O-N 3.19Å; G1404-Y1406 VanDerWaalsContact C-N 3.35Å; G1404-Y1406 PolarHBondContact O-N 3.24Å; G1404-Y1406 VanDerWaalsContact O-N 3.11Å
1405	V	24.4	Very low	25.5	Very low	114.8 Å²	114.8	137.2 Å²	137.2	70%	0.696	78%	0.775	S	S	*	*			trans	-76	110.8	169.4	176.6	0	0	0	0	108.8	F1403 S1407	F1403-V1405 VanDerWaalsContact C-N 3.28Å; F1403-V1405 HydrophobicContact CD1-CG2 4Å; F1403-V1405 HydrophobicContact CE1-CG2 3.73Å; F1403-V1405 PolarHBondContact O-N 2.88Å; F1403-V1405 VanDerWaalsContact O-N 3.08Å; V1405-S1407 VanDerWaalsContact C-N 3.34Å; V1405-S1407 PolarHBondContact O-N 3.36Å; V1405-S1407 PolarHBondContact O-OG 3.07Å
1406	Y	25.9	Very low	25.7	Very low	222.6 Å²	222.6	139.2 Å²	139.2	87%	0.873	78%	0.776	S	S	*	*			trans	-80.1	111.2	157.7	-76.8	-80.5	0	0	0	109	G1404 S1408	G1404-Y1406 VanDerWaalsContact C-N 3.35Å; G1404-Y1406 PolarHBondContact O-N 3.24Å; G1404-Y1406 VanDerWaalsContact O-N 3.11Å; Y1406-S1408 PolarHBondContact O-N 3.1Å; Y1406-S1408 VanDerWaalsContact O-N 3.11Å
1407	S	22.8	Very low	25.6	Very low	108.4 Å²	108.4	139.7 Å²	139.7	76%	0.758	78%	0.775	S	S	*	*			trans	-72	96.5	177.7	-52	0	0	0	0	109.4	V1405 S1409	V1405-S1407 VanDerWaalsContact C-N 3.34Å; V1405-S1407 PolarHBondContact O-N 3.36Å; V1405-S1407 PolarHBondContact O-OG 3.07Å; S1407-S1409 VanDerWaalsContact C-N 3.25Å; S1407-S1409 PolarHBondContact O-N 3.08Å
1408	S	25.7	Very low	25.9	Very low	102 Å²	102	137.2 Å²	137.2	71%	0.713	77%	0.774	S	S	*	*			trans	-86.4	112.5	159	55.6	0	0	0	0	107.7	Y1406 T1410	Y1406-S1408 PolarHBondContact O-N 3.1Å; Y1406-S1408 VanDerWaalsContact O-N 3.11Å; S1408-T1410 PolarHBondContact O-N 3.01Å; S1408-T1410 VanDerWaalsContact O-N 3.08Å; S1408-T1410 PolarHBondContact O-OG1 3.48Å
1409	S	24.6	Very low	26.4	Very low	119.6 Å²	119.6	136.2 Å²	136.2	84%	0.836	77%	0.768	S	S	*	*			trans	-61.7	91.4	174.9	-42.6	0	0	0	0	110.3	S1407 A1411	S1407-S1409 VanDerWaalsContact C-N 3.25Å; S1407-S1409 PolarHBondContact O-N 3.08Å; S1409-A1411 PolarHBondContact O-N 2.97Å; S1409-A1411 VanDerWaalsContact O-N 3.16Å
1410	T	25.5	Very low	27.1	Very low	131.2 Å²	131.2	137.2 Å²	137.2	81%	0.805	77%	0.769	S	S	*	*			trans	-66.4	93.6	163.2	-0.7	0	0	0	0	107.4	S1408 R1412	S1408-T1410 PolarHBondContact O-N 3.01Å; S1408-T1410 VanDerWaalsContact O-N 3.08Å; S1408-T1410 PolarHBondContact O-OG1 3.48Å; T1410-R1412 PolarHBondContact O-N 3.21Å; T1410-R1412 VanDerWaalsContact O-N 3.13Å
1411	A	26.3	Very low	28	Very low	82 Å²	82	134.8 Å²	134.8	68%	0.678	76%	0.755	S	S	*	*			trans	-52	121	166	0	0	0	0	0	108.1	S1409 I1413	S1409-A1411 PolarHBondContact O-N 2.97Å; S1409-A1411 VanDerWaalsContact O-N 3.16Å; A1411-I1413 HydrophobicContact CB-CG1 4.12Å; A1411-I1413 PolarHBondContact O-N 3.08Å; A1411-I1413 VanDerWaalsContact O-N 3.15Å
1412	R	23.4	Very low	30	Very low	225.2 Å²	225.2	137.7 Å²	137.7	85%	0.85	75%	0.751	S	S	*	*			trans	-52.6	107.5	166	-81.5	-179.3	-178.6	165.8	0.1	107.5	T1410 D1414	T1410-R1412 PolarHBondContact O-N 3.21Å; T1410-R1412 VanDerWaalsContact O-N 3.13Å; R1412-D1414 PolarHBondContact O-N 3.17Å; R1412-D1414 VanDerWaalsContact O-N 3.09Å
1413	I	27.3	Very low	32.6	Very low	146.4 Å²	146.4	132.4 Å²	132.4	75%	0.751	72%	0.717	S	S	*	*			trans	-75.2	91.5	161.6	-62.1	172.9	0	0	0	103.8	A1411 Y1415	A1411-I1413 HydrophobicContact CB-CG1 4.12Å; A1411-I1413 PolarHBondContact O-N 3.08Å; A1411-I1413 VanDerWaalsContact O-N 3.15Å; I1413-Y1415 VanDerWaalsContact C-N 3.26Å; I1413-Y1415 PolarHBondContact O-N 3.15Å
1414	D	25.2	Very low	35.4	Very low	124.8 Å²	124.8	128.3 Å²	128.3	67%	0.667	70%	0.699	S	S	*	*			trans	-54.4	123.6	167.3	-72.1	-32.6	0	0	0	107.7	R1412 I1416	R1412-D1414 PolarHBondContact O-N 3.17Å; R1412-D1414 VanDerWaalsContact O-N 3.09Å; D1414-I1416 VanDerWaalsContact C-N 3.31Å; D1414-I1416 PolarHBondContact O-N 2.86Å
1415	Y	27.1	Very low	38.5	Very low	224 Å²	224	127 Å²	127	88%	0.878	68%	0.676	S	S	*	*			trans	-54.4	91	174.7	-85	-98.7	0	0	0	109.7	I1413 Q1417	I1413-Y1415 VanDerWaalsContact C-N 3.26Å; I1413-Y1415 PolarHBondContact O-N 3.15Å; Y1415-Q1417 VanDerWaalsContact C-N 3.32Å; Y1415-Q1417 HydrophobicContact CD1-CB 4.49Å; Y1415-Q1417 HydrophobicContact CD1-CG 4.49Å; Y1415-Q1417 PolarHBondContact O-N 3Å; Y1415-Q1417 VanDerWaalsContact O-N 3.16Å
1416	I	29.1	Very low	41.8	Very low	145.6 Å²	145.6	121.6 Å²	121.6	75%	0.747	64%	0.643	S	S	*	*			trans	-69.2	99.7	161.4	-60.8	174.6	0	0	0	105	D1414	D1414-I1416 VanDerWaalsContact C-N 3.31Å; D1414-I1416 PolarHBondContact O-N 2.86Å
1417	Q	24.8	Very low	45	Very low	163.6 Å²	163.6	115.6 Å²	115.6	76%	0.764	62%	0.619	S	S	*	*			trans	-51.7	132.4	164.1	-77.3	-158.8	-25.8	0	0	108.2	Y1415 S1419	Y1415-Q1417 VanDerWaalsContact C-N 3.32Å; Y1415-Q1417 HydrophobicContact CD1-CB 4.49Å; Y1415-Q1417 HydrophobicContact CD1-CG 4.49Å; Y1415-Q1417 PolarHBondContact O-N 3Å; Y1415-Q1417 VanDerWaalsContact O-N 3.16Å; Q1417-S1419 VanDerWaalsContact C-N 3.33Å; Q1417-S1419 WeakPolarHBondContact O-CA 3.44Å; Q1417-S1419 PolarHBondContact O-N 3.2Å
1418	P	31.8	Very low	48.4	Very low	126.2 Å²	126.2	110.7 Å²	110.7	82%	0.819	58%	0.584	S	S	*	*			trans	-60.4	97.4	179.2	18.3	-21.8	0	0	0	108.1	T1420	P1418-T1420 PolarHBondContact O-N 3.26Å; P1418-T1420 VanDerWaalsContact O-N 3.13Å
1419	S	34.1	Very low	51.8	Low	97 Å²	97	108 Å²	108	68%	0.678	56%	0.561	S	S	*	*			trans	-62.9	113.7	178.9	53.1	0	0	0	0	107.2	Q1417 S1421	Q1417-S1419 VanDerWaalsContact C-N 3.33Å; Q1417-S1419 WeakPolarHBondContact O-CA 3.44Å; Q1417-S1419 PolarHBondContact O-N 3.2Å; S1419-S1421 VanDerWaalsContact C-N 3.3Å; S1419-S1421 PolarHBondContact O-N 3.23Å
1420	T	39.7	Very low	55.2	Low	127.6 Å²	127.6	104.8 Å²	104.8	78%	0.783	53%	0.533	S	S	*	.			trans	7.7	108.3	169.6	57	0	0	0	0	112.2	P1418 Y1422	P1418-T1420 PolarHBondContact O-N 3.26Å; P1418-T1420 VanDerWaalsContact O-N 3.13Å; T1420-Y1422 PolarHBondContact O-N 3.27Å
1421	S	49.4	Very low	58.6	Low	68 Å²	68	99 Å²	99	48%	0.476	50%	0.497	S	S	.	.			trans	-47.4	105.7	178.5	50	0	0	0	0	110.4	S1419 I1423	S1419-S1421 VanDerWaalsContact C-N 3.3Å; S1419-S1421 PolarHBondContact O-N 3.23Å; S1421-I1423 VanDerWaalsContact C-N 3.28Å; S1421-I1423 PolarHBondContact O-N 3.11Å; S1421-I1423 VanDerWaalsContact O-N 3.07Å
1422	Y	67.6	Low	62	Low	170.4 Å²	170.4	100.4 Å²	100.4	67%	0.668	49%	0.488	S	S	*	.			trans	-73.4	95.4	-179.3	-179.2	-98.1	0	0	0	109.1	T1420 K1424	T1420-Y1422 PolarHBondContact O-N 3.27Å; Y1422-K1424 PolarHBondContact O-N 3.05Å
1423	I	80.5	Confident	65.6	Low	25.4 Å²	25.4	94.1 Å²	94.1	13%	0.13	47%	0.467	C	S	.	.	P	Polyproline II helix	trans	-68.8	130	174.1	-96.6	166	0	0	0	108.8	T1317 N1320 S1421 Q1425 A1533 E1535	T1317-I1423 HydrophobicContact CG2-CD1 3.69Å; N1320-I1423 WeakPolarHBondContact OD1-CG2 3.47Å; S1421-I1423 VanDerWaalsContact C-N 3.28Å; S1421-I1423 PolarHBondContact O-N 3.11Å; S1421-I1423 VanDerWaalsContact O-N 3.07Å; I1423-Q1425 PolarHBondContact O-N 2.91Å; I1423-A1533 HydrophobicContact CD1-CB 4.04Å; I1423-A1533 HydrophobicContact CG1-CB 3.65Å; I1423-A1533 HydrophobicContact CG2-CB 3.65Å; I1423-E1535 HydrophobicContact CD1-CG 3.77Å; I1423-E1535 WeakPolarHBondContact CD1-OE1 3.36Å; I1423-E1535 HydrophobicContact CG1-CG 4.19Å
1424	K	85.2	Confident	68.9	Low	107.6 Å²	107.6	88.5 Å²	88.5	47%	0.468	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-67.6	142.4	179.4	-70.2	173.5	-178.8	164.9	0	109.9	N1320 Y1422 A1533 R1570	N1320-K1424 PolarHBondContact ND2-O 3.09Å; Y1422-K1424 PolarHBondContact O-N 3.05Å; K1424-A1533 VanDerWaalsContact O-CB 3.25Å; K1424-A1533 WeakPolarHBondContact O-CB 3.31Å; K1424-R1570 VanDerWaalsContact CB-NH2 3.32Å; K1424-R1570 VanDerWaalsContact CD-NH2 3.31Å; K1424-R1570 PolarHBondContact O-NH2 2.96Å
1425	Q	89.3	Confident	72.3	Confident	35 Å²	35	83.5 Å²	83.5	16%	0.164	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-59.2	147.8	-179.2	-61.5	175.9	-22.3	0	0	113.4	P1321 I1423 R1427 R1570	P1321-Q1425 HydrophobicContact CB-CG 4.03Å; P1321-Q1425 HydrophobicContact CG-CB 4.4Å; P1321-Q1425 HydrophobicContact CG-CG 3.81Å; P1321-Q1425 CarbonylContact O-C 3.54Å; P1321-Q1425 VanDerWaalsContact O-CA 3.3Å; P1321-Q1425 WeakPolarHBondContact O-CA 3.39Å; P1321-Q1425 WeakPolarHBondContact O-CB 3.2Å; I1423-Q1425 PolarHBondContact O-N 2.91Å; Q1425-R1427 VanDerWaalsContact CB-NH1 3.28Å; Q1425-R1427 PolarHBondContact O-NH1 3.27Å; Q1425-R1427 VanDerWaalsContact O-NH1 3.13Å; Q1425-R1570 PolarHBondContact O-NH1 2.83Å; Q1425-R1570 PolarHBondContact O-NH2 2.88Å
1426	D	92.8	Very high	75.6	Confident	0 Å²	0	74.6 Å²	74.6	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	159.3	174.5	-67.8	-17	0	0	0	111.8	H1306 R1307 N1320 P1321 S1322 W1323 L1532 A1533	H1306-D1426 IonicContact CD2-OD2 3.41Å; H1306-D1426 IonicContact CE1-OD2 3.21Å; H1306-D1426 IonicContact NE2-OD2 3.12Å; H1306-D1426 PolarHBondContact NE2-OD2 3.18Å; R1307-D1426 IonicContact CZ-OD1 3.34Å; R1307-D1426 IonicContact CZ-OD2 3.21Å; R1307-D1426 VanDerWaalsContact CZ-OD2 3.25Å; R1307-D1426 IonicContact NE-OD2 3.37Å; R1307-D1426 PolarHBondContact NE-OD2 3.26Å; R1307-D1426 IonicContact NH1-OD1 3.54Å; R1307-D1426 PolarHBondContact NH1-OD1 3.17Å; R1307-D1426 IonicContact NH1-OD2 2.75Å; R1307-D1426 PolarHBondContact NH1-OD2 2.78Å; R1307-D1426 IonicContact NH2-OD1 3.53Å; R1307-D1426 PolarHBondContact NH2-OD1 3.15Å; R1307-D1426 IonicContact NH2-OD2 3.11Å; R1307-D1426 PolarHBondContact NH2-OD2 3.17Å; N1320-D1426 PolarHBondContact ND2-N 2.94Å; N1320-D1426 PolarHBondContact ND2-OD1 3.1Å; P1321-D1426 PolarHBondContact O-N 2.95Å; S1322-D1426 WeakPolarHBondContact CA-O 3.38Å; W1323-D1426 PolarHBondContact N-O 2.86Å; D1426-L1532 HydrophobicContact CB-CD2 4.06Å; D1426-L1532 VanDerWaalsContact OD1-CA 3.28Å; D1426-L1532 WeakPolarHBondContact OD1-CA 3.29Å; D1426-L1532 WeakPolarHBondContact OD2-CD2 3.38Å; D1426-A1533 PolarHBondContact OD1-N 3.02Å
1427	R	93	Very high	78.8	Confident	98 Å²	98	67.9 Å²	67.9	37%	0.37	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	123.2	179.4	-61.3	-106.8	179	-127.1	4.9	109.5	Q1425 K1530 A1531	Q1425-R1427 VanDerWaalsContact CB-NH1 3.28Å; Q1425-R1427 PolarHBondContact O-NH1 3.27Å; Q1425-R1427 VanDerWaalsContact O-NH1 3.13Å; R1427-K1530 CarbonylContact O-C 3.55Å; R1427-K1530 WeakPolarHBondContact O-CA 3.3Å; R1427-A1531 HydrophobicContact CB-CB 4.27Å; R1427-A1531 PolarHBondContact N-O 3.16Å; R1427-A1531 VanDerWaalsContact N-O 3.15Å; R1427-A1531 PolarHBondContact O-N 3Å
1428	I	94.7	Very high	82.1	Confident	5 Å²	5	60.4 Å²	60.4	3%	0.026	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	123.1	-177.9	-54.8	174.1	0	0	0	107.3	H1306 W1323 E1324 F1325 H1430 I1529 K1530	H1306-I1428 HydrophobicContact CB-CD1 3.82Å; W1323-I1428 PolarHBondContact O-N 3.26Å; E1324-I1428 CarbonylContact C-O 3.45Å; E1324-I1428 VanDerWaalsContact CA-O 3.27Å; E1324-I1428 WeakPolarHBondContact CA-O 3.32Å; E1324-I1428 HydrophobicContact CB-CB 4.45Å; E1324-I1428 HydrophobicContact CG-CB 4.16Å; E1324-I1428 HydrophobicContact CG-CD1 4.19Å; F1325-I1428 PolarHBondContact N-O 3.12Å; I1428-H1430 WeakPolarHBondContact CG2-CE1 3.5Å; I1428-H1430 WeakPolarHBondContact CG2-ND1 3.49Å; I1428-H1430 VanDerWaalsContact CG2-NE2 3.31Å; I1428-H1430 WeakPolarHBondContact CG2-NE2 3.16Å; I1428-I1529 CarbonylContact C-O 3.56Å; I1428-I1529 WeakPolarHBondContact CA-O 3.41Å; I1428-K1530 HydrophobicContact CG2-CG 4.46Å
1429	I	95.6	Very high	85.1	Confident	45 Å²	45	56.1 Å²	56.1	23%	0.231	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	127.5	-176.9	-55.4	174.2	0	0	0	108.1	F1325 M1327 I1431 K1528 I1529	F1325-I1429 HydrophobicContact CB-CG1 4.39Å; F1325-I1429 HydrophobicContact CB-CG2 4.45Å; F1325-I1429 HydrophobicContact CD2-CG1 4.11Å; F1325-I1429 CarbonylContact O-C 3.49Å; F1325-I1429 WeakPolarHBondContact O-CA 3.39Å; M1327-I1429 HydrophobicContact CE-CG2 4.32Å; I1429-I1431 HydrophobicContact CG2-CD1 3.97Å; I1429-I1431 HydrophobicContact CG2-CG1 3.83Å; I1429-K1528 CarbonylContact O-C 3.57Å; I1429-K1528 WeakPolarHBondContact O-CA 3.37Å; I1429-I1529 HydrophobicContact CB-CB 4.34Å; I1429-I1529 HydrophobicContact CB-CD1 3.97Å; I1429-I1529 HydrophobicContact CD1-CD1 4.31Å; I1429-I1529 HydrophobicContact CG2-CD1 4.2Å; I1429-I1529 PolarHBondContact N-O 3Å; I1429-I1529 PolarHBondContact O-N 3Å
1430	H	97.2	Very high	87.9	Confident	52.8 Å²	52.8	51.5 Å²	51.5	24%	0.244	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	122.8	175.7	-66	-77.6	0	0	0	109	F1325 Y1326 M1327 I1428 L1527 K1528	F1325-H1430 PolarHBondContact O-N 2.96Å; Y1326-H1430 CarbonylContact C-O 3.53Å; Y1326-H1430 VanDerWaalsContact CA-O 3.29Å; Y1326-H1430 WeakPolarHBondContact CA-O 3.4Å; Y1326-H1430 HydrophobicContact CD1-CB 3.4Å; Y1326-H1430 VanDerWaalsContact CD1-CB 3.4Å; Y1326-H1430 AromaticContact CD1-CG 3.7Å; Y1326-H1430 AromaticContact CD1-ND1 3.82Å; Y1326-H1430 HydrophobicContact CD2-CB 3.9Å; Y1326-H1430 HydrophobicContact CE1-CB 3.76Å; Y1326-H1430 AromaticContact CE1-CE1 3.76Å; Y1326-H1430 AromaticContact CE1-CG 3.46Å; Y1326-H1430 VanDerWaalsContact CE1-CG 3.46Å; Y1326-H1430 AromaticContact CE1-ND1 3.23Å; Y1326-H1430 WeakPolarHBondContact CE1-ND1 3.12Å; Y1326-H1430 HydrophobicContact CG-CB 4.26Å; Y1326-H1430 AromaticContact CZ-ND1 3.75Å; M1327-H1430 PolarHBondContact N-O 3.09Å; I1428-H1430 WeakPolarHBondContact CG2-CE1 3.5Å; I1428-H1430 WeakPolarHBondContact CG2-ND1 3.49Å; I1428-H1430 VanDerWaalsContact CG2-NE2 3.31Å; I1428-H1430 WeakPolarHBondContact CG2-NE2 3.16Å; H1430-L1527 CarbonylContact C-O 3.53Å; H1430-L1527 WeakPolarHBondContact CA-O 3.33Å; H1430-K1528 VanDerWaalsContact CD2-CG 3.49Å; H1430-K1528 WeakPolarHBondContact CD2-CG 3.46Å; H1430-K1528 WeakPolarHBondContact ND1-CG 3.27Å
1431	I	96.9	Very high	90.4	Very high	9.2 Å²	9.2	46.4 Å²	46.4	5%	0.047	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	116.5	-179.8	-48.1	-173.3	0	0	0	107.7	M1327 L1330 I1429 K1433 F1434 N1526 L1527	M1327-I1431 HydrophobicContact CE-CD1 4.31Å; M1327-I1431 HydrophobicContact CE-CG1 4.17Å; M1327-I1431 HydrophobicContact CG-CB 4.18Å; M1327-I1431 HydrophobicContact CG-CD1 4.42Å; M1327-I1431 HydrophobicContact CG-CG1 3.92Å; M1327-I1431 HydrophobicContact CG-CG2 3.78Å; M1327-I1431 WeakPolarHBondContact O-CA 3.36Å; M1327-I1431 HydrophobicContact SD-CD1 3.97Å; M1327-I1431 HydrophobicContact SD-CG1 4.03Å; M1327-I1431 HydrophobicContact SD-CG2 4.43Å; L1330-I1431 HydrophobicContact CB-CD1 4.44Å; L1330-I1431 HydrophobicContact CB-CG2 4.13Å; L1330-I1431 HydrophobicContact CD2-CD1 4.02Å; I1429-I1431 HydrophobicContact CG2-CD1 3.97Å; I1429-I1431 HydrophobicContact CG2-CG1 3.83Å; I1431-K1433 VanDerWaalsContact C-N 3.32Å; I1431-K1433 VanDerWaalsContact CG2-C 3.5Å; I1431-K1433 VanDerWaalsContact CG2-O 3.27Å; I1431-K1433 WeakPolarHBondContact CG2-O 3.32Å; I1431-K1433 PolarHBondContact O-N 2.71Å; I1431-F1434 HydrophobicContact CD1-CB 4.46Å; I1431-F1434 HydrophobicContact CG2-CB 3.96Å; I1431-N1526 CarbonylContact O-C 3.53Å; I1431-N1526 WeakPolarHBondContact O-CA 3.28Å; I1431-L1527 HydrophobicContact CB-CB 4.34Å; I1431-L1527 HydrophobicContact CD1-CD2 4.22Å; I1431-L1527 PolarHBondContact N-O 3.25Å; I1431-L1527 PolarHBondContact O-N 2.89Å
1432	K	97.8	Very high	92.4	Very high	111 Å²	111	45.7 Å²	45.7	48%	0.483	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	-38.2	177.3	-68.6	-175.5	178.6	144.1	0	111.9	Y1326 M1327 D1328 N1526	Y1326-K1432 VanDerWaalsContact OH-CE 3.24Å; Y1326-K1432 WeakPolarHBondContact OH-CE 3.44Å; Y1326-K1432 PolarHBondContact OH-NZ 3.2Å; Y1326-K1432 VanDerWaalsContact OH-NZ 3.15Å; M1327-K1432 PolarHBondContact O-N 3.18Å; M1327-K1432 VanDerWaalsContact O-N 3.07Å; D1328-K1432 HydrophobicContact CB-CD 4.35Å; D1328-K1432 WeakPolarHBondContact O-CB 3.35Å; D1328-K1432 VanDerWaalsContact OD1-CD 3.26Å; D1328-K1432 WeakPolarHBondContact OD1-CD 3.24Å; D1328-K1432 VanDerWaalsContact OD1-CE 3.27Å; D1328-K1432 WeakPolarHBondContact OD1-CE 3.32Å; D1328-K1432 IonicContact OD1-NZ 3.39Å; D1328-K1432 PolarHBondContact OD1-NZ 2.98Å; D1328-K1432 IonicContact OD2-NZ 3.24Å; K1432-N1526 PolarHBondContact O-N 2.9Å
1433	K	97.9	Very high	93.5	Very high	93.8 Å²	93.8	44.2 Å²	44.2	41%	0.408	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	121.9	175.7	-164.3	167.7	-165.9	173.8	0	111	D1328 L1329 L1330 I1431 I1435 D1525	D1328-K1433 PolarHBondContact O-N 3.33Å; L1329-K1433 CarbonylContact C-O 3.5Å; L1329-K1433 WeakPolarHBondContact CA-O 3.45Å; L1329-K1433 HydrophobicContact CD1-CB 3.95Å; L1329-K1433 HydrophobicContact CD1-CD 4.27Å; L1329-K1433 HydrophobicContact CD1-CG 4.09Å; L1330-K1433 PolarHBondContact N-O 3.26Å; I1431-K1433 VanDerWaalsContact C-N 3.32Å; I1431-K1433 VanDerWaalsContact CG2-C 3.5Å; I1431-K1433 VanDerWaalsContact CG2-O 3.27Å; I1431-K1433 WeakPolarHBondContact CG2-O 3.32Å; I1431-K1433 PolarHBondContact O-N 2.71Å; K1433-I1435 HydrophobicContact CD-CD1 4.04Å; K1433-I1435 HydrophobicContact CD-CG1 4.46Å; K1433-I1435 HydrophobicContact CG-CD1 4.11Å; K1433-I1435 HydrophobicContact CG-CG1 4.02Å; K1433-D1525 WeakPolarHBondContact CD-OD1 3.38Å; K1433-D1525 WeakPolarHBondContact CE-OD1 3.49Å; K1433-D1525 IonicContact NZ-OD1 3.27Å; K1433-D1525 PolarHBondContact NZ-OD1 2.8Å
1434	F	97.3	Very high	93.8	Very high	28.6 Å²	28.6	46.1 Å²	46.1	13%	0.125	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	124.9	175.5	176.3	-141.2	0	0	0	109.4	L1330 V1332 I1431 I1436 F1522 T1523 M1524 L1527	L1330-F1434 HydrophobicContact CB-CD2 3.91Å; L1330-F1434 HydrophobicContact CD2-CD2 3.68Å; L1330-F1434 HydrophobicContact CD2-CE2 3.65Å; L1330-F1434 HydrophobicContact CD2-CZ 4.47Å; L1330-F1434 HydrophobicContact CG-CD2 3.65Å; L1330-F1434 HydrophobicContact CG-CE2 3.83Å; L1330-F1434 CarbonylContact O-C 3.58Å; L1330-F1434 WeakPolarHBondContact O-CA 3.27Å; V1332-F1434 HydrophobicContact CG2-CE2 4.33Å; I1431-F1434 HydrophobicContact CD1-CB 4.46Å; I1431-F1434 HydrophobicContact CG2-CB 3.96Å; F1434-I1436 HydrophobicContact CE1-CD1 4.16Å; F1434-I1436 HydrophobicContact CE1-CG1 4.26Å; F1434-I1436 HydrophobicContact CE2-CD1 4.28Å; F1434-I1436 HydrophobicContact CE2-CG1 3.83Å; F1434-I1436 HydrophobicContact CZ-CD1 3.64Å; F1434-I1436 HydrophobicContact CZ-CG1 3.62Å; F1434-F1522 HydrophobicContact CD1-CD1 4.31Å; F1434-F1522 AromaticContact CD1-CE1 3.78Å; F1434-F1522 HydrophobicContact CD1-CE1 3.78Å; F1434-F1522 HydrophobicContact CE1-CD1 4.31Å; F1434-F1522 AromaticContact CE1-CE1 3.68Å; F1434-F1522 HydrophobicContact CE1-CE1 3.68Å; F1434-F1522 HydrophobicContact CE1-CZ 4.4Å; F1434-T1523 CarbonylContact O-C 3.51Å; F1434-T1523 VanDerWaalsContact O-CA 3.26Å; F1434-T1523 WeakPolarHBondContact O-CA 3.3Å; F1434-M1524 HydrophobicContact CB-CB 4.26Å; F1434-M1524 HydrophobicContact CD1-CB 4.42Å; F1434-M1524 HydrophobicContact CD1-SD 4.22Å; F1434-M1524 PolarHBondContact N-O 3.04Å; F1434-M1524 PolarHBondContact O-N 3Å; F1434-L1527 HydrophobicContact CB-CD2 4.37Å; F1434-L1527 HydrophobicContact CD1-CD2 4.14Å; F1434-L1527 HydrophobicContact CG-CD2 4.49Å
1435	I	97.2	Very high	94.1	Very high	20 Å²	20	41.6 Å²	41.6	10%	0.103	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	133.1	-176.7	-53.3	180	0	0	0	109	L1329 L1330 Y1331 V1332 K1433 T1521 F1522 T1523	L1329-I1435 HydrophobicContact CD1-CD1 3.98Å; L1329-I1435 HydrophobicContact CD1-CG1 4.25Å; L1330-I1435 PolarHBondContact O-N 3.11Å; Y1331-I1435 WeakPolarHBondContact CA-O 3.37Å; Y1331-I1435 HydrophobicContact CD2-CB 3.8Å; Y1331-I1435 HydrophobicContact CD2-CD1 4.18Å; Y1331-I1435 HydrophobicContact CD2-CG1 4.41Å; Y1331-I1435 HydrophobicContact CD2-CG2 3.74Å; Y1331-I1435 HydrophobicContact CE2-CB 4.34Å; Y1331-I1435 HydrophobicContact CE2-CD1 4.36Å; Y1331-I1435 HydrophobicContact CE2-CG2 3.9Å; V1332-I1435 PolarHBondContact N-O 3.12Å; K1433-I1435 HydrophobicContact CD-CD1 4.04Å; K1433-I1435 HydrophobicContact CD-CG1 4.46Å; K1433-I1435 HydrophobicContact CG-CD1 4.11Å; K1433-I1435 HydrophobicContact CG-CG1 4.02Å; I1435-T1521 HydrophobicContact CG2-CG2 4.05Å; I1435-F1522 CarbonylContact C-O 3.49Å; I1435-F1522 VanDerWaalsContact CA-O 3.28Å; I1435-F1522 WeakPolarHBondContact CA-O 3.34Å; I1435-T1523 HydrophobicContact CG1-CG2 4.16Å; I1435-T1523 HydrophobicContact CG2-CG2 4.27Å
1436	I	96.3	Very high	94.1	Very high	36.4 Å²	36.4	45 Å²	45	19%	0.187	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	127.8	164.8	-48.6	169	0	0	0	107.6	V1332 F1334 F1434 T1521 F1522	V1332-I1436 HydrophobicContact CB-CG1 4.3Å; V1332-I1436 HydrophobicContact CB-CG2 4.34Å; V1332-I1436 HydrophobicContact CG1-CG2 4.37Å; V1332-I1436 CarbonylContact O-C 3.55Å; V1332-I1436 VanDerWaalsContact O-CA 3.28Å; V1332-I1436 WeakPolarHBondContact O-CA 3.28Å; F1334-I1436 HydrophobicContact CD2-CG2 4.32Å; F1334-I1436 HydrophobicContact CE2-CG2 3.9Å; F1434-I1436 HydrophobicContact CE1-CD1 4.16Å; F1434-I1436 HydrophobicContact CE1-CG1 4.26Å; F1434-I1436 HydrophobicContact CE2-CD1 4.28Å; F1434-I1436 HydrophobicContact CE2-CG1 3.83Å; F1434-I1436 HydrophobicContact CZ-CD1 3.64Å; F1434-I1436 HydrophobicContact CZ-CG1 3.62Å; I1436-T1521 WeakPolarHBondContact O-CA 3.44Å; I1436-F1522 HydrophobicContact CB-CB 4.06Å; I1436-F1522 HydrophobicContact CB-CD1 4.38Å; I1436-F1522 HydrophobicContact CB-CG 4.48Å; I1436-F1522 HydrophobicContact CD1-CB 4.13Å; I1436-F1522 HydrophobicContact CD1-CD1 3.98Å; I1436-F1522 HydrophobicContact CD1-CD2 4.16Å; I1436-F1522 HydrophobicContact CD1-CE1 4.36Å; I1436-F1522 HydrophobicContact CD1-CG 4.27Å; I1436-F1522 HydrophobicContact CG1-CB 4.25Å; I1436-F1522 HydrophobicContact CG1-CD1 4.05Å; I1436-F1522 HydrophobicContact CG1-CG 4.23Å; I1436-F1522 PolarHBondContact N-O 3.26Å; I1436-F1522 PolarHBondContact O-N 3.09Å
1437	E	95	Very high	94	Very high	6 Å²	6	49.3 Å²	49.3	3%	0.028	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	139.1	-177.6	-164.9	-169.9	172.2	0	0	110.6	Y1331 V1332 T1333 F1334 K1439 E1518 F1520 T1521	Y1331-E1437 HydrophobicContact CE2-CB 4.32Å; Y1331-E1437 WeakPolarHBondContact CE2-OE2 3.39Å; Y1331-E1437 VanDerWaalsContact CZ-OE2 3.28Å; Y1331-E1437 VanDerWaalsContact OH-CD 3.28Å; Y1331-E1437 PolarHBondContact OH-OE1 3.37Å; Y1331-E1437 PolarHBondContact OH-OE2 2.87Å; V1332-E1437 PolarHBondContact O-N 3.04Å; T1333-E1437 CarbonylContact C-O 3.51Å; T1333-E1437 VanDerWaalsContact CA-O 3.31Å; T1333-E1437 WeakPolarHBondContact CA-O 3.39Å; T1333-E1437 PolarHBondContact OG1-OE2 2.85Å; F1334-E1437 PolarHBondContact N-O 3.02Å; E1437-K1439 VanDerWaalsContact CD-CE 3.44Å; E1437-K1439 HydrophobicContact CG-CD 4.33Å; E1437-K1439 VanDerWaalsContact OE1-CD 3.26Å; E1437-K1439 WeakPolarHBondContact OE1-CD 3.37Å; E1437-K1439 VanDerWaalsContact OE1-CE 3.25Å; E1437-K1439 WeakPolarHBondContact OE1-CE 3.34Å; E1437-K1439 IonicContact OE1-NZ 2.89Å; E1437-K1439 PolarHBondContact OE1-NZ 3.06Å; E1437-K1439 WeakPolarHBondContact OE2-CE 3.4Å; E1437-K1439 IonicContact OE2-NZ 2.99Å; E1437-K1439 PolarHBondContact OE2-NZ 3.1Å; E1437-K1439 VanDerWaalsContact OE2-NZ 3.11Å; E1437-E1518 HydrophobicContact CG-CB 4.49Å; E1437-E1518 HydrophobicContact CG-CG 4.07Å; E1437-E1518 WeakPolarHBondContact OE1-CB 3.38Å; E1437-E1518 VanDerWaalsContact OE1-CG 3.23Å; E1437-E1518 WeakPolarHBondContact OE1-CG 3.33Å; E1437-F1520 CarbonylContact C-O 3.54Å; E1437-F1520 WeakPolarHBondContact CA-O 3.41Å; E1437-T1521 HydrophobicContact CG-CG2 4.33Å
1438	I	95.6	Very high	93.8	Very high	6 Å²	6	47.3 Å²	47.3	3%	0.031	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	123.1	171.7	-63.7	170.9	0	0	0	107.5	F1334 L1519 F1520 F1665 R1668 L1669 I1672	F1334-I1438 HydrophobicContact CB-CG1 4.26Å; F1334-I1438 HydrophobicContact CD2-CG1 4.06Å; F1334-I1438 HydrophobicContact CG-CG1 4.46Å; I1438-L1519 VanDerWaalsContact O-CB 3.31Å; I1438-L1519 WeakPolarHBondContact O-CB 3.34Å; I1438-L1519 PolarHBondContact O-N 2.93Å; I1438-F1520 HydrophobicContact CB-CB 4.42Å; I1438-F1520 HydrophobicContact CD1-CD1 4.22Å; I1438-F1520 HydrophobicContact CG1-CD1 4.38Å; I1438-F1520 PolarHBondContact N-O 3.14Å; I1438-F1520 PolarHBondContact O-N 3.04Å; I1438-F1665 HydrophobicContact CD1-CD2 4.25Å; I1438-F1665 HydrophobicContact CD1-CE2 3.63Å; I1438-F1665 HydrophobicContact CD1-CZ 4.46Å; I1438-R1668 HydrophobicContact CG2-CB 3.96Å; I1438-R1668 HydrophobicContact CG2-CG 4.22Å; I1438-L1669 HydrophobicContact CD1-CD2 3.82Å; I1438-L1669 HydrophobicContact CD1-CG 4.43Å; I1438-I1672 HydrophobicContact CD1-CD1 3.68Å; I1438-I1672 HydrophobicContact CG1-CD1 3.82Å; I1438-I1672 HydrophobicContact CG2-CD1 4.19Å
1439	K	94.4	Very high	93.5	Very high	34.8 Å²	34.8	48.1 Å²	48.1	15%	0.151	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	142.2	-178.3	-60	-55.9	-156	171.6	0	112.2	F1334 E1437 D1517 R1668	F1334-K1439 PolarHBondContact O-N 3.02Å; E1437-K1439 VanDerWaalsContact CD-CE 3.44Å; E1437-K1439 HydrophobicContact CG-CD 4.33Å; E1437-K1439 VanDerWaalsContact OE1-CD 3.26Å; E1437-K1439 WeakPolarHBondContact OE1-CD 3.37Å; E1437-K1439 VanDerWaalsContact OE1-CE 3.25Å; E1437-K1439 WeakPolarHBondContact OE1-CE 3.34Å; E1437-K1439 IonicContact OE1-NZ 2.89Å; E1437-K1439 PolarHBondContact OE1-NZ 3.06Å; E1437-K1439 WeakPolarHBondContact OE2-CE 3.4Å; E1437-K1439 IonicContact OE2-NZ 2.99Å; E1437-K1439 PolarHBondContact OE2-NZ 3.1Å; E1437-K1439 VanDerWaalsContact OE2-NZ 3.11Å; K1439-D1517 CarbonylContact C-O 3.43Å; K1439-D1517 VanDerWaalsContact CA-O 3.26Å; K1439-D1517 WeakPolarHBondContact CA-O 3.3Å; K1439-D1517 HydrophobicContact CD-CB 4.44Å; K1439-D1517 VanDerWaalsContact CD-CG 3.5Å; K1439-D1517 WeakPolarHBondContact CD-O 3.26Å; K1439-D1517 WeakPolarHBondContact CD-OD1 3.28Å; K1439-D1517 WeakPolarHBondContact CD-OD2 3.4Å; K1439-D1517 VanDerWaalsContact CE-OD1 3.3Å; K1439-D1517 WeakPolarHBondContact CE-OD1 3.41Å; K1439-D1517 VanDerWaalsContact CE-OD2 3.24Å; K1439-D1517 WeakPolarHBondContact CE-OD2 3.32Å; K1439-D1517 WeakPolarHBondContact CG-OD2 3.42Å; K1439-D1517 IonicContact NZ-OD1 3.57Å; K1439-D1517 PolarHBondContact NZ-OD1 3.14Å; K1439-D1517 IonicContact NZ-OD2 3.07Å; K1439-R1668 PolarHBondContact O-NE 3.46Å; K1439-R1668 VanDerWaalsContact O-NE 3.07Å; K1439-R1668 PolarHBondContact O-NH2 3.4Å
1440	D	93.7	Very high	93.3	Very high	0.8 Å²	0.8	48.3 Å²	48.3	0%	0.004	23%	0.232	C	C	.	.			trans	-83.8	177.7	175.5	-148	-23.9	0	0	0	111.8	Y1336 P1442 D1517 L1519 R1584 W1664	Y1336-D1440 VanDerWaalsContact CB-O 3.31Å; Y1336-D1440 WeakPolarHBondContact CB-O 3.27Å; Y1336-D1440 WeakPolarHBondContact CD2-O 3.1Å; Y1336-D1440 VanDerWaalsContact CG-O 3.26Å; D1440-P1442 VanDerWaalsContact O-CD 3.25Å; D1440-P1442 WeakPolarHBondContact O-CD 3.26Å; D1440-D1517 PolarHBondContact N-O 2.94Å; D1440-L1519 HydrophobicContact CB-CB 3.73Å; D1440-L1519 WeakPolarHBondContact OD2-CD1 3.31Å; D1440-R1584 VanDerWaalsContact CG-NH2 3.33Å; D1440-R1584 IonicContact OD1-NH2 3Å; D1440-R1584 PolarHBondContact OD1-NH2 3.09Å; D1440-R1584 IonicContact OD2-CZ 3.2Å; D1440-R1584 IonicContact OD2-NE 2.86Å; D1440-R1584 PolarHBondContact OD2-NE 3.09Å; D1440-R1584 IonicContact OD2-NH2 3.55Å; D1440-R1584 PolarHBondContact OD2-NH2 2.99Å; D1440-W1664 PolarHBondContact OD1-NE1 3.15Å
1441	D	91.7	Very high	93	Very high	21.4 Å²	21.4	50.5 Å²	50.5	11%	0.114	24%	0.242	C	C	.	.			trans	-71.4	115.6	172.6	-168.5	-28.4	0	0	0	110.7	Y1336 F1443 E1444 C1445 W1664 R1862	Y1336-D1441 HydrophobicContact CD1-CB 4.44Å; Y1336-D1441 HydrophobicContact CD2-CB 4.37Å; Y1336-D1441 HydrophobicContact CE1-CB 4.02Å; Y1336-D1441 VanDerWaalsContact CE1-CG 3.43Å; Y1336-D1441 WeakPolarHBondContact CE1-OD2 3.44Å; Y1336-D1441 HydrophobicContact CE2-CB 3.85Å; Y1336-D1441 VanDerWaalsContact CZ-CG 3.42Å; Y1336-D1441 VanDerWaalsContact CZ-OD2 3.29Å; Y1336-D1441 VanDerWaalsContact OH-CG 3.31Å; Y1336-D1441 PolarHBondContact OH-OD2 3.1Å; D1441-F1443 PolarHBondContact O-N 2.96Å; D1441-F1443 VanDerWaalsContact O-N 3.1Å; D1441-F1443 VanDerWaalsContact OD1-CB 3.32Å; D1441-F1443 WeakPolarHBondContact OD1-CB 3.45Å; D1441-F1443 PolarHBondContact OD1-N 3.14Å; D1441-E1444 HydrophobicContact CB-CB 4.25Å; D1441-E1444 HydrophobicContact CB-CG 4.3Å; D1441-E1444 PolarHBondContact O-N 3.15Å; D1441-C1445 PolarHBondContact O-N 3.13Å; D1441-C1445 VanDerWaalsContact O-N 3.12Å; D1441-C1445 PolarHBondContact O-SG 3.04Å; D1441-W1664 HydrophobicContact CB-CZ2 4.33Å; D1441-R1862 IonicContact OD2-CZ 3.33Å; D1441-R1862 VanDerWaalsContact OD2-CZ 3.27Å; D1441-R1862 IonicContact OD2-NH1 3.49Å; D1441-R1862 PolarHBondContact OD2-NH1 3.23Å; D1441-R1862 IonicContact OD2-NH2 3.09Å; D1441-R1862 PolarHBondContact OD2-NH2 3.2Å
1442	P	90.3	Very high	92.5	Very high	51.6 Å²	51.6	53.3 Å²	53.3	34%	0.335	26%	0.26	S	S	.	.	H	α-helix	trans	-57.4	-28.5	179.6	-25.6	35.8	0	0	0	113.4	Y1336 D1440 K1446 F1515	Y1336-P1442 VanDerWaalsContact CD1-CD 3.43Å; Y1336-P1442 HydrophobicContact CD1-CG 4.41Å; D1440-P1442 VanDerWaalsContact O-CD 3.25Å; D1440-P1442 WeakPolarHBondContact O-CD 3.26Å; P1442-K1446 VanDerWaalsContact O-CB 3.26Å; P1442-K1446 WeakPolarHBondContact O-CB 3.41Å; P1442-K1446 PolarHBondContact O-N 3.09Å; P1442-F1515 HydrophobicContact CB-CE1 4.02Å; P1442-F1515 HydrophobicContact CB-CE2 3.86Å; P1442-F1515 HydrophobicContact CB-CZ 4.06Å; P1442-F1515 WeakPolarHBondContact O-CZ 3.26Å
1443	F	90.8	Very high	92.1	Very high	140.8 Å²	140.8	48.6 Å²	48.6	62%	0.618	24%	0.24	S	C	*	.	H	α-helix	trans	-68.8	-42.6	175.7	175.6	-97.5	0	0	0	111.9	D1441 K1446 L1447	D1441-F1443 PolarHBondContact O-N 2.96Å; D1441-F1443 VanDerWaalsContact O-N 3.1Å; D1441-F1443 VanDerWaalsContact OD1-CB 3.32Å; D1441-F1443 WeakPolarHBondContact OD1-CB 3.45Å; D1441-F1443 PolarHBondContact OD1-N 3.14Å; F1443-K1446 PolarHBondContact O-N 3.17Å; F1443-L1447 HydrophobicContact CD1-CD1 3.92Å; F1443-L1447 HydrophobicContact CE1-CD1 3.33Å; F1443-L1447 HydrophobicContact CE1-CD2 4.35Å; F1443-L1447 HydrophobicContact CE1-CG 4.23Å; F1443-L1447 HydrophobicContact CE2-CD1 4.38Å; F1443-L1447 HydrophobicContact CZ-CD1 4Å; F1443-L1447 HydrophobicContact CZ-CG 4.17Å; F1443-L1447 VanDerWaalsContact O-CB 3.29Å; F1443-L1447 WeakPolarHBondContact O-CB 3.27Å; F1443-L1447 WeakPolarHBondContact O-CG 3.21Å; F1443-L1447 PolarHBondContact O-N 3.14Å
1444	E	88.2	Confident	91.8	Very high	65.2 Å²	65.2	47.5 Å²	47.5	31%	0.305	24%	0.238	S	C	.	.	H	α-helix	trans	-68.5	-41.2	177.1	-78.1	-168	-171.6	0	0	111.6	D1441 K1446 L1447 N1448 R1584 R1862	D1441-E1444 HydrophobicContact CB-CB 4.25Å; D1441-E1444 HydrophobicContact CB-CG 4.3Å; D1441-E1444 PolarHBondContact O-N 3.15Å; E1444-K1446 VanDerWaalsContact C-N 3.34Å; E1444-K1446 PolarHBondContact O-N 3.13Å; E1444-L1447 PolarHBondContact O-N 3.13Å; E1444-N1448 WeakPolarHBondContact O-CB 3.27Å; E1444-N1448 PolarHBondContact O-N 3.32Å; E1444-R1584 IonicContact OE2-CZ 3.01Å; E1444-R1584 IonicContact OE2-NH1 3.34Å; E1444-R1584 IonicContact OE2-NH2 3.49Å; E1444-R1584 PolarHBondContact OE2-NH2 3.14Å; E1444-R1584 VanDerWaalsContact OE2-NH2 3.17Å; E1444-R1862 VanDerWaalsContact CD-NH2 3.35Å; E1444-R1862 IonicContact OE1-CZ 3.84Å; E1444-R1862 VanDerWaalsContact OE1-CZ 3.26Å; E1444-R1862 IonicContact OE1-NE 3.11Å; E1444-R1862 PolarHBondContact OE1-NE 3.21Å; E1444-R1862 IonicContact OE1-NH2 3.18Å; E1444-R1862 PolarHBondContact OE1-NH2 3.2Å; E1444-R1862 IonicContact OE2-NE 3.81Å; E1444-R1862 IonicContact OE2-NH2 2.84Å
1445	C	90.3	Very high	91.4	Very high	12.6 Å²	12.6	50.7 Å²	50.7	9%	0.085	26%	0.256	C	S	.	.	H	α-helix	trans	-59	-48.9	174.7	-68.3	0	0	0	0	111.1	D1441 L1447 N1448 D1449 F1515 S1516	D1441-C1445 PolarHBondContact O-N 3.13Å; D1441-C1445 VanDerWaalsContact O-N 3.12Å; D1441-C1445 PolarHBondContact O-SG 3.04Å; C1445-L1447 VanDerWaalsContact C-N 3.3Å; C1445-L1447 PolarHBondContact O-N 2.88Å; C1445-N1448 WeakPolarHBondContact O-CA 3.18Å; C1445-N1448 WeakPolarHBondContact O-CB 3.33Å; C1445-N1448 PolarHBondContact O-N 3.12Å; C1445-N1448 VanDerWaalsContact O-N 3.14Å; C1445-D1449 VanDerWaalsContact O-CG 3.28Å; C1445-D1449 PolarHBondContact O-N 3.12Å; C1445-F1515 HydrophobicContact CB-CD2 4.09Å; C1445-F1515 HydrophobicContact CB-CE1 4.28Å; C1445-F1515 HydrophobicContact CB-CE2 3.95Å; C1445-F1515 HydrophobicContact CB-CZ 3.58Å; C1445-S1516 VanDerWaalsContact CB-O 3.31Å; C1445-S1516 WeakPolarHBondContact CB-O 3.33Å; C1445-S1516 PolarHBondContact SG-O 3.17Å; C1445-S1516 VanDerWaalsContact SG-O 3.33Å
1446	K	89.5	Confident	91	Very high	105.6 Å²	105.6	53.7 Å²	53.7	46%	0.459	27%	0.272	S	S	.	.	H	α-helix	trans	-61	-39.4	177.2	-168	173.8	-173.6	169.6	0	112.3	P1442 F1443 E1444 N1448 D1449 I1450 Y1510 F1515	P1442-K1446 VanDerWaalsContact O-CB 3.26Å; P1442-K1446 WeakPolarHBondContact O-CB 3.41Å; P1442-K1446 PolarHBondContact O-N 3.09Å; F1443-K1446 PolarHBondContact O-N 3.17Å; E1444-K1446 VanDerWaalsContact C-N 3.34Å; E1444-K1446 PolarHBondContact O-N 3.13Å; K1446-N1448 VanDerWaalsContact C-N 3.32Å; K1446-N1448 PolarHBondContact O-N 2.88Å; K1446-D1449 PolarHBondContact O-N 2.88Å; K1446-I1450 HydrophobicContact CG-CD1 4.03Å; K1446-I1450 VanDerWaalsContact O-CB 3.29Å; K1446-I1450 WeakPolarHBondContact O-CB 3.34Å; K1446-I1450 WeakPolarHBondContact O-CD1 3.38Å; K1446-I1450 WeakPolarHBondContact O-CG1 3.39Å; K1446-I1450 PolarHBondContact O-N 3.15Å; K1446-I1450 VanDerWaalsContact O-N 3.1Å; K1446-Y1510 HydrophobicContact CG-CE1 4.48Å; K1446-Y1510 HydrophobicContact CG-CE2 4.43Å; K1446-Y1510 VanDerWaalsContact CG-OH 3.27Å; K1446-Y1510 WeakPolarHBondContact CG-OH 3.3Å; K1446-Y1510 PolarHBondContact O-OH 3.15Å; K1446-F1515 HydrophobicContact CB-CE2 4.14Å; K1446-F1515 HydrophobicContact CB-CZ 4.42Å
1447	L	90.9	Very high	90.7	Very high	90 Å²	90	52.2 Å²	52.2	47%	0.471	26%	0.264	S	S	.	.	H	α-helix	trans	-65.1	-38.1	175.7	-158.3	83.4	0	0	0	111.8	F1443 E1444 C1445 I1450 H1451	F1443-L1447 HydrophobicContact CD1-CD1 3.92Å; F1443-L1447 HydrophobicContact CE1-CD1 3.33Å; F1443-L1447 HydrophobicContact CE1-CD2 4.35Å; F1443-L1447 HydrophobicContact CE1-CG 4.23Å; F1443-L1447 HydrophobicContact CE2-CD1 4.38Å; F1443-L1447 HydrophobicContact CZ-CD1 4Å; F1443-L1447 HydrophobicContact CZ-CG 4.17Å; F1443-L1447 VanDerWaalsContact O-CB 3.29Å; F1443-L1447 WeakPolarHBondContact O-CB 3.27Å; F1443-L1447 WeakPolarHBondContact O-CG 3.21Å; F1443-L1447 PolarHBondContact O-N 3.14Å; E1444-L1447 PolarHBondContact O-N 3.13Å; C1445-L1447 VanDerWaalsContact C-N 3.3Å; C1445-L1447 PolarHBondContact O-N 2.88Å; L1447-I1450 PolarHBondContact O-N 3.22Å; L1447-H1451 VanDerWaalsContact O-CB 3.28Å; L1447-H1451 WeakPolarHBondContact O-CB 3.29Å; L1447-H1451 PolarHBondContact O-N 2.97Å
1448	N	88.5	Confident	90.4	Very high	56.4 Å²	56.4	57 Å²	57	30%	0.302	29%	0.285	S	S	.	.	H	α-helix	trans	-64.9	-44.1	175.7	-174.9	66.5	0	0	0	111.9	E1444 C1445 K1446 H1451 T1452	E1444-N1448 WeakPolarHBondContact O-CB 3.27Å; E1444-N1448 PolarHBondContact O-N 3.32Å; C1445-N1448 WeakPolarHBondContact O-CA 3.18Å; C1445-N1448 WeakPolarHBondContact O-CB 3.33Å; C1445-N1448 PolarHBondContact O-N 3.12Å; C1445-N1448 VanDerWaalsContact O-N 3.14Å; K1446-N1448 VanDerWaalsContact C-N 3.32Å; K1446-N1448 PolarHBondContact O-N 2.88Å; N1448-H1451 PolarHBondContact O-N 3.13Å; N1448-T1452 VanDerWaalsContact O-CB 3.3Å; N1448-T1452 WeakPolarHBondContact O-CB 3.32Å; N1448-T1452 PolarHBondContact O-N 3.02Å; N1448-T1452 PolarHBondContact O-OG1 3.13Å
1449	D	88.9	Confident	90.2	Very high	22 Å²	22	58.9 Å²	58.9	12%	0.118	30%	0.302	C	S	.	.	H	α-helix	trans	-61.8	-47.8	175.7	-66.6	-14.5	0	0	0	111	C1445 K1446 H1451 T1452 I1453 F1509 Y1510 F1515	C1445-D1449 VanDerWaalsContact O-CG 3.28Å; C1445-D1449 PolarHBondContact O-N 3.12Å; K1446-D1449 PolarHBondContact O-N 2.88Å; D1449-H1451 VanDerWaalsContact C-N 3.32Å; D1449-H1451 PolarHBondContact O-N 3.1Å; D1449-T1452 PolarHBondContact O-N 3.1Å; D1449-I1453 WeakPolarHBondContact O-CD1 3.33Å; D1449-I1453 WeakPolarHBondContact O-CG1 3.34Å; D1449-I1453 PolarHBondContact O-N 3.11Å; D1449-F1509 HydrophobicContact CB-CE1 4.12Å; D1449-Y1510 HydrophobicContact CB-CE1 4.42Å; D1449-Y1510 VanDerWaalsContact CB-OH 3.28Å; D1449-Y1510 WeakPolarHBondContact CB-OH 3.31Å; D1449-Y1510 PolarHBondContact OD2-OH 3.11Å; D1449-F1515 WeakPolarHBondContact OD2-CB 3.44Å; D1449-F1515 WeakPolarHBondContact OD2-CE2 3.49Å
1450	I	90.8	Very high	90	Very high	50 Å²	50	59.5 Å²	59.5	26%	0.256	31%	0.308	S	S	.	.	H	α-helix	trans	-55.4	-47.8	175.2	-74.4	168.6	0	0	0	110.6	K1446 L1447 T1452 I1453 L1454 Y1502 L1506	K1446-I1450 HydrophobicContact CG-CD1 4.03Å; K1446-I1450 VanDerWaalsContact O-CB 3.29Å; K1446-I1450 WeakPolarHBondContact O-CB 3.34Å; K1446-I1450 WeakPolarHBondContact O-CD1 3.38Å; K1446-I1450 WeakPolarHBondContact O-CG1 3.39Å; K1446-I1450 PolarHBondContact O-N 3.15Å; K1446-I1450 VanDerWaalsContact O-N 3.1Å; L1447-I1450 PolarHBondContact O-N 3.22Å; I1450-T1452 PolarHBondContact O-N 3.01Å; I1450-I1453 PolarHBondContact O-N 3.06Å; I1450-L1454 VanDerWaalsContact O-CB 3.27Å; I1450-L1454 WeakPolarHBondContact O-CB 3.41Å; I1450-L1454 PolarHBondContact O-N 3.09Å; I1450-Y1502 WeakPolarHBondContact CG2-OH 3.33Å; I1450-Y1502 PolarHBondContact O-OH 2.97Å; I1450-L1506 HydrophobicContact CB-CD1 4.37Å; I1450-L1506 HydrophobicContact CG1-CD1 4.04Å; I1450-L1506 HydrophobicContact CG1-CD2 4.17Å; I1450-L1506 HydrophobicContact CG2-CD1 4.37Å
1451	H	90.4	Very high	89.8	Confident	98.2 Å²	98.2	60.2 Å²	60.2	46%	0.455	31%	0.312	S	S	.	.	H	α-helix	trans	-64.3	-42.1	179	175.1	-99	0	0	0	112.1	L1447 N1448 D1449 I1453 L1454 L1455	L1447-H1451 VanDerWaalsContact O-CB 3.28Å; L1447-H1451 WeakPolarHBondContact O-CB 3.29Å; L1447-H1451 PolarHBondContact O-N 2.97Å; N1448-H1451 PolarHBondContact O-N 3.13Å; D1449-H1451 VanDerWaalsContact C-N 3.32Å; D1449-H1451 PolarHBondContact O-N 3.1Å; H1451-I1453 PolarHBondContact O-N 3.2Å; H1451-L1454 WeakPolarHBondContact O-CB 3.29Å; H1451-L1454 PolarHBondContact O-N 3.16Å; H1451-L1454 VanDerWaalsContact O-N 3.16Å; H1451-L1455 VanDerWaalsContact CE1-CD1 3.45Å; H1451-L1455 WeakPolarHBondContact CE1-CD1 3.34Å; H1451-L1455 WeakPolarHBondContact O-CG 3.37Å; H1451-L1455 PolarHBondContact O-N 2.98Å
1452	T	86.9	Confident	89.8	Confident	68.4 Å²	68.4	64.2 Å²	64.2	42%	0.42	33%	0.33	S	S	.	.	H	α-helix	trans	-62.9	-45.4	179.5	-58	0	0	0	0	111.3	N1448 D1449 I1450 L1454 L1455 D1456	N1448-T1452 VanDerWaalsContact O-CB 3.3Å; N1448-T1452 WeakPolarHBondContact O-CB 3.32Å; N1448-T1452 PolarHBondContact O-N 3.02Å; N1448-T1452 PolarHBondContact O-OG1 3.13Å; D1449-T1452 PolarHBondContact O-N 3.1Å; I1450-T1452 PolarHBondContact O-N 3.01Å; T1452-L1454 VanDerWaalsContact C-N 3.31Å; T1452-L1454 PolarHBondContact O-N 3.36Å; T1452-L1455 PolarHBondContact O-N 3.12Å; T1452-D1456 PolarHBondContact O-N 2.95Å
1453	I	89.4	Confident	90	Very high	12.8 Å²	12.8	68.7 Å²	68.7	7%	0.066	34%	0.344	C	S	.	.	H	α-helix	trans	-67.3	-34.6	176.5	-62.2	163	0	0	0	110.9	D1449 I1450 H1451 D1456 E1457 Y1502 R1505 L1506 F1509	D1449-I1453 WeakPolarHBondContact O-CD1 3.33Å; D1449-I1453 WeakPolarHBondContact O-CG1 3.34Å; D1449-I1453 PolarHBondContact O-N 3.11Å; I1450-I1453 PolarHBondContact O-N 3.06Å; H1451-I1453 PolarHBondContact O-N 3.2Å; I1453-D1456 PolarHBondContact O-N 3.08Å; I1453-E1457 WeakPolarHBondContact O-CB 3.42Å; I1453-E1457 PolarHBondContact O-N 3.2Å; I1453-Y1502 HydrophobicContact CB-CE2 4.23Å; I1453-Y1502 HydrophobicContact CG2-CD2 4.1Å; I1453-Y1502 HydrophobicContact CG2-CE2 3.79Å; I1453-R1505 HydrophobicContact CG2-CB 4.15Å; I1453-R1505 HydrophobicContact CG2-CG 4.18Å; I1453-L1506 HydrophobicContact CB-CD1 4.46Å; I1453-L1506 HydrophobicContact CD1-CD1 3.59Å; I1453-L1506 VanDerWaalsContact CD1-CD1 3.48Å; I1453-L1506 HydrophobicContact CD1-CG 4.26Å; I1453-L1506 HydrophobicContact CG2-CD1 4.46Å; I1453-F1509 HydrophobicContact CD1-CB 3.82Å; I1453-F1509 HydrophobicContact CD1-CD1 3.68Å; I1453-F1509 HydrophobicContact CD1-CD2 4.1Å; I1453-F1509 HydrophobicContact CD1-CE1 4.24Å; I1453-F1509 HydrophobicContact CD1-CG 3.59Å; I1453-F1509 HydrophobicContact CG1-CD2 4.46Å; I1453-F1509 HydrophobicContact CG1-CG 4.4Å
1454	L	91	Very high	90	Very high	70 Å²	70	65.9 Å²	65.9	37%	0.366	33%	0.329	S	S	.	.	H	α-helix	trans	-66.3	-38.3	177	-178.7	65.5	0	0	0	112	I1450 H1451 T1452 D1456 E1457 F1458 Y1502	I1450-L1454 VanDerWaalsContact O-CB 3.27Å; I1450-L1454 WeakPolarHBondContact O-CB 3.41Å; I1450-L1454 PolarHBondContact O-N 3.09Å; H1451-L1454 WeakPolarHBondContact O-CB 3.29Å; H1451-L1454 PolarHBondContact O-N 3.16Å; H1451-L1454 VanDerWaalsContact O-N 3.16Å; T1452-L1454 VanDerWaalsContact C-N 3.31Å; T1452-L1454 PolarHBondContact O-N 3.36Å; L1454-D1456 VanDerWaalsContact C-N 3.34Å; L1454-E1457 PolarHBondContact O-N 3.07Å; L1454-F1458 VanDerWaalsContact O-CB 3.29Å; L1454-F1458 WeakPolarHBondContact O-CB 3.35Å; L1454-F1458 PolarHBondContact O-N 3.28Å; L1454-Y1502 HydrophobicContact CB-CE2 3.94Å; L1454-Y1502 HydrophobicContact CD1-CD2 4.36Å; L1454-Y1502 HydrophobicContact CD1-CE2 4.17Å
1455	L	89.8	Confident	90.2	Very high	96 Å²	96	63.5 Å²	63.5	50%	0.503	32%	0.319	S	S	.	.	H	α-helix	trans	-62.4	-44	174.8	-73.6	177.4	0	0	0	111.6	H1451 T1452 F1458 A1459	H1451-L1455 VanDerWaalsContact CE1-CD1 3.45Å; H1451-L1455 WeakPolarHBondContact CE1-CD1 3.34Å; H1451-L1455 WeakPolarHBondContact O-CG 3.37Å; H1451-L1455 PolarHBondContact O-N 2.98Å; T1452-L1455 PolarHBondContact O-N 3.12Å; L1455-F1458 PolarHBondContact O-N 2.96Å; L1455-A1459 PolarHBondContact O-N 3.07Å; L1455-A1459 VanDerWaalsContact O-N 3.1Å
1456	D	88.4	Confident	90.4	Very high	82.8 Å²	82.8	66.1 Å²	66.1	44%	0.443	33%	0.332	S	S	.	.	H	α-helix	trans	-64.2	-45.5	175.9	-116.2	24	0	0	0	112	T1452 I1453 L1454 F1458 A1459 V1460 R1505	T1452-D1456 PolarHBondContact O-N 2.95Å; I1453-D1456 PolarHBondContact O-N 3.08Å; L1454-D1456 VanDerWaalsContact C-N 3.34Å; D1456-F1458 VanDerWaalsContact C-N 3.3Å; D1456-F1458 PolarHBondContact O-N 3.12Å; D1456-A1459 PolarHBondContact O-N 3.02Å; D1456-V1460 WeakPolarHBondContact O-CG2 3.36Å; D1456-V1460 PolarHBondContact O-N 3.16Å; D1456-V1460 VanDerWaalsContact O-N 3.11Å; D1456-R1505 IonicContact OD2-CZ 3.27Å; D1456-R1505 IonicContact OD2-NH1 3.15Å; D1456-R1505 PolarHBondContact OD2-NH1 3.22Å; D1456-R1505 IonicContact OD2-NH2 3.09Å; D1456-R1505 PolarHBondContact OD2-NH2 3.15Å
1457	E	89.8	Confident	90.5	Very high	4.4 Å²	4.4	64.2 Å²	64.2	2%	0.021	33%	0.329	C	S	.	.	H	α-helix	trans	-63.4	-37.7	176.7	-177.9	60.5	-144.2	0	0	111.4	I1453 L1454 A1459 V1460 H1461 R1464 R1498 Y1502 R1505	I1453-E1457 WeakPolarHBondContact O-CB 3.42Å; I1453-E1457 PolarHBondContact O-N 3.2Å; L1454-E1457 PolarHBondContact O-N 3.07Å; E1457-A1459 PolarHBondContact O-N 3.15Å; E1457-V1460 PolarHBondContact O-N 3.03Å; E1457-H1461 WeakPolarHBondContact O-CB 3.39Å; E1457-H1461 PolarHBondContact O-N 3.23Å; E1457-R1464 IonicContact OE1-CZ 3.35Å; E1457-R1464 IonicContact OE1-NH1 3.4Å; E1457-R1464 PolarHBondContact OE1-NH1 3.04Å; E1457-R1498 HydrophobicContact CG-CG 4.09Å; E1457-Y1502 HydrophobicContact CB-CD2 4.09Å; E1457-Y1502 HydrophobicContact CG-CD2 4.32Å; E1457-Y1502 PolarHBondContact OE2-N 3.24Å; E1457-R1505 IonicContact OE1-NH2 2.91Å; E1457-R1505 PolarHBondContact OE1-NH2 3.28Å; E1457-R1505 WeakPolarHBondContact OE2-CD 3.36Å; E1457-R1505 IonicContact OE2-CZ 2.95Å; E1457-R1505 IonicContact OE2-NE 3.07Å; E1457-R1505 PolarHBondContact OE2-NE 3.07Å; E1457-R1505 IonicContact OE2-NH1 3.24Å; E1457-R1505 PolarHBondContact OE2-NH1 3.47Å; E1457-R1505 IonicContact OE2-NH2 3.26Å; E1457-R1505 PolarHBondContact OE2-NH2 2.93Å
1458	F	89.8	Confident	90.5	Very high	107.4 Å²	107.4	60.8 Å²	60.8	47%	0.471	31%	0.311	S	S	.	.	H	α-helix	trans	-61.2	-45.7	176.1	-178.5	-98.1	0	0	0	111.6	L1454 L1455 D1456 V1460 H1461 E1462	L1454-F1458 VanDerWaalsContact O-CB 3.29Å; L1454-F1458 WeakPolarHBondContact O-CB 3.35Å; L1454-F1458 PolarHBondContact O-N 3.28Å; L1455-F1458 PolarHBondContact O-N 2.96Å; D1456-F1458 VanDerWaalsContact C-N 3.3Å; D1456-F1458 PolarHBondContact O-N 3.12Å; F1458-V1460 VanDerWaalsContact C-N 3.32Å; F1458-V1460 PolarHBondContact O-N 3.05Å; F1458-H1461 PolarHBondContact O-N 3.06Å; F1458-E1462 HydrophobicContact CE1-CG 4.04Å; F1458-E1462 HydrophobicContact CZ-CG 4.06Å; F1458-E1462 WeakPolarHBondContact O-CB 3.44Å; F1458-E1462 PolarHBondContact O-N 3.09Å
1459	A	91.5	Very high	90.6	Very high	44.8 Å²	44.8	63.9 Å²	63.9	37%	0.37	32%	0.319	S	S	.	.	H	α-helix	trans	-64.6	-34.7	177.7	0	0	0	0	0	112.9	L1455 D1456 E1457 K1463	L1455-A1459 PolarHBondContact O-N 3.07Å; L1455-A1459 VanDerWaalsContact O-N 3.1Å; D1456-A1459 PolarHBondContact O-N 3.02Å; E1457-A1459 PolarHBondContact O-N 3.15Å; A1459-K1463 WeakPolarHBondContact O-CG 3.39Å
1460	V	89.6	Confident	90.8	Very high	48.4 Å²	48.4	67.6 Å²	67.6	29%	0.293	34%	0.336	S	S	.	.	H	α-helix	trans	-73.3	-41.1	174	173.8	0	0	0	0	111.2	D1456 E1457 F1458 E1462 K1463 R1464	D1456-V1460 WeakPolarHBondContact O-CG2 3.36Å; D1456-V1460 PolarHBondContact O-N 3.16Å; D1456-V1460 VanDerWaalsContact O-N 3.11Å; E1457-V1460 PolarHBondContact O-N 3.03Å; F1458-V1460 VanDerWaalsContact C-N 3.32Å; F1458-V1460 PolarHBondContact O-N 3.05Å; V1460-E1462 VanDerWaalsContact C-N 3.34Å; V1460-E1462 PolarHBondContact O-N 3.13Å; V1460-K1463 WeakPolarHBondContact O-CB 3.35Å; V1460-K1463 PolarHBondContact O-N 3.16Å; V1460-K1463 VanDerWaalsContact O-N 3.13Å; V1460-R1464 HydrophobicContact CG1-CG 4.41Å; V1460-R1464 WeakPolarHBondContact O-CG 3.38Å; V1460-R1464 PolarHBondContact O-N 2.98Å
1461	H	89.8	Confident	90.7	Very high	16 Å²	16	70.3 Å²	70.3	7%	0.074	35%	0.347	C	S	.	.	H	α-helix	trans	-62.4	-41.7	178.1	173.5	72.6	0	0	0	112.1	E1457 F1458 K1463 R1464 V1465 E1495 R1498	E1457-H1461 WeakPolarHBondContact O-CB 3.39Å; E1457-H1461 PolarHBondContact O-N 3.23Å; F1458-H1461 PolarHBondContact O-N 3.06Å; H1461-K1463 VanDerWaalsContact C-N 3.27Å; H1461-K1463 PolarHBondContact O-N 3.01Å; H1461-R1464 WeakPolarHBondContact O-CB 3.36Å; H1461-R1464 PolarHBondContact O-N 3.09Å; H1461-R1464 VanDerWaalsContact O-N 3.09Å; H1461-V1465 WeakPolarHBondContact CE1-CG2 3.32Å; H1461-V1465 WeakPolarHBondContact NE2-CG2 3.38Å; H1461-V1465 WeakPolarHBondContact O-CB 3.47Å; H1461-V1465 WeakPolarHBondContact O-CG2 3.28Å; H1461-V1465 PolarHBondContact O-N 3.18Å; H1461-E1495 IonicContact CD2-OE1 2.81Å; H1461-E1495 IonicContact CE1-OE1 3.27Å; H1461-E1495 PolarHBondContact CE1-OE1 3.1Å; H1461-E1495 VanDerWaalsContact CE1-OE1 3.27Å; H1461-E1495 IonicContact CE1-OE2 3.31Å; H1461-E1495 PolarHBondContact CE1-OE2 3.35Å; H1461-E1495 VanDerWaalsContact CE1-OE2 3.3Å; H1461-E1495 IonicContact NE2-OE1 2.99Å; H1461-E1495 PolarHBondContact NE2-OE1 3.06Å; H1461-E1495 VanDerWaalsContact NE2-OE1 3.12Å; H1461-E1495 IonicContact NE2-OE2 2.94Å; H1461-R1498 HydrophobicContact CB-CG 4.26Å; H1461-R1498 WeakPolarHBondContact ND1-CD 3.18Å
1462	E	92.1	Very high	90.6	Very high	105.8 Å²	105.8	66.3 Å²	66.3	49%	0.494	33%	0.329	S	S	.	.	H	α-helix	trans	-56.4	-42.7	174.4	-158.6	-178.1	-179.3	0	0	111.5	F1458 V1460 V1465 N1466	F1458-E1462 HydrophobicContact CE1-CG 4.04Å; F1458-E1462 HydrophobicContact CZ-CG 4.06Å; F1458-E1462 WeakPolarHBondContact O-CB 3.44Å; F1458-E1462 PolarHBondContact O-N 3.09Å; V1460-E1462 VanDerWaalsContact C-N 3.34Å; V1460-E1462 PolarHBondContact O-N 3.13Å; E1462-V1465 PolarHBondContact O-N 3.18Å; E1462-N1466 WeakPolarHBondContact O-CB 3.34Å; E1462-N1466 VanDerWaalsContact O-CG 3.27Å; E1462-N1466 PolarHBondContact O-N 3.07Å; E1462-N1466 PolarHBondContact O-ND2 3.21Å
1463	K	93.7	Very high	90.6	Very high	146 Å²	146	66.5 Å²	66.5	64%	0.635	33%	0.328	S	S	*	.	H	α-helix	trans	-63.4	-44	174.4	-64.5	173.3	-177.5	175.6	0	111.9	A1459 V1460 H1461 V1465 N1466 T1467	A1459-K1463 WeakPolarHBondContact O-CG 3.39Å; V1460-K1463 WeakPolarHBondContact O-CB 3.35Å; V1460-K1463 PolarHBondContact O-N 3.16Å; V1460-K1463 VanDerWaalsContact O-N 3.13Å; H1461-K1463 VanDerWaalsContact C-N 3.27Å; H1461-K1463 PolarHBondContact O-N 3.01Å; K1463-V1465 VanDerWaalsContact C-N 3.34Å; K1463-V1465 PolarHBondContact O-N 3.13Å; K1463-N1466 PolarHBondContact O-N 3.13Å; K1463-T1467 WeakPolarHBondContact O-CB 3.2Å; K1463-T1467 PolarHBondContact O-N 2.95Å; K1463-T1467 PolarHBondContact O-OG1 3.03Å; K1463-T1467 VanDerWaalsContact O-OG1 3.06Å
1464	R	91.4	Very high	90.6	Very high	80.2 Å²	80.2	72.3 Å²	72.3	30%	0.303	35%	0.348	S	S	.	.	H	α-helix	trans	-60.7	-43.9	177.1	-68.1	168.8	176.7	-172.5	-15.4	111.6	E1457 V1460 H1461 T1467 L1468 I1494 D1501	E1457-R1464 IonicContact OE1-CZ 3.35Å; E1457-R1464 IonicContact OE1-NH1 3.4Å; E1457-R1464 PolarHBondContact OE1-NH1 3.04Å; V1460-R1464 HydrophobicContact CG1-CG 4.41Å; V1460-R1464 WeakPolarHBondContact O-CG 3.38Å; V1460-R1464 PolarHBondContact O-N 2.98Å; H1461-R1464 WeakPolarHBondContact O-CB 3.36Å; H1461-R1464 PolarHBondContact O-N 3.09Å; H1461-R1464 VanDerWaalsContact O-N 3.09Å; R1464-T1467 PolarHBondContact O-N 3.07Å; R1464-L1468 WeakPolarHBondContact O-CB 3.33Å; R1464-L1468 PolarHBondContact O-N 3.28Å; R1464-I1494 HydrophobicContact CB-CD1 3.96Å; R1464-D1501 IonicContact CZ-OD2 3.42Å; R1464-D1501 VanDerWaalsContact CZ-OD2 3.25Å; R1464-D1501 IonicContact NH1-OD2 3.15Å; R1464-D1501 PolarHBondContact NH1-OD2 3.12Å; R1464-D1501 IonicContact NH2-OD2 3.25Å; R1464-D1501 PolarHBondContact NH2-OD2 3.18Å
1465	V	91.6	Very high	90.4	Very high	16.6 Å²	16.6	70 Å²	70	10%	0.101	34%	0.34	C	S	.	.	H	α-helix	trans	-64.4	-43.1	177.4	168.7	0	0	0	0	111.2	H1461 E1462 K1463 L1468 R1469 F1491 I1494	H1461-V1465 WeakPolarHBondContact CE1-CG2 3.32Å; H1461-V1465 WeakPolarHBondContact NE2-CG2 3.38Å; H1461-V1465 WeakPolarHBondContact O-CB 3.47Å; H1461-V1465 WeakPolarHBondContact O-CG2 3.28Å; H1461-V1465 PolarHBondContact O-N 3.18Å; E1462-V1465 PolarHBondContact O-N 3.18Å; K1463-V1465 VanDerWaalsContact C-N 3.34Å; K1463-V1465 PolarHBondContact O-N 3.13Å; V1465-L1468 PolarHBondContact O-N 3.13Å; V1465-R1469 VanDerWaalsContact CG1-CZ 3.49Å; V1465-R1469 WeakPolarHBondContact O-CG 3.37Å; V1465-R1469 PolarHBondContact O-N 2.81Å; V1465-F1491 HydrophobicContact CG1-CE1 4.25Å; V1465-I1494 HydrophobicContact CG2-CG2 4.26Å
1466	N	93.6	Very high	90.1	Very high	66.2 Å²	66.2	69.4 Å²	69.4	35%	0.354	34%	0.336	S	S	.	.	H	α-helix	trans	-64.6	-43.9	176.7	-69.5	-20	0	0	0	111.4	E1462 K1463 L1468 R1469 E1470	E1462-N1466 WeakPolarHBondContact O-CB 3.34Å; E1462-N1466 VanDerWaalsContact O-CG 3.27Å; E1462-N1466 PolarHBondContact O-N 3.07Å; E1462-N1466 PolarHBondContact O-ND2 3.21Å; K1463-N1466 PolarHBondContact O-N 3.13Å; N1466-L1468 VanDerWaalsContact C-N 3.33Å; N1466-L1468 PolarHBondContact O-N 3.04Å; N1466-R1469 WeakPolarHBondContact O-CB 3.36Å; N1466-R1469 PolarHBondContact O-N 3.07Å; N1466-R1469 PolarHBondContact OD1-NH1 3.04Å; N1466-E1470 WeakPolarHBondContact O-CG 3.36Å; N1466-E1470 PolarHBondContact O-N 3.1Å
1467	T	93.1	Very high	90	Very high	65 Å²	65	73.4 Å²	73.4	40%	0.399	35%	0.352	S	S	.	.	H	α-helix	trans	-61.2	-40.5	174.7	-53.3	0	0	0	0	112	K1463 R1464 E1470 Q1471	K1463-T1467 WeakPolarHBondContact O-CB 3.2Å; K1463-T1467 PolarHBondContact O-N 2.95Å; K1463-T1467 PolarHBondContact O-OG1 3.03Å; K1463-T1467 VanDerWaalsContact O-OG1 3.06Å; R1464-T1467 PolarHBondContact O-N 3.07Å; T1467-E1470 PolarHBondContact O-N 3.15Å; T1467-Q1471 VanDerWaalsContact O-CG 3.3Å; T1467-Q1471 WeakPolarHBondContact O-CG 3.41Å; T1467-Q1471 PolarHBondContact O-N 3.08Å
1468	L	90.9	Very high	89.9	Confident	19 Å²	19	77.2 Å²	77.2	10%	0.099	38%	0.379	C	S	.	.	H	α-helix	trans	-64.8	-43.9	176.2	178.9	65.2	0	0	0	111.5	R1464 V1465 N1466 E1470 Q1471 I1472 C1490 F1491 I1494	R1464-L1468 WeakPolarHBondContact O-CB 3.33Å; R1464-L1468 PolarHBondContact O-N 3.28Å; V1465-L1468 PolarHBondContact O-N 3.13Å; N1466-L1468 VanDerWaalsContact C-N 3.33Å; N1466-L1468 PolarHBondContact O-N 3.04Å; L1468-E1470 VanDerWaalsContact C-N 3.31Å; L1468-E1470 PolarHBondContact O-N 2.91Å; L1468-Q1471 WeakPolarHBondContact O-CB 3.31Å; L1468-Q1471 PolarHBondContact O-N 3.19Å; L1468-Q1471 VanDerWaalsContact O-N 3.14Å; L1468-I1472 HydrophobicContact CD1-CD1 4.18Å; L1468-I1472 HydrophobicContact CD1-CG1 4.3Å; L1468-I1472 HydrophobicContact CD2-CD1 4.2Å; L1468-I1472 HydrophobicContact CG-CD1 3.9Å; L1468-I1472 HydrophobicContact CG-CG1 4.37Å; L1468-I1472 WeakPolarHBondContact O-CG1 3.31Å; L1468-I1472 PolarHBondContact O-N 3Å; L1468-C1490 VanDerWaalsContact CD1-SG 3.52Å; L1468-C1490 HydrophobicContact CD2-CB 4.29Å; L1468-F1491 HydrophobicContact CD2-CD1 3.84Å; L1468-F1491 HydrophobicContact CD2-CE1 3.74Å; L1468-F1491 HydrophobicContact CD2-CE2 4.45Å; L1468-F1491 HydrophobicContact CD2-CG 4.36Å; L1468-F1491 HydrophobicContact CD2-CZ 4.18Å; L1468-F1491 HydrophobicContact CG-CE1 4.38Å; L1468-I1494 HydrophobicContact CB-CD1 3.98Å; L1468-I1494 HydrophobicContact CD1-CD1 4.21Å; L1468-I1494 HydrophobicContact CD2-CB 4.41Å; L1468-I1494 HydrophobicContact CD2-CD1 3.64Å; L1468-I1494 VanDerWaalsContact CD2-CD1 3.49Å; L1468-I1494 HydrophobicContact CD2-CG1 4.15Å; L1468-I1494 HydrophobicContact CD2-CG2 4.29Å; L1468-I1494 HydrophobicContact CG-CD1 3.97Å
1469	R	91.2	Very high	89.6	Confident	122.6 Å²	122.6	75.1 Å²	75.1	46%	0.463	39%	0.388	S	S	.	.	H	α-helix	trans	-57	-49.3	175.8	-75.7	172.8	179.5	159.4	-2.4	110.9	V1465 N1466 Q1471 I1472 D1473 F1491	V1465-R1469 VanDerWaalsContact CG1-CZ 3.49Å; V1465-R1469 WeakPolarHBondContact O-CG 3.37Å; V1465-R1469 PolarHBondContact O-N 2.81Å; N1466-R1469 WeakPolarHBondContact O-CB 3.36Å; N1466-R1469 PolarHBondContact O-N 3.07Å; N1466-R1469 PolarHBondContact OD1-NH1 3.04Å; R1469-Q1471 VanDerWaalsContact C-N 3.28Å; R1469-Q1471 PolarHBondContact O-N 3.13Å; R1469-I1472 PolarHBondContact O-N 3.03Å; R1469-I1472 VanDerWaalsContact O-N 3.16Å; R1469-D1473 WeakPolarHBondContact O-CB 3.41Å; R1469-D1473 VanDerWaalsContact O-CG 3.25Å; R1469-D1473 PolarHBondContact O-N 3.05Å; R1469-F1491 HydrophobicContact CG-CE1 4.31Å; R1469-F1491 HydrophobicContact CG-CZ 3.95Å
1470	E	92	Very high	89.2	Confident	100 Å²	100	77.7 Å²	77.7	47%	0.467	40%	0.395	S	S	.	.	H	α-helix	trans	-61	-35.1	176.3	-67.7	174.1	-165.5	0	0	113	N1466 T1467 L1468 R1474	N1466-E1470 WeakPolarHBondContact O-CG 3.36Å; N1466-E1470 PolarHBondContact O-N 3.1Å; T1467-E1470 PolarHBondContact O-N 3.15Å; L1468-E1470 VanDerWaalsContact C-N 3.31Å; L1468-E1470 PolarHBondContact O-N 2.91Å; E1470-R1474 VanDerWaalsContact CB-CZ 3.49Å; E1470-R1474 VanDerWaalsContact O-CB 3.22Å; E1470-R1474 WeakPolarHBondContact O-CB 3.38Å; E1470-R1474 VanDerWaalsContact O-CG 3.26Å; E1470-R1474 WeakPolarHBondContact O-CG 3.3Å; E1470-R1474 PolarHBondContact O-N 2.99Å; E1470-R1474 PolarHBondContact O-NE 3.23Å; E1470-R1474 VanDerWaalsContact O-NE 3.16Å; E1470-R1474 IonicContact OE2-CZ 3.15Å; E1470-R1474 VanDerWaalsContact OE2-CZ 3.26Å; E1470-R1474 IonicContact OE2-NH1 3.21Å; E1470-R1474 PolarHBondContact OE2-NH1 2.99Å; E1470-R1474 VanDerWaalsContact OE2-NH1 3.16Å; E1470-R1474 IonicContact OE2-NH2 3.53Å; E1470-R1474 PolarHBondContact OE2-NH2 2.86Å
1471	Q	89.1	Confident	88.7	Confident	106 Å²	106	86.8 Å²	86.8	50%	0.495	42%	0.424	S	S	.	.	H	α-helix	trans	-68	-42.8	175.3	-76.2	178.4	0.7	0	0	112	T1467 L1468 R1469 D1473 R1474 A1475	T1467-Q1471 VanDerWaalsContact O-CG 3.3Å; T1467-Q1471 WeakPolarHBondContact O-CG 3.41Å; T1467-Q1471 PolarHBondContact O-N 3.08Å; L1468-Q1471 WeakPolarHBondContact O-CB 3.31Å; L1468-Q1471 PolarHBondContact O-N 3.19Å; L1468-Q1471 VanDerWaalsContact O-N 3.14Å; R1469-Q1471 VanDerWaalsContact C-N 3.28Å; R1469-Q1471 PolarHBondContact O-N 3.13Å; Q1471-D1473 VanDerWaalsContact C-N 3.34Å; Q1471-R1474 PolarHBondContact O-N 3.05Å; Q1471-A1475 WeakPolarHBondContact O-CB 3.32Å; Q1471-A1475 PolarHBondContact O-N 3.08Å
1472	I	87.5	Confident	88.3	Confident	13.4 Å²	13.4	88.3 Å²	88.3	7%	0.069	43%	0.434	C	S	.	.	H	α-helix	trans	-62.5	-46.4	175.2	-68.9	167.7	0	0	0	109.7	L1468 R1469 R1474 A1475 I1476 R1487 F1491	L1468-I1472 HydrophobicContact CD1-CD1 4.18Å; L1468-I1472 HydrophobicContact CD1-CG1 4.3Å; L1468-I1472 HydrophobicContact CD2-CD1 4.2Å; L1468-I1472 HydrophobicContact CG-CD1 3.9Å; L1468-I1472 HydrophobicContact CG-CG1 4.37Å; L1468-I1472 WeakPolarHBondContact O-CG1 3.31Å; L1468-I1472 PolarHBondContact O-N 3Å; R1469-I1472 PolarHBondContact O-N 3.03Å; R1469-I1472 VanDerWaalsContact O-N 3.16Å; I1472-R1474 VanDerWaalsContact C-N 3.34Å; I1472-R1474 PolarHBondContact O-N 3.22Å; I1472-A1475 WeakPolarHBondContact O-CB 3.36Å; I1472-A1475 PolarHBondContact O-N 3.06Å; I1472-A1475 VanDerWaalsContact O-N 3.14Å; I1472-I1476 HydrophobicContact CG2-CD1 3.8Å; I1472-I1476 HydrophobicContact CG2-CG1 4.45Å; I1472-I1476 VanDerWaalsContact O-CG1 3.29Å; I1472-I1476 WeakPolarHBondContact O-CG1 3.29Å; I1472-I1476 PolarHBondContact O-N 2.99Å; I1472-R1487 HydrophobicContact CD1-CG 4.38Å; I1472-F1491 HydrophobicContact CD1-CE2 3.91Å; I1472-F1491 HydrophobicContact CD1-CZ 4.03Å
1473	D	87.9	Confident	88	Confident	74 Å²	74	86.7 Å²	86.7	40%	0.396	43%	0.431	S	S	.	.	H	α-helix	trans	-61.6	-45	178	-65.7	-25.4	0	0	0	110.4	R1469 Q1471 A1475 I1476 H1477	R1469-D1473 WeakPolarHBondContact O-CB 3.41Å; R1469-D1473 VanDerWaalsContact O-CG 3.25Å; R1469-D1473 PolarHBondContact O-N 3.05Å; Q1471-D1473 VanDerWaalsContact C-N 3.34Å; D1473-A1475 VanDerWaalsContact C-N 3.33Å; D1473-A1475 PolarHBondContact O-N 2.81Å; D1473-I1476 PolarHBondContact O-N 2.95Å; D1473-H1477 PolarHBondContact O-N 3.13Å; D1473-H1477 PolarHBondContact O-ND1 3Å
1474	R	88.9	Confident	87.6	Confident	132.8 Å²	132.8	85.5 Å²	85.5	50%	0.501	43%	0.432	S	S	.	.	H	α-helix	trans	-60.2	-40.6	174.2	-77.7	-176.3	-67.5	-112.6	-0.7	112.9	E1470 Q1471 I1472 I1476 H1477 S1478	E1470-R1474 VanDerWaalsContact CB-CZ 3.49Å; E1470-R1474 VanDerWaalsContact O-CB 3.22Å; E1470-R1474 WeakPolarHBondContact O-CB 3.38Å; E1470-R1474 VanDerWaalsContact O-CG 3.26Å; E1470-R1474 WeakPolarHBondContact O-CG 3.3Å; E1470-R1474 PolarHBondContact O-N 2.99Å; E1470-R1474 PolarHBondContact O-NE 3.23Å; E1470-R1474 VanDerWaalsContact O-NE 3.16Å; E1470-R1474 IonicContact OE2-CZ 3.15Å; E1470-R1474 VanDerWaalsContact OE2-CZ 3.26Å; E1470-R1474 IonicContact OE2-NH1 3.21Å; E1470-R1474 PolarHBondContact OE2-NH1 2.99Å; E1470-R1474 VanDerWaalsContact OE2-NH1 3.16Å; E1470-R1474 IonicContact OE2-NH2 3.53Å; E1470-R1474 PolarHBondContact OE2-NH2 2.86Å; Q1471-R1474 PolarHBondContact O-N 3.05Å; I1472-R1474 VanDerWaalsContact C-N 3.34Å; I1472-R1474 PolarHBondContact O-N 3.22Å; R1474-I1476 VanDerWaalsContact C-N 3.34Å; R1474-H1477 PolarHBondContact O-N 2.99Å; R1474-S1478 PolarHBondContact O-N 2.98Å; R1474-S1478 PolarHBondContact O-OG 3.17Å
1475	A	86.2	Confident	87.4	Confident	23.4 Å²	23.4	89.3 Å²	89.3	19%	0.193	45%	0.453	C	S	.	.	H	α-helix	trans	-63.9	-43.2	177.2	0	0	0	0	0	111.6	Q1471 I1472 D1473 H1477 S1478 G1479 I1480 V1482	Q1471-A1475 WeakPolarHBondContact O-CB 3.32Å; Q1471-A1475 PolarHBondContact O-N 3.08Å; I1472-A1475 WeakPolarHBondContact O-CB 3.36Å; I1472-A1475 PolarHBondContact O-N 3.06Å; I1472-A1475 VanDerWaalsContact O-N 3.14Å; D1473-A1475 VanDerWaalsContact C-N 3.33Å; D1473-A1475 PolarHBondContact O-N 2.81Å; A1475-H1477 VanDerWaalsContact C-N 3.34Å; A1475-H1477 PolarHBondContact O-N 2.98Å; A1475-S1478 WeakPolarHBondContact CA-OG 3.37Å; A1475-S1478 CarbonylContact O-C 3.52Å; A1475-S1478 PolarHBondContact O-N 2.99Å; A1475-S1478 VanDerWaalsContact O-N 3.13Å; A1475-S1478 PolarHBondContact O-OG 2.96Å; A1475-G1479 PolarHBondContact O-N 3.18Å; A1475-I1480 HydrophobicContact CB-CB 4.38Å; A1475-I1480 HydrophobicContact CB-CD1 4.27Å; A1475-I1480 WeakPolarHBondContact O-CB 3.32Å; A1475-I1480 PolarHBondContact O-N 2.95Å; A1475-I1480 VanDerWaalsContact O-N 3.09Å; A1475-V1482 HydrophobicContact CB-CG2 4.45Å
1476	I	85.2	Confident	87.2	Confident	81.8 Å²	81.8	93.6 Å²	93.6	42%	0.419	47%	0.472	S	S	.	.	H	α-helix	trans	-60.9	-44.3	174.4	-66.8	165.9	0	0	0	110.5	I1472 D1473 R1474 S1478 G1479 V1482	I1472-I1476 HydrophobicContact CG2-CD1 3.8Å; I1472-I1476 HydrophobicContact CG2-CG1 4.45Å; I1472-I1476 VanDerWaalsContact O-CG1 3.29Å; I1472-I1476 WeakPolarHBondContact O-CG1 3.29Å; I1472-I1476 PolarHBondContact O-N 2.99Å; D1473-I1476 PolarHBondContact O-N 2.95Å; R1474-I1476 VanDerWaalsContact C-N 3.34Å; I1476-S1478 VanDerWaalsContact C-N 3.3Å; I1476-S1478 PolarHBondContact O-N 2.91Å; I1476-G1479 PolarHBondContact O-N 3.19Å; I1476-G1479 VanDerWaalsContact O-N 3.11Å; I1476-V1482 HydrophobicContact CG1-CG2 4.41Å
1477	H	85	Confident	86.8	Confident	167 Å²	167	95 Å²	95	77%	0.773	47%	0.472	S	S	*	.	H	α-helix	trans	-65.4	-30	176.9	-74.3	84.4	0	0	0	113.2	D1473 R1474 A1475 G1479	D1473-H1477 PolarHBondContact O-N 3.13Å; D1473-H1477 PolarHBondContact O-ND1 3Å; R1474-H1477 PolarHBondContact O-N 2.99Å; A1475-H1477 VanDerWaalsContact C-N 3.34Å; A1475-H1477 PolarHBondContact O-N 2.98Å; H1477-G1479 VanDerWaalsContact C-N 3.26Å; H1477-G1479 PolarHBondContact O-N 3.18Å
1478	S	87.8	Confident	86.6	Confident	84.4 Å²	84.4	98 Å²	98	59%	0.59	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-0.4	174.2	66.1	0	0	0	0	114.5	R1474 A1475 I1476	R1474-S1478 PolarHBondContact O-N 2.98Å; R1474-S1478 PolarHBondContact O-OG 3.17Å; A1475-S1478 WeakPolarHBondContact CA-OG 3.37Å; A1475-S1478 CarbonylContact O-C 3.52Å; A1475-S1478 PolarHBondContact O-N 2.99Å; A1475-S1478 VanDerWaalsContact O-N 3.13Å; A1475-S1478 PolarHBondContact O-OG 2.96Å; I1476-S1478 VanDerWaalsContact C-N 3.3Å; I1476-S1478 PolarHBondContact O-N 2.91Å
1479	G	83.9	Confident	86.6	Confident	63.8 Å²	63.8	99.6 Å²	99.6	66%	0.658	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.6	6.8	178.5	0	0	0	0	0	115.1	A1475 I1476 H1477 R1481	A1475-G1479 PolarHBondContact O-N 3.18Å; I1476-G1479 PolarHBondContact O-N 3.19Å; I1476-G1479 VanDerWaalsContact O-N 3.11Å; H1477-G1479 VanDerWaalsContact C-N 3.26Å; H1477-G1479 PolarHBondContact O-N 3.18Å; G1479-R1481 PolarHBondContact O-N 2.89Å
1480	I	83.5	Confident	86.5	Confident	100 Å²	100	95.9 Å²	95.9	51%	0.513	49%	0.491	S	S	.	.			trans	-77.2	116.7	173.8	-57.4	173.3	0	0	0	108.3	A1475 V1482	A1475-I1480 HydrophobicContact CB-CB 4.38Å; A1475-I1480 HydrophobicContact CB-CD1 4.27Å; A1475-I1480 WeakPolarHBondContact O-CB 3.32Å; A1475-I1480 PolarHBondContact O-N 2.95Å; A1475-I1480 VanDerWaalsContact O-N 3.09Å; I1480-V1482 HydrophobicContact CG2-CG2 4.23Å; I1480-V1482 PolarHBondContact O-N 3.06Å
1481	R	79.1	Confident	86.5	Confident	239.8 Å²	239.8	93.6 Å²	93.6	91%	0.905	48%	0.479	S	S	*	.			trans	-75.5	105.5	170.7	-86.3	-176.3	172.6	-177.4	-2.1	109.1	G1479	G1479-R1481 PolarHBondContact O-N 2.89Å
1482	V	79.7	Confident	86.7	Confident	47.4 Å²	47.4	92.3 Å²	92.3	29%	0.287	48%	0.478	S	S	.	.			trans	-92.3	121.6	170.6	-176	0	0	0	0	107.9	A1475 I1476 I1480 E1486 R1487	A1475-V1482 HydrophobicContact CB-CG2 4.45Å; I1476-V1482 HydrophobicContact CG1-CG2 4.41Å; I1480-V1482 HydrophobicContact CG2-CG2 4.23Å; I1480-V1482 PolarHBondContact O-N 3.06Å; V1482-E1486 WeakPolarHBondContact CA-OE2 3.29Å; V1482-E1486 HydrophobicContact CG1-CB 4Å; V1482-R1487 HydrophobicContact CG1-CB 4.25Å
1483	T	87.1	Confident	86.9	Confident	70.4 Å²	70.4	100.5 Å²	100.5	43%	0.432	51%	0.508	S	S	.	.			trans	-71.8	156.2	174.7	63.2	0	0	0	0	111	E1485 E1486 R1487	T1483-E1485 PolarHBondContact O-N 3.03Å; T1483-E1485 PolarHBondContact OG1-N 2.93Å; T1483-E1486 PolarHBondContact N-OE2 3.13Å; T1483-E1486 PolarHBondContact O-N 3.02Å; T1483-E1486 WeakPolarHBondContact OG1-CB 3.38Å; T1483-E1486 WeakPolarHBondContact OG1-CG 3.33Å; T1483-E1486 PolarHBondContact OG1-N 2.99Å; T1483-E1486 PolarHBondContact OG1-OE2 3.03Å; T1483-R1487 VanDerWaalsContact O-CB 3.27Å; T1483-R1487 WeakPolarHBondContact O-CB 3.39Å; T1483-R1487 PolarHBondContact O-N 3.04Å
1484	D	84.7	Confident	87.1	Confident	121.2 Å²	121.2	98.2 Å²	98.2	65%	0.648	50%	0.496	S	S	*	.	H	α-helix	trans	-61.4	-31.1	175.4	-76.9	-39.8	0	0	0	112.1	R1487 Q1488	D1484-R1487 PolarHBondContact O-N 2.93Å; D1484-Q1488 VanDerWaalsContact O-CB 3.3Å; D1484-Q1488 WeakPolarHBondContact O-CB 3.4Å; D1484-Q1488 VanDerWaalsContact O-CG 3.26Å; D1484-Q1488 WeakPolarHBondContact O-CG 3.35Å; D1484-Q1488 PolarHBondContact O-N 3.01Å
1485	E	88	Confident	87.2	Confident	161.4 Å²	161.4	95.8 Å²	95.8	75%	0.754	49%	0.49	S	S	*	.	H	α-helix	trans	-65.5	-46.6	174.3	-64.4	-178.2	175.8	0	0	111.8	T1483 R1487 Q1488 A1489	T1483-E1485 PolarHBondContact O-N 3.03Å; T1483-E1485 PolarHBondContact OG1-N 2.93Å; E1485-R1487 VanDerWaalsContact C-N 3.34Å; E1485-R1487 PolarHBondContact O-N 3.01Å; E1485-Q1488 PolarHBondContact O-N 3.16Å; E1485-A1489 VanDerWaalsContact O-CB 3.29Å; E1485-A1489 WeakPolarHBondContact O-CB 3.33Å; E1485-A1489 PolarHBondContact O-N 2.95Å
1486	E	86.9	Confident	87.5	Confident	105.2 Å²	105.2	99.3 Å²	99.3	49%	0.492	51%	0.505	S	S	.	.	H	α-helix	trans	-63.3	-42	175.2	-73	165.8	149.6	0	0	111.6	V1482 T1483 Q1488 A1489 C1490	V1482-E1486 WeakPolarHBondContact CA-OE2 3.29Å; V1482-E1486 HydrophobicContact CG1-CB 4Å; T1483-E1486 PolarHBondContact N-OE2 3.13Å; T1483-E1486 PolarHBondContact O-N 3.02Å; T1483-E1486 WeakPolarHBondContact OG1-CB 3.38Å; T1483-E1486 WeakPolarHBondContact OG1-CG 3.33Å; T1483-E1486 PolarHBondContact OG1-N 2.99Å; T1483-E1486 PolarHBondContact OG1-OE2 3.03Å; E1486-Q1488 PolarHBondContact O-N 2.91Å; E1486-A1489 PolarHBondContact O-N 3.14Å; E1486-C1490 WeakPolarHBondContact O-CB 3.35Å; E1486-C1490 PolarHBondContact O-N 3.09Å; E1486-C1490 PolarHBondContact O-SG 3.13Å; E1486-C1490 VanDerWaalsContact O-SG 3.4Å
1487	R	85.2	Confident	87.8	Confident	95.4 Å²	95.4	99.9 Å²	99.9	36%	0.36	51%	0.506	S	S	.	.	H	α-helix	trans	-58.5	-50.1	175.5	-177.8	179.5	-177.3	146.3	5.8	110.7	I1472 V1482 T1483 D1484 E1485 A1489 C1490 F1491	I1472-R1487 HydrophobicContact CD1-CG 4.38Å; V1482-R1487 HydrophobicContact CG1-CB 4.25Å; T1483-R1487 VanDerWaalsContact O-CB 3.27Å; T1483-R1487 WeakPolarHBondContact O-CB 3.39Å; T1483-R1487 PolarHBondContact O-N 3.04Å; D1484-R1487 PolarHBondContact O-N 2.93Å; E1485-R1487 VanDerWaalsContact C-N 3.34Å; E1485-R1487 PolarHBondContact O-N 3.01Å; R1487-A1489 VanDerWaalsContact C-N 3.34Å; R1487-A1489 PolarHBondContact O-N 2.68Å; R1487-C1490 WeakPolarHBondContact O-CB 3.35Å; R1487-C1490 PolarHBondContact O-N 3.08Å; R1487-F1491 HydrophobicContact CG-CD2 4.2Å; R1487-F1491 HydrophobicContact CG-CE2 3.88Å; R1487-F1491 WeakPolarHBondContact O-CD2 3.42Å; R1487-F1491 PolarHBondContact O-N 3.14Å
1488	Q	89.3	Confident	88.1	Confident	129 Å²	129	94.2 Å²	94.2	60%	0.603	48%	0.477	S	S	*	.	H	α-helix	trans	-64.2	-40.9	178.2	-88.2	163.7	15.6	0	0	111.9	D1484 E1485 E1486 C1490 F1491 T1492	D1484-Q1488 VanDerWaalsContact O-CB 3.3Å; D1484-Q1488 WeakPolarHBondContact O-CB 3.4Å; D1484-Q1488 VanDerWaalsContact O-CG 3.26Å; D1484-Q1488 WeakPolarHBondContact O-CG 3.35Å; D1484-Q1488 PolarHBondContact O-N 3.01Å; E1485-Q1488 PolarHBondContact O-N 3.16Å; E1486-Q1488 PolarHBondContact O-N 2.91Å; Q1488-C1490 VanDerWaalsContact C-N 3.3Å; Q1488-C1490 PolarHBondContact O-N 3.07Å; Q1488-F1491 PolarHBondContact O-N 2.88Å; Q1488-T1492 WeakPolarHBondContact O-CB 3.34Å; Q1488-T1492 WeakPolarHBondContact O-CG2 3.49Å; Q1488-T1492 PolarHBondContact O-N 3.1Å; Q1488-T1492 PolarHBondContact O-OG1 2.89Å; Q1488-T1492 VanDerWaalsContact O-OG1 3.07Å
1489	A	91.2	Very high	88.3	Confident	53.2 Å²	53.2	92.1 Å²	92.1	44%	0.44	47%	0.465	S	S	.	.	H	α-helix	trans	-61.1	-37.8	176.1	0	0	0	0	0	112.1	E1485 E1486 R1487 T1492 R1493	E1485-A1489 VanDerWaalsContact O-CB 3.29Å; E1485-A1489 WeakPolarHBondContact O-CB 3.33Å; E1485-A1489 PolarHBondContact O-N 2.95Å; E1486-A1489 PolarHBondContact O-N 3.14Å; R1487-A1489 VanDerWaalsContact C-N 3.34Å; R1487-A1489 PolarHBondContact O-N 2.68Å; A1489-T1492 WeakPolarHBondContact CA-OG1 3.41Å; A1489-T1492 PolarHBondContact O-N 3.12Å; A1489-T1492 PolarHBondContact O-OG1 2.86Å; A1489-R1493 WeakPolarHBondContact O-CB 3.28Å; A1489-R1493 WeakPolarHBondContact O-CG 3.39Å; A1489-R1493 PolarHBondContact O-N 3.12Å
1490	C	88.4	Confident	88.8	Confident	45.2 Å²	45.2	94.2 Å²	94.2	31%	0.305	46%	0.458	S	S	.	.	H	α-helix	trans	-63.7	-45.5	175.4	-126.1	0	0	0	0	112.2	L1468 E1486 R1487 Q1488 T1492 R1493 I1494	L1468-C1490 VanDerWaalsContact CD1-SG 3.52Å; L1468-C1490 HydrophobicContact CD2-CB 4.29Å; E1486-C1490 WeakPolarHBondContact O-CB 3.35Å; E1486-C1490 PolarHBondContact O-N 3.09Å; E1486-C1490 PolarHBondContact O-SG 3.13Å; E1486-C1490 VanDerWaalsContact O-SG 3.4Å; R1487-C1490 WeakPolarHBondContact O-CB 3.35Å; R1487-C1490 PolarHBondContact O-N 3.08Å; Q1488-C1490 VanDerWaalsContact C-N 3.3Å; Q1488-C1490 PolarHBondContact O-N 3.07Å; C1490-T1492 VanDerWaalsContact C-N 3.35Å; C1490-T1492 PolarHBondContact O-N 3.48Å; C1490-R1493 PolarHBondContact O-N 3.08Å; C1490-I1494 PolarHBondContact O-N 3.01Å
1491	F	92.5	Very high	89.1	Confident	50.2 Å²	50.2	91.5 Å²	91.5	22%	0.22	44%	0.444	C	S	.	.	H	α-helix	trans	-66.5	-37.6	175	-74	-69.3	0	0	0	112.5	V1465 L1468 R1469 I1472 R1487 Q1488 R1493 I1494 E1495	V1465-F1491 HydrophobicContact CG1-CE1 4.25Å; L1468-F1491 HydrophobicContact CD2-CD1 3.84Å; L1468-F1491 HydrophobicContact CD2-CE1 3.74Å; L1468-F1491 HydrophobicContact CD2-CE2 4.45Å; L1468-F1491 HydrophobicContact CD2-CG 4.36Å; L1468-F1491 HydrophobicContact CD2-CZ 4.18Å; L1468-F1491 HydrophobicContact CG-CE1 4.38Å; R1469-F1491 HydrophobicContact CG-CE1 4.31Å; R1469-F1491 HydrophobicContact CG-CZ 3.95Å; I1472-F1491 HydrophobicContact CD1-CE2 3.91Å; I1472-F1491 HydrophobicContact CD1-CZ 4.03Å; R1487-F1491 HydrophobicContact CG-CD2 4.2Å; R1487-F1491 HydrophobicContact CG-CE2 3.88Å; R1487-F1491 WeakPolarHBondContact O-CD2 3.42Å; R1487-F1491 PolarHBondContact O-N 3.14Å; Q1488-F1491 PolarHBondContact O-N 2.88Å; F1491-R1493 VanDerWaalsContact C-N 3.31Å; F1491-R1493 PolarHBondContact O-N 3.08Å; F1491-I1494 HydrophobicContact CD1-CG2 4.47Å; F1491-I1494 VanDerWaalsContact O-CG2 3.3Å; F1491-I1494 WeakPolarHBondContact O-CG2 3.33Å; F1491-I1494 PolarHBondContact O-N 2.99Å; F1491-E1495 PolarHBondContact O-N 3.01Å; F1491-E1495 VanDerWaalsContact O-N 3.08Å
1492	T	92.6	Very high	89.7	Confident	78.6 Å²	78.6	81.9 Å²	81.9	48%	0.482	41%	0.408	S	S	.	.	H	α-helix	trans	-63.1	-40.9	174.9	-41	0	0	0	0	111.3	Q1488 A1489 C1490 E1495 I1496	Q1488-T1492 WeakPolarHBondContact O-CB 3.34Å; Q1488-T1492 WeakPolarHBondContact O-CG2 3.49Å; Q1488-T1492 PolarHBondContact O-N 3.1Å; Q1488-T1492 PolarHBondContact O-OG1 2.89Å; Q1488-T1492 VanDerWaalsContact O-OG1 3.07Å; A1489-T1492 WeakPolarHBondContact CA-OG1 3.41Å; A1489-T1492 PolarHBondContact O-N 3.12Å; A1489-T1492 PolarHBondContact O-OG1 2.86Å; C1490-T1492 VanDerWaalsContact C-N 3.35Å; C1490-T1492 PolarHBondContact O-N 3.48Å; T1492-E1495 PolarHBondContact O-N 3.17Å; T1492-I1496 HydrophobicContact CG2-CD1 4.09Å; T1492-I1496 WeakPolarHBondContact O-CG1 3.43Å; T1492-I1496 PolarHBondContact O-N 3.15Å
1493	R	92.3	Very high	90.3	Very high	185.6 Å²	185.6	87.6 Å²	87.6	70%	0.7	43%	0.425	S	S	*	.	H	α-helix	trans	-63.5	-41.8	175.7	-135.7	176.7	138.9	174.4	1.4	112.2	A1489 C1490 F1491 E1495 I1496 Q1497	A1489-R1493 WeakPolarHBondContact O-CB 3.28Å; A1489-R1493 WeakPolarHBondContact O-CG 3.39Å; A1489-R1493 PolarHBondContact O-N 3.12Å; C1490-R1493 PolarHBondContact O-N 3.08Å; F1491-R1493 VanDerWaalsContact C-N 3.31Å; F1491-R1493 PolarHBondContact O-N 3.08Å; R1493-E1495 VanDerWaalsContact C-N 3.32Å; R1493-E1495 PolarHBondContact O-N 2.79Å; R1493-I1496 PolarHBondContact O-N 3.04Å; R1493-Q1497 WeakPolarHBondContact O-CB 3.39Å; R1493-Q1497 PolarHBondContact O-N 2.88Å
1494	I	91.5	Very high	90.6	Very high	25.4 Å²	25.4	89 Å²	89	13%	0.13	43%	0.43	C	S	.	.	H	α-helix	trans	-65.2	-37.1	176.8	-104	-173.1	0	0	0	111.7	R1464 V1465 L1468 C1490 F1491 Q1497 R1498	R1464-I1494 HydrophobicContact CB-CD1 3.96Å; V1465-I1494 HydrophobicContact CG2-CG2 4.26Å; L1468-I1494 HydrophobicContact CB-CD1 3.98Å; L1468-I1494 HydrophobicContact CD1-CD1 4.21Å; L1468-I1494 HydrophobicContact CD2-CB 4.41Å; L1468-I1494 HydrophobicContact CD2-CD1 3.64Å; L1468-I1494 VanDerWaalsContact CD2-CD1 3.49Å; L1468-I1494 HydrophobicContact CD2-CG1 4.15Å; L1468-I1494 HydrophobicContact CD2-CG2 4.29Å; L1468-I1494 HydrophobicContact CG-CD1 3.97Å; C1490-I1494 PolarHBondContact O-N 3.01Å; F1491-I1494 HydrophobicContact CD1-CG2 4.47Å; F1491-I1494 VanDerWaalsContact O-CG2 3.3Å; F1491-I1494 WeakPolarHBondContact O-CG2 3.33Å; F1491-I1494 PolarHBondContact O-N 2.99Å; I1494-Q1497 PolarHBondContact O-N 3.06Å; I1494-R1498 VanDerWaalsContact O-CB 3.28Å; I1494-R1498 WeakPolarHBondContact O-CB 3.43Å; I1494-R1498 PolarHBondContact O-N 3.01Å
1495	E	91.3	Very high	90.8	Very high	84.2 Å²	84.2	87.3 Å²	87.3	39%	0.393	41%	0.414	S	S	.	.	H	α-helix	trans	-67.8	-41.3	175.7	-91.8	-50.1	160	0	0	112.4	H1461 F1491 T1492 R1493 Q1497 R1498 A1499	H1461-E1495 IonicContact CD2-OE1 2.81Å; H1461-E1495 IonicContact CE1-OE1 3.27Å; H1461-E1495 PolarHBondContact CE1-OE1 3.1Å; H1461-E1495 VanDerWaalsContact CE1-OE1 3.27Å; H1461-E1495 IonicContact CE1-OE2 3.31Å; H1461-E1495 PolarHBondContact CE1-OE2 3.35Å; H1461-E1495 VanDerWaalsContact CE1-OE2 3.3Å; H1461-E1495 IonicContact NE2-OE1 2.99Å; H1461-E1495 PolarHBondContact NE2-OE1 3.06Å; H1461-E1495 VanDerWaalsContact NE2-OE1 3.12Å; H1461-E1495 IonicContact NE2-OE2 2.94Å; F1491-E1495 PolarHBondContact O-N 3.01Å; F1491-E1495 VanDerWaalsContact O-N 3.08Å; T1492-E1495 PolarHBondContact O-N 3.17Å; R1493-E1495 VanDerWaalsContact C-N 3.32Å; R1493-E1495 PolarHBondContact O-N 2.79Å; E1495-Q1497 VanDerWaalsContact C-N 3.34Å; E1495-Q1497 PolarHBondContact O-N 3.11Å; E1495-R1498 WeakPolarHBondContact O-CB 3.16Å; E1495-R1498 PolarHBondContact O-N 2.95Å; E1495-R1498 WeakPolarHBondContact OE1-CD 3.4Å; E1495-R1498 IonicContact OE1-CZ 2.76Å; E1495-R1498 IonicContact OE1-NE 3.15Å; E1495-R1498 IonicContact OE1-NH1 3.42Å; E1495-R1498 PolarHBondContact OE1-NH1 3.15Å; E1495-R1498 WeakPolarHBondContact OE2-CD 3.34Å; E1495-R1498 IonicContact OE2-NH1 3.34Å; E1495-R1498 PolarHBondContact OE2-NH1 3.12Å; E1495-R1498 VanDerWaalsContact OE2-NH1 3.13Å; E1495-A1499 WeakPolarHBondContact O-CB 3.24Å; E1495-A1499 PolarHBondContact O-N 3.14Å
1496	I	93.1	Very high	90.9	Very high	96 Å²	96	81 Å²	81	49%	0.492	39%	0.386	S	S	.	.	H	α-helix	trans	-61.7	-45.8	173.8	-67.4	166.5	0	0	0	110.3	T1492 R1493 R1498 A1499 Q1500	T1492-I1496 HydrophobicContact CG2-CD1 4.09Å; T1492-I1496 WeakPolarHBondContact O-CG1 3.43Å; T1492-I1496 PolarHBondContact O-N 3.15Å; R1493-I1496 PolarHBondContact O-N 3.04Å; I1496-R1498 VanDerWaalsContact C-N 3.34Å; I1496-R1498 PolarHBondContact O-N 2.83Å; I1496-A1499 PolarHBondContact O-N 2.89Å; I1496-Q1500 WeakPolarHBondContact O-CG 3.25Å; I1496-Q1500 PolarHBondContact O-N 3Å
1497	Q	89.9	Confident	91	Very high	94.4 Å²	94.4	82.3 Å²	82.3	44%	0.441	39%	0.391	S	S	.	.	H	α-helix	trans	-61.8	-44.3	177.4	-176.2	178.7	1	0	0	111.4	R1493 I1494 E1495 A1499 Q1500 D1501	R1493-Q1497 WeakPolarHBondContact O-CB 3.39Å; R1493-Q1497 PolarHBondContact O-N 2.88Å; I1494-Q1497 PolarHBondContact O-N 3.06Å; E1495-Q1497 VanDerWaalsContact C-N 3.34Å; E1495-Q1497 PolarHBondContact O-N 3.11Å; Q1497-A1499 VanDerWaalsContact C-N 3.32Å; Q1497-A1499 PolarHBondContact O-N 3.03Å; Q1497-Q1500 PolarHBondContact O-N 2.93Å; Q1497-Q1500 VanDerWaalsContact O-N 3.15Å; Q1497-D1501 WeakPolarHBondContact O-CB 3.33Å; Q1497-D1501 VanDerWaalsContact O-CG 3.3Å; Q1497-D1501 PolarHBondContact O-N 2.88Å
1498	R	91.4	Very high	91.2	Very high	47.6 Å²	47.6	85.6 Å²	85.6	18%	0.18	40%	0.404	C	S	.	.	H	α-helix	trans	-56.2	-46.5	174.4	179.9	-154.6	179.8	-176.3	-4.2	111.2	E1457 H1461 I1494 E1495 I1496 Q1500 D1501 Y1502	E1457-R1498 HydrophobicContact CG-CG 4.09Å; H1461-R1498 HydrophobicContact CB-CG 4.26Å; H1461-R1498 WeakPolarHBondContact ND1-CD 3.18Å; I1494-R1498 VanDerWaalsContact O-CB 3.28Å; I1494-R1498 WeakPolarHBondContact O-CB 3.43Å; I1494-R1498 PolarHBondContact O-N 3.01Å; E1495-R1498 WeakPolarHBondContact O-CB 3.16Å; E1495-R1498 PolarHBondContact O-N 2.95Å; E1495-R1498 WeakPolarHBondContact OE1-CD 3.4Å; E1495-R1498 IonicContact OE1-CZ 2.76Å; E1495-R1498 IonicContact OE1-NE 3.15Å; E1495-R1498 IonicContact OE1-NH1 3.42Å; E1495-R1498 PolarHBondContact OE1-NH1 3.15Å; E1495-R1498 WeakPolarHBondContact OE2-CD 3.34Å; E1495-R1498 IonicContact OE2-NH1 3.34Å; E1495-R1498 PolarHBondContact OE2-NH1 3.12Å; E1495-R1498 VanDerWaalsContact OE2-NH1 3.13Å; I1496-R1498 VanDerWaalsContact C-N 3.34Å; I1496-R1498 PolarHBondContact O-N 2.83Å; R1498-Q1500 VanDerWaalsContact C-N 3.31Å; R1498-Q1500 PolarHBondContact O-N 2.94Å; R1498-D1501 PolarHBondContact O-N 2.93Å; R1498-Y1502 VanDerWaalsContact O-CB 3.24Å; R1498-Y1502 WeakPolarHBondContact O-CB 3.28Å; R1498-Y1502 PolarHBondContact O-N 3.16Å
1499	A	92.6	Very high	91.1	Very high	40.8 Å²	40.8	82.4 Å²	82.4	34%	0.337	39%	0.388	S	S	.	.	H	α-helix	trans	-63.7	-36.3	178.7	0	0	0	0	0	112.4	E1495 I1496 Q1497 R1503	E1495-A1499 WeakPolarHBondContact O-CB 3.24Å; E1495-A1499 PolarHBondContact O-N 3.14Å; I1496-A1499 PolarHBondContact O-N 2.89Å; Q1497-A1499 VanDerWaalsContact C-N 3.32Å; Q1497-A1499 PolarHBondContact O-N 3.03Å; A1499-R1503 WeakPolarHBondContact O-CB 3.36Å; A1499-R1503 WeakPolarHBondContact O-CD 3.17Å; A1499-R1503 VanDerWaalsContact O-CG 3.28Å; A1499-R1503 WeakPolarHBondContact O-CG 3.31Å; A1499-R1503 PolarHBondContact O-N 3.12Å; A1499-R1503 VanDerWaalsContact O-N 3.1Å
1500	Q	93.4	Very high	90.9	Very high	108.2 Å²	108.2	82.9 Å²	82.9	51%	0.506	38%	0.379	S	S	.	.	H	α-helix	trans	-70.5	-48.8	174.8	-71.3	174.6	-20.1	0	0	111.9	I1496 Q1497 R1498 Y1502 R1503 N1504	I1496-Q1500 WeakPolarHBondContact O-CG 3.25Å; I1496-Q1500 PolarHBondContact O-N 3Å; Q1497-Q1500 PolarHBondContact O-N 2.93Å; Q1497-Q1500 VanDerWaalsContact O-N 3.15Å; R1498-Q1500 VanDerWaalsContact C-N 3.31Å; R1498-Q1500 PolarHBondContact O-N 2.94Å; Q1500-Y1502 VanDerWaalsContact C-N 3.31Å; Q1500-Y1502 PolarHBondContact O-N 3.13Å; Q1500-R1503 PolarHBondContact O-N 3.04Å; Q1500-R1503 VanDerWaalsContact O-N 3.12Å; Q1500-N1504 WeakPolarHBondContact O-CB 3.37Å; Q1500-N1504 PolarHBondContact O-N 3Å; Q1500-N1504 PolarHBondContact O-ND2 3.03Å
1501	D	90.2	Very high	90.8	Very high	41.4 Å²	41.4	85.2 Å²	85.2	22%	0.221	40%	0.395	C	S	.	.	H	α-helix	trans	-57.8	-44.7	177	-76.6	-5.6	0	0	0	111.3	R1464 Q1497 R1498 R1503 N1504 R1505	R1464-D1501 IonicContact CZ-OD2 3.42Å; R1464-D1501 VanDerWaalsContact CZ-OD2 3.25Å; R1464-D1501 IonicContact NH1-OD2 3.15Å; R1464-D1501 PolarHBondContact NH1-OD2 3.12Å; R1464-D1501 IonicContact NH2-OD2 3.25Å; R1464-D1501 PolarHBondContact NH2-OD2 3.18Å; Q1497-D1501 WeakPolarHBondContact O-CB 3.33Å; Q1497-D1501 VanDerWaalsContact O-CG 3.3Å; Q1497-D1501 PolarHBondContact O-N 2.88Å; R1498-D1501 PolarHBondContact O-N 2.93Å; D1501-R1503 PolarHBondContact O-N 3.41Å; D1501-N1504 PolarHBondContact O-N 3.15Å; D1501-R1505 WeakPolarHBondContact O-CB 3.45Å; D1501-R1505 WeakPolarHBondContact O-CG 3.4Å; D1501-R1505 PolarHBondContact O-N 3Å
1502	Y	93.3	Very high	90.4	Very high	39.2 Å²	39.2	87.7 Å²	87.7	15%	0.154	41%	0.41	C	S	.	.	H	α-helix	trans	-58.7	-48.7	175.7	176.2	-113.5	0	0	0	111.9	I1450 I1453 L1454 E1457 R1498 Q1500 N1504 R1505 L1506	I1450-Y1502 WeakPolarHBondContact CG2-OH 3.33Å; I1450-Y1502 PolarHBondContact O-OH 2.97Å; I1453-Y1502 HydrophobicContact CB-CE2 4.23Å; I1453-Y1502 HydrophobicContact CG2-CD2 4.1Å; I1453-Y1502 HydrophobicContact CG2-CE2 3.79Å; L1454-Y1502 HydrophobicContact CB-CE2 3.94Å; L1454-Y1502 HydrophobicContact CD1-CD2 4.36Å; L1454-Y1502 HydrophobicContact CD1-CE2 4.17Å; E1457-Y1502 HydrophobicContact CB-CD2 4.09Å; E1457-Y1502 HydrophobicContact CG-CD2 4.32Å; E1457-Y1502 PolarHBondContact OE2-N 3.24Å; R1498-Y1502 VanDerWaalsContact O-CB 3.24Å; R1498-Y1502 WeakPolarHBondContact O-CB 3.28Å; R1498-Y1502 PolarHBondContact O-N 3.16Å; Q1500-Y1502 VanDerWaalsContact C-N 3.31Å; Q1500-Y1502 PolarHBondContact O-N 3.13Å; Y1502-N1504 VanDerWaalsContact C-N 3.34Å; Y1502-N1504 PolarHBondContact O-N 3Å; Y1502-R1505 PolarHBondContact O-N 3.01Å; Y1502-L1506 HydrophobicContact CE1-CD1 4.23Å; Y1502-L1506 HydrophobicContact CE1-CD2 4.45Å; Y1502-L1506 HydrophobicContact CE2-CD1 3.97Å; Y1502-L1506 VanDerWaalsContact O-CB 3.27Å; Y1502-L1506 WeakPolarHBondContact O-CB 3.38Å; Y1502-L1506 PolarHBondContact O-N 3.23Å; Y1502-L1506 WeakPolarHBondContact OH-CD1 3.48Å
1503	R	91.9	Very high	89.7	Confident	168 Å²	168	90.5 Å²	90.5	63%	0.634	41%	0.413	S	S	*	.	H	α-helix	trans	-61.7	-43	176.7	-74.4	174.9	-172.3	166.1	3.2	111.6	A1499 Q1500 D1501 R1505 L1506 H1507	A1499-R1503 WeakPolarHBondContact O-CB 3.36Å; A1499-R1503 WeakPolarHBondContact O-CD 3.17Å; A1499-R1503 VanDerWaalsContact O-CG 3.28Å; A1499-R1503 WeakPolarHBondContact O-CG 3.31Å; A1499-R1503 PolarHBondContact O-N 3.12Å; A1499-R1503 VanDerWaalsContact O-N 3.1Å; Q1500-R1503 PolarHBondContact O-N 3.04Å; Q1500-R1503 VanDerWaalsContact O-N 3.12Å; D1501-R1503 PolarHBondContact O-N 3.41Å; R1503-R1505 PolarHBondContact O-N 3.39Å; R1503-L1506 PolarHBondContact O-N 3.19Å; R1503-H1507 WeakPolarHBondContact O-CB 3.25Å; R1503-H1507 PolarHBondContact O-CD2 3.22Å; R1503-H1507 PolarHBondContact O-N 3.03Å
1504	N	91.8	Very high	89	Confident	99.8 Å²	99.8	86.3 Å²	86.3	53%	0.534	42%	0.418	S	S	.	.	H	α-helix	trans	-63.8	-42.7	178.4	-69.1	-19.9	0	0	0	111.4	Q1500 D1501 Y1502 H1507 R1508	Q1500-N1504 WeakPolarHBondContact O-CB 3.37Å; Q1500-N1504 PolarHBondContact O-N 3Å; Q1500-N1504 PolarHBondContact O-ND2 3.03Å; D1501-N1504 PolarHBondContact O-N 3.15Å; Y1502-N1504 VanDerWaalsContact C-N 3.34Å; Y1502-N1504 PolarHBondContact O-N 3Å; N1504-H1507 PolarHBondContact O-N 2.86Å; N1504-R1508 VanDerWaalsContact O-CB 3.26Å; N1504-R1508 WeakPolarHBondContact O-CB 3.42Å; N1504-R1508 VanDerWaalsContact O-CG 3.26Å; N1504-R1508 WeakPolarHBondContact O-CG 3.34Å; N1504-R1508 PolarHBondContact O-N 2.98Å
1505	R	90	Very high	88.2	Confident	83.8 Å²	83.8	88.7 Å²	88.7	32%	0.316	43%	0.427	S	S	.	.	H	α-helix	trans	-63.6	-43	174.8	-137.6	-178.9	-166	-166.8	-2.7	111.6	I1453 D1456 E1457 D1501 Y1502 R1503 R1508 F1509	I1453-R1505 HydrophobicContact CG2-CB 4.15Å; I1453-R1505 HydrophobicContact CG2-CG 4.18Å; D1456-R1505 IonicContact OD2-CZ 3.27Å; D1456-R1505 IonicContact OD2-NH1 3.15Å; D1456-R1505 PolarHBondContact OD2-NH1 3.22Å; D1456-R1505 IonicContact OD2-NH2 3.09Å; D1456-R1505 PolarHBondContact OD2-NH2 3.15Å; E1457-R1505 IonicContact OE1-NH2 2.91Å; E1457-R1505 PolarHBondContact OE1-NH2 3.28Å; E1457-R1505 WeakPolarHBondContact OE2-CD 3.36Å; E1457-R1505 IonicContact OE2-CZ 2.95Å; E1457-R1505 IonicContact OE2-NE 3.07Å; E1457-R1505 PolarHBondContact OE2-NE 3.07Å; E1457-R1505 IonicContact OE2-NH1 3.24Å; E1457-R1505 PolarHBondContact OE2-NH1 3.47Å; E1457-R1505 IonicContact OE2-NH2 3.26Å; E1457-R1505 PolarHBondContact OE2-NH2 2.93Å; D1501-R1505 WeakPolarHBondContact O-CB 3.45Å; D1501-R1505 WeakPolarHBondContact O-CG 3.4Å; D1501-R1505 PolarHBondContact O-N 3Å; Y1502-R1505 PolarHBondContact O-N 3.01Å; R1503-R1505 PolarHBondContact O-N 3.39Å; R1505-R1508 PolarHBondContact O-N 3.14Å; R1505-F1509 VanDerWaalsContact O-CB 3.29Å; R1505-F1509 WeakPolarHBondContact O-CB 3.31Å; R1505-F1509 PolarHBondContact O-N 3.05Å
1506	L	89.4	Confident	87.7	Confident	30.8 Å²	30.8	87.7 Å²	87.7	16%	0.161	43%	0.429	C	S	.	.	H	α-helix	trans	-64.8	-44	177.7	-169.7	75.6	0	0	0	111.8	I1450 I1453 Y1502 R1503 F1509 Y1510	I1450-L1506 HydrophobicContact CB-CD1 4.37Å; I1450-L1506 HydrophobicContact CG1-CD1 4.04Å; I1450-L1506 HydrophobicContact CG1-CD2 4.17Å; I1450-L1506 HydrophobicContact CG2-CD1 4.37Å; I1453-L1506 HydrophobicContact CB-CD1 4.46Å; I1453-L1506 HydrophobicContact CD1-CD1 3.59Å; I1453-L1506 VanDerWaalsContact CD1-CD1 3.48Å; I1453-L1506 HydrophobicContact CD1-CG 4.26Å; I1453-L1506 HydrophobicContact CG2-CD1 4.46Å; Y1502-L1506 HydrophobicContact CE1-CD1 4.23Å; Y1502-L1506 HydrophobicContact CE1-CD2 4.45Å; Y1502-L1506 HydrophobicContact CE2-CD1 3.97Å; Y1502-L1506 VanDerWaalsContact O-CB 3.27Å; Y1502-L1506 WeakPolarHBondContact O-CB 3.38Å; Y1502-L1506 PolarHBondContact O-N 3.23Å; Y1502-L1506 WeakPolarHBondContact OH-CD1 3.48Å; R1503-L1506 PolarHBondContact O-N 3.19Å; L1506-F1509 WeakPolarHBondContact O-CB 3.45Å; L1506-F1509 PolarHBondContact O-N 3.16Å; L1506-Y1510 HydrophobicContact CD1-CD2 4.18Å; L1506-Y1510 HydrophobicContact CD1-CE2 3.52Å; L1506-Y1510 HydrophobicContact CD2-CD2 3.99Å; L1506-Y1510 HydrophobicContact CD2-CE2 3.66Å; L1506-Y1510 HydrophobicContact CG-CD2 4.23Å; L1506-Y1510 HydrophobicContact CG-CE2 3.9Å; L1506-Y1510 VanDerWaalsContact O-CD2 3.26Å; L1506-Y1510 WeakPolarHBondContact O-CD2 3.34Å; L1506-Y1510 PolarHBondContact O-N 2.95Å; L1506-Y1510 VanDerWaalsContact O-N 3.14Å
1507	H	89.8	Confident	87.5	Confident	131.2 Å²	131.2	84.8 Å²	84.8	61%	0.607	42%	0.415	S	S	*	.	H	α-helix	trans	-62.1	-46.9	175.5	-137.7	-32.6	0	0	0	111.1	R1503 N1504 F1509 Y1510 C1511	R1503-H1507 WeakPolarHBondContact O-CB 3.25Å; R1503-H1507 PolarHBondContact O-CD2 3.22Å; R1503-H1507 PolarHBondContact O-N 3.03Å; N1504-H1507 PolarHBondContact O-N 2.86Å; H1507-F1509 VanDerWaalsContact C-N 3.33Å; H1507-F1509 PolarHBondContact O-N 3.1Å; H1507-Y1510 PolarHBondContact O-N 2.96Å; H1507-C1511 PolarHBondContact CE1-SG 3.38Å; H1507-C1511 PolarHBondContact ND1-SG 3.07Å; H1507-C1511 VanDerWaalsContact ND1-SG 3.42Å; H1507-C1511 PolarHBondContact O-N 3.09Å; H1507-C1511 VanDerWaalsContact O-N 3.11Å; H1507-C1511 PolarHBondContact O-SG 3.04Å; H1507-C1511 VanDerWaalsContact O-SG 3.33Å
1508	R	89.1	Confident	87.5	Confident	164.2 Å²	164.2	83.8 Å²	83.8	62%	0.62	41%	0.411	S	S	*	.	H	α-helix	trans	-60.7	-41.8	176.5	-162.3	173.5	-178.8	169.9	3.6	112.2	N1504 R1505 Y1510 C1511 D1512	N1504-R1508 VanDerWaalsContact O-CB 3.26Å; N1504-R1508 WeakPolarHBondContact O-CB 3.42Å; N1504-R1508 VanDerWaalsContact O-CG 3.26Å; N1504-R1508 WeakPolarHBondContact O-CG 3.34Å; N1504-R1508 PolarHBondContact O-N 2.98Å; R1505-R1508 PolarHBondContact O-N 3.14Å; R1508-Y1510 VanDerWaalsContact C-N 3.33Å; R1508-Y1510 PolarHBondContact O-N 3.07Å; R1508-C1511 WeakPolarHBondContact O-CA 3.45Å; R1508-C1511 WeakPolarHBondContact O-CB 3.38Å; R1508-C1511 PolarHBondContact O-N 2.95Å; R1508-C1511 VanDerWaalsContact O-N 3.1Å; R1508-D1512 VanDerWaalsContact CG-OD2 3.25Å; R1508-D1512 WeakPolarHBondContact CG-OD2 3.42Å; R1508-D1512 IonicContact CZ-OD2 2.76Å; R1508-D1512 IonicContact NE-OD2 3.52Å; R1508-D1512 PolarHBondContact NE-OD2 2.95Å; R1508-D1512 IonicContact NH2-OD2 3.51Å; R1508-D1512 WeakPolarHBondContact O-CB 3.14Å; R1508-D1512 PolarHBondContact O-N 2.98Å; R1508-D1512 VanDerWaalsContact O-N 3.1Å
1509	F	87.6	Confident	87.6	Confident	62 Å²	62	81.6 Å²	81.6	27%	0.272	40%	0.402	S	S	.	.	H	α-helix	trans	-56.3	-46.6	177.1	178.6	-97.3	0	0	0	111.9	D1449 I1453 R1505 L1506 H1507 C1511 D1512 Y1513	D1449-F1509 HydrophobicContact CB-CE1 4.12Å; I1453-F1509 HydrophobicContact CD1-CB 3.82Å; I1453-F1509 HydrophobicContact CD1-CD1 3.68Å; I1453-F1509 HydrophobicContact CD1-CD2 4.1Å; I1453-F1509 HydrophobicContact CD1-CE1 4.24Å; I1453-F1509 HydrophobicContact CD1-CG 3.59Å; I1453-F1509 HydrophobicContact CG1-CD2 4.46Å; I1453-F1509 HydrophobicContact CG1-CG 4.4Å; R1505-F1509 VanDerWaalsContact O-CB 3.29Å; R1505-F1509 WeakPolarHBondContact O-CB 3.31Å; R1505-F1509 PolarHBondContact O-N 3.05Å; L1506-F1509 WeakPolarHBondContact O-CB 3.45Å; L1506-F1509 PolarHBondContact O-N 3.16Å; H1507-F1509 VanDerWaalsContact C-N 3.33Å; H1507-F1509 PolarHBondContact O-N 3.1Å; F1509-C1511 VanDerWaalsContact C-N 3.31Å; F1509-C1511 PolarHBondContact O-N 3.12Å; F1509-D1512 PolarHBondContact O-N 3.03Å; F1509-Y1513 AromaticContact CD2-CD2 3.58Å; F1509-Y1513 HydrophobicContact CD2-CD2 3.84Å; F1509-Y1513 HydrophobicContact CD2-CE2 4.09Å; F1509-Y1513 HydrophobicContact CD2-CG 4.32Å; F1509-Y1513 AromaticContact CE2-CD2 3.81Å; F1509-Y1513 HydrophobicContact CE2-CD2 4.01Å; F1509-Y1513 HydrophobicContact CE2-CE2 4.38Å; F1509-Y1513 HydrophobicContact CE2-CG 4.15Å; F1509-Y1513 HydrophobicContact CG-CD2 4.28Å; F1509-Y1513 WeakPolarHBondContact O-CB 3.38Å; F1509-Y1513 WeakPolarHBondContact O-CD2 3.45Å; F1509-Y1513 PolarHBondContact O-N 3.02Å
1510	Y	86.4	Confident	87.8	Confident	64.6 Å²	64.6	80.8 Å²	80.8	25%	0.253	39%	0.391	S	S	.	.	H	α-helix	trans	-76.3	-13.2	177.2	-69.2	-60.5	0	0	0	114.7	K1446 D1449 L1506 H1507 R1508 F1515	K1446-Y1510 HydrophobicContact CG-CE1 4.48Å; K1446-Y1510 HydrophobicContact CG-CE2 4.43Å; K1446-Y1510 VanDerWaalsContact CG-OH 3.27Å; K1446-Y1510 WeakPolarHBondContact CG-OH 3.3Å; K1446-Y1510 PolarHBondContact O-OH 3.15Å; D1449-Y1510 HydrophobicContact CB-CE1 4.42Å; D1449-Y1510 VanDerWaalsContact CB-OH 3.28Å; D1449-Y1510 WeakPolarHBondContact CB-OH 3.31Å; D1449-Y1510 PolarHBondContact OD2-OH 3.11Å; L1506-Y1510 HydrophobicContact CD1-CD2 4.18Å; L1506-Y1510 HydrophobicContact CD1-CE2 3.52Å; L1506-Y1510 HydrophobicContact CD2-CD2 3.99Å; L1506-Y1510 HydrophobicContact CD2-CE2 3.66Å; L1506-Y1510 HydrophobicContact CG-CD2 4.23Å; L1506-Y1510 HydrophobicContact CG-CE2 3.9Å; L1506-Y1510 VanDerWaalsContact O-CD2 3.26Å; L1506-Y1510 WeakPolarHBondContact O-CD2 3.34Å; L1506-Y1510 PolarHBondContact O-N 2.95Å; L1506-Y1510 VanDerWaalsContact O-N 3.14Å; H1507-Y1510 PolarHBondContact O-N 2.96Å; R1508-Y1510 VanDerWaalsContact C-N 3.33Å; R1508-Y1510 PolarHBondContact O-N 3.07Å; Y1510-F1515 HydrophobicContact CE1-CB 4.25Å; Y1510-F1515 HydrophobicContact CE1-CD1 4.32Å; Y1510-F1515 HydrophobicContact CE1-CD2 4.1Å; Y1510-F1515 HydrophobicContact CE1-CE2 4.49Å
1511	C	86.8	Confident	87.9	Confident	93.8 Å²	93.8	76.4 Å²	76.4	63%	0.634	37%	0.372	S	S	*	.	H	α-helix	trans	-79.4	-38.5	168.6	-67.2	0	0	0	0	111.6	H1507 R1508 F1509	H1507-C1511 PolarHBondContact CE1-SG 3.38Å; H1507-C1511 PolarHBondContact ND1-SG 3.07Å; H1507-C1511 VanDerWaalsContact ND1-SG 3.42Å; H1507-C1511 PolarHBondContact O-N 3.09Å; H1507-C1511 VanDerWaalsContact O-N 3.11Å; H1507-C1511 PolarHBondContact O-SG 3.04Å; H1507-C1511 VanDerWaalsContact O-SG 3.33Å; R1508-C1511 WeakPolarHBondContact O-CA 3.45Å; R1508-C1511 WeakPolarHBondContact O-CB 3.38Å; R1508-C1511 PolarHBondContact O-N 2.95Å; R1508-C1511 VanDerWaalsContact O-N 3.1Å; F1509-C1511 VanDerWaalsContact C-N 3.31Å; F1509-C1511 PolarHBondContact O-N 3.12Å
1512	D	83.5	Confident	88.2	Confident	102.2 Å²	102.2	75.8 Å²	75.8	55%	0.547	37%	0.367	S	S	.	.	H	α-helix	trans	-89.8	-29	-173.3	-65.9	-16.6	0	0	0	112.7	R1508 F1509	R1508-D1512 VanDerWaalsContact CG-OD2 3.25Å; R1508-D1512 WeakPolarHBondContact CG-OD2 3.42Å; R1508-D1512 IonicContact CZ-OD2 2.76Å; R1508-D1512 IonicContact NE-OD2 3.52Å; R1508-D1512 PolarHBondContact NE-OD2 2.95Å; R1508-D1512 IonicContact NH2-OD2 3.51Å; R1508-D1512 WeakPolarHBondContact O-CB 3.14Å; R1508-D1512 PolarHBondContact O-N 2.98Å; R1508-D1512 VanDerWaalsContact O-N 3.1Å; F1509-D1512 PolarHBondContact O-N 3.03Å
1513	Y	79.1	Confident	88.4	Confident	137.8 Å²	137.8	75 Å²	75	54%	0.54	37%	0.367	S	S	.	.	S	Bend	trans	-124.8	138.2	-175.2	-62.2	-85.5	0	0	0	112.8	F1509	F1509-Y1513 AromaticContact CD2-CD2 3.58Å; F1509-Y1513 HydrophobicContact CD2-CD2 3.84Å; F1509-Y1513 HydrophobicContact CD2-CE2 4.09Å; F1509-Y1513 HydrophobicContact CD2-CG 4.32Å; F1509-Y1513 AromaticContact CE2-CD2 3.81Å; F1509-Y1513 HydrophobicContact CE2-CD2 4.01Å; F1509-Y1513 HydrophobicContact CE2-CE2 4.38Å; F1509-Y1513 HydrophobicContact CE2-CG 4.15Å; F1509-Y1513 HydrophobicContact CG-CD2 4.28Å; F1509-Y1513 WeakPolarHBondContact O-CB 3.38Å; F1509-Y1513 WeakPolarHBondContact O-CD2 3.45Å; F1509-Y1513 PolarHBondContact O-N 3.02Å
1514	A	75.8	Confident	88.7	Confident	96.6 Å²	96.6	67.5 Å²	67.5	80%	0.798	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-73.6	137.4	167.1	0	0	0	0	0	110.1	S1516	A1514-S1516 PolarHBondContact O-N 3.2Å
1515	F	76.6	Confident	88.9	Confident	76.2 Å²	76.2	64.6 Å²	64.6	33%	0.334	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-60.9	132.6	175.5	141.1	-103.3	0	0	0	110.8	P1442 C1445 K1446 D1449 Y1510 D1517	P1442-F1515 HydrophobicContact CB-CE1 4.02Å; P1442-F1515 HydrophobicContact CB-CE2 3.86Å; P1442-F1515 HydrophobicContact CB-CZ 4.06Å; P1442-F1515 WeakPolarHBondContact O-CZ 3.26Å; C1445-F1515 HydrophobicContact CB-CD2 4.09Å; C1445-F1515 HydrophobicContact CB-CE1 4.28Å; C1445-F1515 HydrophobicContact CB-CE2 3.95Å; C1445-F1515 HydrophobicContact CB-CZ 3.58Å; K1446-F1515 HydrophobicContact CB-CE2 4.14Å; K1446-F1515 HydrophobicContact CB-CZ 4.42Å; D1449-F1515 WeakPolarHBondContact OD2-CB 3.44Å; D1449-F1515 WeakPolarHBondContact OD2-CE2 3.49Å; Y1510-F1515 HydrophobicContact CE1-CB 4.25Å; Y1510-F1515 HydrophobicContact CE1-CD1 4.32Å; Y1510-F1515 HydrophobicContact CE1-CD2 4.1Å; Y1510-F1515 HydrophobicContact CE1-CE2 4.49Å; F1515-D1517 HydrophobicContact CD1-CB 4.09Å; F1515-D1517 HydrophobicContact CD2-CB 4.33Å; F1515-D1517 HydrophobicContact CE1-CB 3.73Å; F1515-D1517 HydrophobicContact CE2-CB 4.24Å; F1515-D1517 HydrophobicContact CZ-CB 4.37Å; F1515-D1517 PolarHBondContact O-N 3.41Å
1516	S	79.5	Confident	89.3	Confident	62.6 Å²	62.6	63.1 Å²	63.1	44%	0.438	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-90.6	118	176.8	-174.4	0	0	0	0	110	C1445 A1514 E1518	C1445-S1516 VanDerWaalsContact CB-O 3.31Å; C1445-S1516 WeakPolarHBondContact CB-O 3.33Å; C1445-S1516 PolarHBondContact SG-O 3.17Å; C1445-S1516 VanDerWaalsContact SG-O 3.33Å; A1514-S1516 PolarHBondContact O-N 3.2Å; S1516-E1518 WeakPolarHBondContact CA-OE2 3.22Å; S1516-E1518 WeakPolarHBondContact CB-OE2 3.39Å; S1516-E1518 PolarHBondContact OG-OE2 2.91Å
1517	D	88.7	Confident	89.7	Confident	36 Å²	36	61.9 Å²	61.9	19%	0.193	32%	0.316	C	S	.	.			trans	-118.7	24.3	179.6	64.9	-21.6	0	0	0	112.2	K1439 D1440 F1515 L1519	K1439-D1517 CarbonylContact C-O 3.43Å; K1439-D1517 VanDerWaalsContact CA-O 3.26Å; K1439-D1517 WeakPolarHBondContact CA-O 3.3Å; K1439-D1517 HydrophobicContact CD-CB 4.44Å; K1439-D1517 VanDerWaalsContact CD-CG 3.5Å; K1439-D1517 WeakPolarHBondContact CD-O 3.26Å; K1439-D1517 WeakPolarHBondContact CD-OD1 3.28Å; K1439-D1517 WeakPolarHBondContact CD-OD2 3.4Å; K1439-D1517 VanDerWaalsContact CE-OD1 3.3Å; K1439-D1517 WeakPolarHBondContact CE-OD1 3.41Å; K1439-D1517 VanDerWaalsContact CE-OD2 3.24Å; K1439-D1517 WeakPolarHBondContact CE-OD2 3.32Å; K1439-D1517 WeakPolarHBondContact CG-OD2 3.42Å; K1439-D1517 IonicContact NZ-OD1 3.57Å; K1439-D1517 PolarHBondContact NZ-OD1 3.14Å; K1439-D1517 IonicContact NZ-OD2 3.07Å; D1440-D1517 PolarHBondContact N-O 2.94Å; F1515-D1517 HydrophobicContact CD1-CB 4.09Å; F1515-D1517 HydrophobicContact CD2-CB 4.33Å; F1515-D1517 HydrophobicContact CE1-CB 3.73Å; F1515-D1517 HydrophobicContact CE2-CB 4.24Å; F1515-D1517 HydrophobicContact CZ-CB 4.37Å; F1515-D1517 PolarHBondContact O-N 3.41Å; D1517-L1519 PolarHBondContact O-N 2.85Å
1518	E	90.3	Very high	90	Very high	73.4 Å²	73.4	59.3 Å²	59.3	34%	0.343	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	112.9	179.9	-44.8	179.1	169.6	0	0	110.8	E1437 S1516 T1521 R1584	E1437-E1518 HydrophobicContact CG-CB 4.49Å; E1437-E1518 HydrophobicContact CG-CG 4.07Å; E1437-E1518 WeakPolarHBondContact OE1-CB 3.38Å; E1437-E1518 VanDerWaalsContact OE1-CG 3.23Å; E1437-E1518 WeakPolarHBondContact OE1-CG 3.33Å; S1516-E1518 WeakPolarHBondContact CA-OE2 3.22Å; S1516-E1518 WeakPolarHBondContact CB-OE2 3.39Å; S1516-E1518 PolarHBondContact OG-OE2 2.91Å; E1518-T1521 PolarHBondContact OE2-OG1 3.33Å; E1518-T1521 VanDerWaalsContact OE2-OG1 3.08Å; E1518-R1584 VanDerWaalsContact O-CA 3.32Å; E1518-R1584 WeakPolarHBondContact O-CA 3.34Å
1519	L	94.7	Very high	90.3	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	-43.9	170.2	175.4	59.2	0	0	0	111.2	I1438 D1440 D1517 L1583 R1584 T1661 W1664 F1665 R1668	I1438-L1519 VanDerWaalsContact O-CB 3.31Å; I1438-L1519 WeakPolarHBondContact O-CB 3.34Å; I1438-L1519 PolarHBondContact O-N 2.93Å; D1440-L1519 HydrophobicContact CB-CB 3.73Å; D1440-L1519 WeakPolarHBondContact OD2-CD1 3.31Å; D1517-L1519 PolarHBondContact O-N 2.85Å; L1519-L1583 WeakPolarHBondContact O-CA 3.47Å; L1519-R1584 HydrophobicContact CD1-CG 4.2Å; L1519-R1584 PolarHBondContact O-N 3.07Å; L1519-T1661 HydrophobicContact CD1-CG2 3.76Å; L1519-W1664 VanDerWaalsContact CD1-CD1 3.48Å; L1519-W1664 HydrophobicContact CD1-CG 4.39Å; L1519-W1664 HydrophobicContact CD2-CG 4.2Å; L1519-F1665 HydrophobicContact CD2-CB 4.3Å; L1519-F1665 HydrophobicContact CG-CB 4.31Å; L1519-R1668 HydrophobicContact CD2-CB 4.26Å; L1519-R1668 HydrophobicContact CD2-CG 3.58Å; L1519-R1668 VanDerWaalsContact CD2-CG 3.48Å
1520	F	95.4	Very high	90.7	Very high	24.6 Å²	24.6	52.3 Å²	52.3	11%	0.108	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	132.6	-176.9	172.6	-94	0	0	0	110.6	E1437 I1438 F1522 L1581 Q1582 L1583 F1665	E1437-F1520 CarbonylContact C-O 3.54Å; E1437-F1520 WeakPolarHBondContact CA-O 3.41Å; I1438-F1520 HydrophobicContact CB-CB 4.42Å; I1438-F1520 HydrophobicContact CD1-CD1 4.22Å; I1438-F1520 HydrophobicContact CG1-CD1 4.38Å; I1438-F1520 PolarHBondContact N-O 3.14Å; I1438-F1520 PolarHBondContact O-N 3.04Å; F1520-F1522 HydrophobicContact CE1-CB 3.89Å; F1520-F1522 HydrophobicContact CZ-CB 4.25Å; F1520-L1581 HydrophobicContact CE2-CB 4.24Å; F1520-L1581 HydrophobicContact CE2-CD1 4.1Å; F1520-L1581 HydrophobicContact CE2-CD2 4.3Å; F1520-L1581 HydrophobicContact CE2-CG 4.47Å; F1520-L1581 HydrophobicContact CZ-CB 4.44Å; F1520-L1581 HydrophobicContact CZ-CD1 4.24Å; F1520-L1581 HydrophobicContact CZ-CD2 4.02Å; F1520-Q1582 WeakPolarHBondContact CA-O 3.41Å; F1520-Q1582 WeakPolarHBondContact CD2-O 3.27Å; F1520-L1583 HydrophobicContact CB-CD2 4.34Å; F1520-L1583 HydrophobicContact CD2-CD2 3.82Å; F1520-L1583 HydrophobicContact CD2-CG 4.48Å; F1520-F1665 HydrophobicContact CB-CD2 3.54Å; F1520-F1665 HydrophobicContact CB-CE2 3.63Å; F1520-F1665 HydrophobicContact CB-CG 4.46Å; F1520-F1665 HydrophobicContact CB-CZ 4.49Å; F1520-F1665 HydrophobicContact CD1-CD2 4.29Å; F1520-F1665 AromaticContact CD1-CE2 3.47Å; F1520-F1665 HydrophobicContact CD1-CE2 3.47Å; F1520-F1665 VanDerWaalsContact CD1-CE2 3.45Å; F1520-F1665 AromaticContact CD1-CZ 3.92Å; F1520-F1665 HydrophobicContact CD1-CZ 4Å; F1520-F1665 HydrophobicContact CD2-CD2 4.15Å; F1520-F1665 HydrophobicContact CD2-CE1 4.42Å; F1520-F1665 AromaticContact CD2-CE2 3.76Å; F1520-F1665 HydrophobicContact CD2-CE2 3.76Å; F1520-F1665 AromaticContact CD2-CZ 3.86Å; F1520-F1665 HydrophobicContact CD2-CZ 3.95Å; F1520-F1665 AromaticContact CE1-CE2 3.92Å; F1520-F1665 HydrophobicContact CE1-CE2 3.98Å; F1520-F1665 AromaticContact CE1-CZ 3.96Å; F1520-F1665 HydrophobicContact CE1-CZ 4.04Å; F1520-F1665 HydrophobicContact CE2-CE1 4.45Å; F1520-F1665 AromaticContact CE2-CE2 3.93Å; F1520-F1665 HydrophobicContact CE2-CE2 4.23Å; F1520-F1665 AromaticContact CE2-CZ 3.9Å; F1520-F1665 HydrophobicContact CE2-CZ 3.99Å; F1520-F1665 AromaticContact CG-CD2 3.75Å; F1520-F1665 HydrophobicContact CG-CD2 3.75Å; F1520-F1665 AromaticContact CG-CE2 3.32Å; F1520-F1665 HydrophobicContact CG-CE2 3.32Å; F1520-F1665 AromaticContact CG-CZ 3.9Å; F1520-F1665 HydrophobicContact CG-CZ 3.93Å; F1520-F1665 HydrophobicContact CZ-CE2 4.32Å; F1520-F1665 AromaticContact CZ-CZ 3.99Å; F1520-F1665 HydrophobicContact CZ-CZ 4.03Å
1521	T	96.3	Very high	91	Very high	17.2 Å²	17.2	49.9 Å²	49.9	11%	0.106	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	121.7	-179.8	-48.1	0	0	0	0	109.6	I1435 I1436 E1437 E1518 T1523 Q1582	I1435-T1521 HydrophobicContact CG2-CG2 4.05Å; I1436-T1521 WeakPolarHBondContact O-CA 3.44Å; E1437-T1521 HydrophobicContact CG-CG2 4.33Å; E1518-T1521 PolarHBondContact OE2-OG1 3.33Å; E1518-T1521 VanDerWaalsContact OE2-OG1 3.08Å; T1521-T1523 HydrophobicContact CG2-CG2 3.89Å; T1521-Q1582 PolarHBondContact N-O 3.02Å; T1521-Q1582 WeakPolarHBondContact O-CB 3.35Å; T1521-Q1582 PolarHBondContact O-N 2.97Å
1522	F	96.4	Very high	91.3	Very high	27 Å²	27	45.5 Å²	45.5	12%	0.118	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	128.5	171.9	170.8	-73.4	0	0	0	107.8	F1434 I1435 I1436 F1520 M1524 W1579 L1581	F1434-F1522 HydrophobicContact CD1-CD1 4.31Å; F1434-F1522 AromaticContact CD1-CE1 3.78Å; F1434-F1522 HydrophobicContact CD1-CE1 3.78Å; F1434-F1522 HydrophobicContact CE1-CD1 4.31Å; F1434-F1522 AromaticContact CE1-CE1 3.68Å; F1434-F1522 HydrophobicContact CE1-CE1 3.68Å; F1434-F1522 HydrophobicContact CE1-CZ 4.4Å; I1435-F1522 CarbonylContact C-O 3.49Å; I1435-F1522 VanDerWaalsContact CA-O 3.28Å; I1435-F1522 WeakPolarHBondContact CA-O 3.34Å; I1436-F1522 HydrophobicContact CB-CB 4.06Å; I1436-F1522 HydrophobicContact CB-CD1 4.38Å; I1436-F1522 HydrophobicContact CB-CG 4.48Å; I1436-F1522 HydrophobicContact CD1-CB 4.13Å; I1436-F1522 HydrophobicContact CD1-CD1 3.98Å; I1436-F1522 HydrophobicContact CD1-CD2 4.16Å; I1436-F1522 HydrophobicContact CD1-CE1 4.36Å; I1436-F1522 HydrophobicContact CD1-CG 4.27Å; I1436-F1522 HydrophobicContact CG1-CB 4.25Å; I1436-F1522 HydrophobicContact CG1-CD1 4.05Å; I1436-F1522 HydrophobicContact CG1-CG 4.23Å; I1436-F1522 PolarHBondContact N-O 3.26Å; I1436-F1522 PolarHBondContact O-N 3.09Å; F1520-F1522 HydrophobicContact CE1-CB 3.89Å; F1520-F1522 HydrophobicContact CZ-CB 4.25Å; F1522-M1524 HydrophobicContact CE1-CB 4.19Å; F1522-M1524 HydrophobicContact CE1-CE 4.35Å; F1522-M1524 HydrophobicContact CE1-CG 3.78Å; F1522-M1524 HydrophobicContact CE1-SD 3.92Å; F1522-M1524 HydrophobicContact CE2-CE 4.43Å; F1522-M1524 HydrophobicContact CZ-CE 3.67Å; F1522-M1524 HydrophobicContact CZ-CG 3.94Å; F1522-M1524 HydrophobicContact CZ-SD 3.77Å; F1522-W1579 AromaticContact CD2-NE1 3.78Å; F1522-W1579 AromaticContact CE1-NE1 3.97Å; F1522-W1579 AromaticContact CE2-CE2 3.78Å; F1522-W1579 AromaticContact CE2-CZ2 3.93Å; F1522-W1579 HydrophobicContact CE2-CZ2 3.93Å; F1522-W1579 AromaticContact CE2-NE1 3.11Å; F1522-W1579 AromaticContact CZ-CD1 3.81Å; F1522-W1579 AromaticContact CZ-CE2 3.93Å; F1522-W1579 HydrophobicContact CZ-CZ2 4.37Å; F1522-W1579 AromaticContact CZ-NE1 3.41Å; F1522-L1581 HydrophobicContact CB-CD2 4Å; F1522-L1581 HydrophobicContact CD2-CD2 3.19Å; F1522-L1581 HydrophobicContact CE2-CD2 3.91Å; F1522-L1581 HydrophobicContact CG-CD2 3.9Å
1523	T	97.2	Very high	91.7	Very high	23.6 Å²	23.6	40.7 Å²	40.7	15%	0.145	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	136	177.3	64.9	0	0	0	0	112.2	F1434 I1435 T1521 W1579 R1580	F1434-T1523 CarbonylContact O-C 3.51Å; F1434-T1523 VanDerWaalsContact O-CA 3.26Å; F1434-T1523 WeakPolarHBondContact O-CA 3.3Å; I1435-T1523 HydrophobicContact CG1-CG2 4.16Å; I1435-T1523 HydrophobicContact CG2-CG2 4.27Å; T1521-T1523 HydrophobicContact CG2-CG2 3.89Å; T1523-W1579 CarbonylContact O-C 3.53Å; T1523-W1579 WeakPolarHBondContact O-CA 3.43Å; T1523-R1580 PolarHBondContact N-O 3.07Å; T1523-R1580 PolarHBondContact O-N 2.84Å
1524	M	97.5	Very high	92.2	Very high	10.6 Å²	10.6	34.2 Å²	34.2	5%	0.052	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	122	166.7	-73.1	176.4	160.7	0	0	109.7	F1434 F1522 L1527 M1574 V1576 R1578 W1579	F1434-M1524 HydrophobicContact CB-CB 4.26Å; F1434-M1524 HydrophobicContact CD1-CB 4.42Å; F1434-M1524 HydrophobicContact CD1-SD 4.22Å; F1434-M1524 PolarHBondContact N-O 3.04Å; F1434-M1524 PolarHBondContact O-N 3Å; F1522-M1524 HydrophobicContact CE1-CB 4.19Å; F1522-M1524 HydrophobicContact CE1-CE 4.35Å; F1522-M1524 HydrophobicContact CE1-CG 3.78Å; F1522-M1524 HydrophobicContact CE1-SD 3.92Å; F1522-M1524 HydrophobicContact CE2-CE 4.43Å; F1522-M1524 HydrophobicContact CZ-CE 3.67Å; F1522-M1524 HydrophobicContact CZ-CG 3.94Å; F1522-M1524 HydrophobicContact CZ-SD 3.77Å; M1524-L1527 HydrophobicContact CB-CB 4.4Å; M1524-L1527 HydrophobicContact CB-CD2 4.45Å; M1524-L1527 HydrophobicContact SD-CD1 4.17Å; M1524-L1527 HydrophobicContact SD-CD2 4.06Å; M1524-M1574 HydrophobicContact CE-CE 4.44Å; M1524-V1576 HydrophobicContact CB-CG1 4.06Å; M1524-V1576 HydrophobicContact CE-CG2 4.4Å; M1524-V1576 HydrophobicContact CG-CG1 4.17Å; M1524-V1576 HydrophobicContact SD-CG2 4.47Å; M1524-R1578 CarbonylContact C-O 3.49Å; M1524-R1578 VanDerWaalsContact CA-O 3.32Å; M1524-R1578 WeakPolarHBondContact CA-O 3.3Å; M1524-W1579 HydrophobicContact CE-CB 4.36Å; M1524-W1579 HydrophobicContact CE-CD2 3.47Å; M1524-W1579 VanDerWaalsContact CE-CD2 3.46Å; M1524-W1579 VanDerWaalsContact CE-CE2 3.45Å; M1524-W1579 HydrophobicContact CE-CE3 3.87Å; M1524-W1579 HydrophobicContact CE-CG 3.78Å; M1524-W1579 HydrophobicContact CE-CH2 4.17Å; M1524-W1579 HydrophobicContact CE-CZ2 3.92Å; M1524-W1579 HydrophobicContact CE-CZ3 4.16Å; M1524-W1579 HydrophobicContact CG-CB 4.19Å; M1524-W1579 VanDerWaalsContact CG-CD1 3.47Å; M1524-W1579 HydrophobicContact CG-CD2 4.48Å; M1524-W1579 HydrophobicContact CG-CG 3.92Å
1525	D	97.9	Very high	92.7	Very high	39.2 Å²	39.2	33.8 Å²	33.8	21%	0.21	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	135.4	176.8	-59.8	-45.8	0	0	0	109.8	K1433 L1527 V1576 E1577 R1578	K1433-D1525 WeakPolarHBondContact CD-OD1 3.38Å; K1433-D1525 WeakPolarHBondContact CE-OD1 3.49Å; K1433-D1525 IonicContact NZ-OD1 3.27Å; K1433-D1525 PolarHBondContact NZ-OD1 2.8Å; D1525-L1527 VanDerWaalsContact C-N 3.35Å; D1525-L1527 PolarHBondContact O-N 3Å; D1525-V1576 WeakPolarHBondContact O-CG1 3.28Å; D1525-E1577 PolarHBondContact O-N 3.15Å; D1525-E1577 VanDerWaalsContact O-N 3.11Å; D1525-R1578 HydrophobicContact CB-CB 4.21Å; D1525-R1578 PolarHBondContact N-O 2.89Å
1526	N	97.7	Very high	93.1	Very high	52 Å²	52	32.2 Å²	32.2	28%	0.278	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	53.3	44.9	178.8	-162.6	18.4	0	0	0	114.6	I1431 K1432 K1528 E1577	I1431-N1526 CarbonylContact O-C 3.53Å; I1431-N1526 WeakPolarHBondContact O-CA 3.28Å; K1432-N1526 PolarHBondContact O-N 2.9Å; N1526-K1528 VanDerWaalsContact CG-NZ 3.25Å; N1526-K1528 PolarHBondContact ND2-NZ 3.28Å; N1526-K1528 WeakPolarHBondContact O-CG 3.31Å; N1526-K1528 PolarHBondContact O-N 2.83Å; N1526-K1528 PolarHBondContact O-NZ 3.15Å; N1526-K1528 VanDerWaalsContact OD1-CE 3.23Å; N1526-K1528 WeakPolarHBondContact OD1-CE 3.33Å; N1526-K1528 PolarHBondContact OD1-NZ 2.84Å; N1526-E1577 HydrophobicContact CB-CB 3.9Å; N1526-E1577 VanDerWaalsContact CB-OE2 3.23Å; N1526-E1577 WeakPolarHBondContact CB-OE2 3.44Å; N1526-E1577 PolarHBondContact ND2-OE2 3.22Å; N1526-E1577 VanDerWaalsContact ND2-OE2 3.16Å
1527	L	97.2	Very high	93.4	Very high	6 Å²	6	29.3 Å²	29.3	3%	0.031	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	123.9	178.8	173.3	64.6	0	0	0	111.7	H1430 I1431 F1434 M1524 D1525 I1529 M1574 N1575 V1576	H1430-L1527 CarbonylContact C-O 3.53Å; H1430-L1527 WeakPolarHBondContact CA-O 3.33Å; I1431-L1527 HydrophobicContact CB-CB 4.34Å; I1431-L1527 HydrophobicContact CD1-CD2 4.22Å; I1431-L1527 PolarHBondContact N-O 3.25Å; I1431-L1527 PolarHBondContact O-N 2.89Å; F1434-L1527 HydrophobicContact CB-CD2 4.37Å; F1434-L1527 HydrophobicContact CD1-CD2 4.14Å; F1434-L1527 HydrophobicContact CG-CD2 4.49Å; M1524-L1527 HydrophobicContact CB-CB 4.4Å; M1524-L1527 HydrophobicContact CB-CD2 4.45Å; M1524-L1527 HydrophobicContact SD-CD1 4.17Å; M1524-L1527 HydrophobicContact SD-CD2 4.06Å; D1525-L1527 VanDerWaalsContact C-N 3.35Å; D1525-L1527 PolarHBondContact O-N 3Å; L1527-I1529 HydrophobicContact CD1-CD1 3.93Å; L1527-I1529 HydrophobicContact CD1-CG1 3.76Å; L1527-I1529 HydrophobicContact CD2-CD1 4.13Å; L1527-I1529 HydrophobicContact CG-CD1 4.15Å; L1527-I1529 HydrophobicContact CG-CG1 4.19Å; L1527-M1574 HydrophobicContact CD1-CG 3.87Å; L1527-M1574 HydrophobicContact CD1-SD 4.12Å; L1527-N1575 CarbonylContact C-O 3.53Å; L1527-N1575 WeakPolarHBondContact CA-O 3.45Å; L1527-V1576 HydrophobicContact CB-CG2 4.45Å; L1527-V1576 HydrophobicContact CD1-CG2 3.5Å; L1527-V1576 VanDerWaalsContact CD1-CG2 3.48Å
1528	K	96.9	Very high	93.2	Very high	76.4 Å²	76.4	29.4 Å²	29.4	33%	0.332	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	121.2	174.4	-50.7	179.7	-174.9	139.7	0	109.3	I1429 H1430 N1526 M1574 N1575	I1429-K1528 CarbonylContact O-C 3.57Å; I1429-K1528 WeakPolarHBondContact O-CA 3.37Å; H1430-K1528 VanDerWaalsContact CD2-CG 3.49Å; H1430-K1528 WeakPolarHBondContact CD2-CG 3.46Å; H1430-K1528 WeakPolarHBondContact ND1-CG 3.27Å; N1526-K1528 VanDerWaalsContact CG-NZ 3.25Å; N1526-K1528 PolarHBondContact ND2-NZ 3.28Å; N1526-K1528 WeakPolarHBondContact O-CG 3.31Å; N1526-K1528 PolarHBondContact O-N 2.83Å; N1526-K1528 PolarHBondContact O-NZ 3.15Å; N1526-K1528 VanDerWaalsContact OD1-CE 3.23Å; N1526-K1528 WeakPolarHBondContact OD1-CE 3.33Å; N1526-K1528 PolarHBondContact OD1-NZ 2.84Å; K1528-M1574 CarbonylContact O-C 3.52Å; K1528-M1574 VanDerWaalsContact O-CA 3.27Å; K1528-M1574 WeakPolarHBondContact O-CA 3.35Å; K1528-N1575 HydrophobicContact CB-CB 4.38Å; K1528-N1575 PolarHBondContact N-O 3.13Å; K1528-N1575 PolarHBondContact NZ-OD1 2.85Å; K1528-N1575 PolarHBondContact O-N 3.18Å
1529	I	95.9	Very high	93	Very high	39.6 Å²	39.6	30.7 Å²	30.7	20%	0.203	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	131.2	179	-57.3	163.2	0	0	0	109	I1428 I1429 L1527 T1573 M1574	I1428-I1529 CarbonylContact C-O 3.56Å; I1428-I1529 WeakPolarHBondContact CA-O 3.41Å; I1429-I1529 HydrophobicContact CB-CB 4.34Å; I1429-I1529 HydrophobicContact CB-CD1 3.97Å; I1429-I1529 HydrophobicContact CD1-CD1 4.31Å; I1429-I1529 HydrophobicContact CG2-CD1 4.2Å; I1429-I1529 PolarHBondContact N-O 3Å; I1429-I1529 PolarHBondContact O-N 3Å; L1527-I1529 HydrophobicContact CD1-CD1 3.93Å; L1527-I1529 HydrophobicContact CD1-CG1 3.76Å; L1527-I1529 HydrophobicContact CD2-CD1 4.13Å; L1527-I1529 HydrophobicContact CG-CD1 4.15Å; L1527-I1529 HydrophobicContact CG-CG1 4.19Å; I1529-T1573 CarbonylContact C-O 3.49Å; I1529-T1573 VanDerWaalsContact CA-O 3.3Å; I1529-T1573 WeakPolarHBondContact CA-O 3.31Å; I1529-M1574 HydrophobicContact CG1-CB 4.38Å; I1529-M1574 HydrophobicContact CG1-CG 3.96Å; I1529-M1574 HydrophobicContact CG1-SD 4.42Å
1530	K	94.4	Very high	92.6	Very high	39 Å²	39	30.9 Å²	30.9	17%	0.17	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	131.2	164.6	-48.6	174.5	-171.7	170.7	0	108.3	H1306 E1309 H1310 R1427 I1428 L1532 I1572 T1573	H1306-K1530 PolarHBondContact O-NZ 2.81Å; E1309-K1530 IonicContact OE2-NZ 3.26Å; E1309-K1530 PolarHBondContact OE2-NZ 3.12Å; H1310-K1530 PolarHBondContact NE2-NZ 2.82Å; R1427-K1530 CarbonylContact O-C 3.55Å; R1427-K1530 WeakPolarHBondContact O-CA 3.3Å; I1428-K1530 HydrophobicContact CG2-CG 4.46Å; K1530-L1532 HydrophobicContact CB-CD2 4.26Å; K1530-I1572 CarbonylContact O-C 3.52Å; K1530-I1572 VanDerWaalsContact O-CA 3.27Å; K1530-I1572 WeakPolarHBondContact O-CA 3.27Å; K1530-T1573 WeakPolarHBondContact CB-OG1 3.33Å; K1530-T1573 WeakPolarHBondContact CD-OG1 3.37Å; K1530-T1573 WeakPolarHBondContact CG-OG1 3.34Å; K1530-T1573 PolarHBondContact N-O 3.02Å; K1530-T1573 PolarHBondContact O-N 3.18Å
1531	A	93.8	Very high	92.3	Very high	14.6 Å²	14.6	36.8 Å²	36.8	12%	0.121	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	107.3	170.6	0	0	0	0	0	109.1	R1427 R1570 I1571 I1572	R1427-A1531 HydrophobicContact CB-CB 4.27Å; R1427-A1531 PolarHBondContact N-O 3.16Å; R1427-A1531 VanDerWaalsContact N-O 3.15Å; R1427-A1531 PolarHBondContact O-N 3Å; A1531-R1570 HydrophobicContact CB-CB 4.26Å; A1531-R1570 HydrophobicContact CB-CG 4.29Å; A1531-R1570 PolarHBondContact O-NH1 3.27Å; A1531-R1570 VanDerWaalsContact O-NH1 3.12Å; A1531-I1571 WeakPolarHBondContact CA-O 3.43Å; A1531-I1572 HydrophobicContact CB-CG2 4.26Å
1532	L	93.6	Very high	92	Very high	0.2 Å²	0.2	39.1 Å²	39.1	0%	0.001	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	135.4	-171.7	-50.8	-176.4	0	0	0	110.8	R1307 H1310 L1315 D1426 K1530 R1570 I1571	R1307-L1532 HydrophobicContact CG-CD1 4.41Å; R1307-L1532 HydrophobicContact CG-CD2 4.46Å; H1310-L1532 HydrophobicContact CB-CD1 3.94Å; H1310-L1532 WeakPolarHBondContact CD2-CD1 3.2Å; H1310-L1532 VanDerWaalsContact CG-CD1 3.47Å; L1315-L1532 HydrophobicContact CD1-CB 4.44Å; L1315-L1532 HydrophobicContact CD2-CD1 4.22Å; D1426-L1532 HydrophobicContact CB-CD2 4.06Å; D1426-L1532 VanDerWaalsContact OD1-CA 3.28Å; D1426-L1532 WeakPolarHBondContact OD1-CA 3.29Å; D1426-L1532 WeakPolarHBondContact OD2-CD2 3.38Å; K1530-L1532 HydrophobicContact CB-CD2 4.26Å; L1532-R1570 VanDerWaalsContact C-CD 3.44Å; L1532-R1570 WeakPolarHBondContact O-CA 3.23Å; L1532-R1570 WeakPolarHBondContact O-CD 3.37Å; L1532-I1571 HydrophobicContact CB-CB 4.47Å; L1532-I1571 PolarHBondContact N-O 2.92Å; L1532-I1571 PolarHBondContact O-N 3.19Å; L1532-I1571 VanDerWaalsContact O-N 3.1Å
1533	A	91	Very high	91.9	Very high	1.6 Å²	1.6	37.9 Å²	37.9	1%	0.013	19%	0.193	C	C	.	.			trans	-87	150.6	165	0	0	0	0	0	110.4	R1307 I1423 K1424 D1426 R1570	R1307-A1533 PolarHBondContact NH1-O 3.08Å; R1307-A1533 PolarHBondContact NH2-O 2.92Å; I1423-A1533 HydrophobicContact CD1-CB 4.04Å; I1423-A1533 HydrophobicContact CG1-CB 3.65Å; I1423-A1533 HydrophobicContact CG2-CB 3.65Å; K1424-A1533 VanDerWaalsContact O-CB 3.25Å; K1424-A1533 WeakPolarHBondContact O-CB 3.31Å; D1426-A1533 PolarHBondContact OD1-N 3.02Å; A1533-R1570 VanDerWaalsContact N-NH1 3.19Å
1534	D	90.1	Very high	91.7	Very high	1.4 Å²	1.4	37.3 Å²	37.3	1%	0.007	19%	0.188	C	C	.	.			trans	-145.3	150.7	178.6	-168.7	59.9	0	0	0	111	R1307 L1315 L1316 T1317 S1536 I1537 T1538 I1571	R1307-D1534 IonicContact NH2-OD1 3.05Å; L1315-D1534 HydrophobicContact CD1-CB 3.64Å; L1315-D1534 VanDerWaalsContact CD1-CG 3.42Å; L1315-D1534 VanDerWaalsContact CD1-OD1 3.28Å; L1315-D1534 WeakPolarHBondContact CD1-OD1 3.19Å; L1315-D1534 WeakPolarHBondContact CG-OD1 3.33Å; L1316-D1534 PolarHBondContact N-OD1 3.13Å; L1316-D1534 VanDerWaalsContact N-OD1 3.12Å; T1317-D1534 WeakPolarHBondContact CB-OD1 3.23Å; T1317-D1534 PolarHBondContact N-OD1 3.01Å; T1317-D1534 PolarHBondContact OG1-OD1 3.06Å; D1534-S1536 PolarHBondContact O-N 3.1Å; D1534-S1536 WeakPolarHBondContact OD2-CB 3.22Å; D1534-S1536 PolarHBondContact OD2-N 2.93Å; D1534-S1536 VanDerWaalsContact OD2-N 3.07Å; D1534-S1536 PolarHBondContact OD2-OG 2.96Å; D1534-I1537 HydrophobicContact CB-CD1 4.35Å; D1534-I1537 HydrophobicContact CB-CG1 3.98Å; D1534-I1537 PolarHBondContact O-N 3.16Å; D1534-I1537 VanDerWaalsContact O-N 3.13Å; D1534-T1538 WeakPolarHBondContact O-CB 3.38Å; D1534-T1538 PolarHBondContact O-N 3.21Å; D1534-T1538 PolarHBondContact O-OG1 2.96Å; D1534-I1571 HydrophobicContact CB-CD1 4.29Å
1535	E	86.1	Confident	91.4	Very high	88.2 Å²	88.2	38.9 Å²	38.9	41%	0.412	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-58.4	-29.6	178.4	-81.8	157.1	-125.7	0	0	113.5	T1317 I1423 I1537 Q1542	T1317-E1535 WeakPolarHBondContact CA-OE1 3.04Å; T1317-E1535 VanDerWaalsContact CB-OE1 3.25Å; T1317-E1535 WeakPolarHBondContact CB-OE1 3.23Å; T1317-E1535 VanDerWaalsContact OG1-CD 3.29Å; T1317-E1535 VanDerWaalsContact OG1-CG 3.28Å; T1317-E1535 WeakPolarHBondContact OG1-CG 3.43Å; T1317-E1535 PolarHBondContact OG1-N 2.87Å; T1317-E1535 VanDerWaalsContact OG1-N 3.15Å; T1317-E1535 PolarHBondContact OG1-OE1 2.96Å; I1423-E1535 HydrophobicContact CD1-CG 3.77Å; I1423-E1535 WeakPolarHBondContact CD1-OE1 3.36Å; I1423-E1535 HydrophobicContact CG1-CG 4.19Å; E1535-I1537 PolarHBondContact O-N 2.87Å; E1535-Q1542 PolarHBondContact O-NE2 2.9Å; E1535-Q1542 PolarHBondContact O-OE1 3.32Å; E1535-Q1542 VanDerWaalsContact O-OE1 3.08Å
1536	S	85.3	Confident	91.1	Very high	42.4 Å²	42.4	38.6 Å²	38.6	30%	0.297	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-68.4	-17.8	178.4	61	0	0	0	0	114.5	D1534 Q1542	D1534-S1536 PolarHBondContact O-N 3.1Å; D1534-S1536 WeakPolarHBondContact OD2-CB 3.22Å; D1534-S1536 PolarHBondContact OD2-N 2.93Å; D1534-S1536 VanDerWaalsContact OD2-N 3.07Å; D1534-S1536 PolarHBondContact OD2-OG 2.96Å; S1536-Q1542 WeakPolarHBondContact O-CB 3.36Å; S1536-Q1542 PolarHBondContact O-OE1 3.19Å
1537	I	85.6	Confident	90.9	Very high	2.4 Å²	2.4	36.1 Å²	36.1	1%	0.012	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-138.8	22.6	-168.8	59	167.5	0	0	0	113.2	D1534 E1535 V1543 Q1546 C1569 I1571	D1534-I1537 HydrophobicContact CB-CD1 4.35Å; D1534-I1537 HydrophobicContact CB-CG1 3.98Å; D1534-I1537 PolarHBondContact O-N 3.16Å; D1534-I1537 VanDerWaalsContact O-N 3.13Å; E1535-I1537 PolarHBondContact O-N 2.87Å; I1537-V1543 VanDerWaalsContact O-CG2 3.27Å; I1537-V1543 WeakPolarHBondContact O-CG2 3.29Å; I1537-Q1546 HydrophobicContact CG2-CG 3.81Å; I1537-C1569 HydrophobicContact CB-CB 3.93Å; I1537-C1569 HydrophobicContact CD1-CB 4.09Å; I1537-C1569 VanDerWaalsContact CD1-SG 3.58Å; I1537-C1569 HydrophobicContact CG1-CB 4.42Å; I1537-I1571 HydrophobicContact CD1-CD1 4.39Å; I1537-I1571 HydrophobicContact CD1-CG1 4.05Å
1538	T	83.7	Confident	90.6	Very high	38.8 Å²	38.8	40.4 Å²	40.4	24%	0.238	21%	0.206	C	C	.	.			trans	-93.1	-35.8	-176.5	-70.2	0	0	0	0	112.7	D1534 Q1542	D1534-T1538 WeakPolarHBondContact O-CB 3.38Å; D1534-T1538 PolarHBondContact O-N 3.21Å; D1534-T1538 PolarHBondContact O-OG1 2.96Å; T1538-Q1542 VanDerWaalsContact N-OE1 3.14Å
1539	H	86	Confident	90.4	Very high	99.2 Å²	99.2	42.2 Å²	42.2	46%	0.459	22%	0.218	S	C	.	.	S	Bend	trans	-81.8	143.9	-179	-58.9	61.9	0	0	0	111.2	E1541 Q1542 V1543	H1539-E1541 VanDerWaalsContact C-N 3.31Å; H1539-E1541 PolarHBondContact O-N 3Å; H1539-Q1542 HydrophobicContact CB-CB 4.39Å; H1539-Q1542 HydrophobicContact CB-CG 4.06Å; H1539-Q1542 PolarHBondContact CD2-OE1 3.04Å; H1539-Q1542 VanDerWaalsContact N-OE1 3.11Å; H1539-Q1542 PolarHBondContact ND1-OE1 2.78Å; H1539-Q1542 WeakPolarHBondContact O-CB 3.33Å; H1539-Q1542 PolarHBondContact O-N 3.05Å; H1539-Q1542 VanDerWaalsContact O-N 3.08Å; H1539-V1543 WeakPolarHBondContact O-CG2 3.38Å; H1539-V1543 PolarHBondContact O-N 3.16Å
1540	G	87	Confident	90.3	Very high	5 Å²	5	40.7 Å²	40.7	5%	0.052	21%	0.21	C	C	.	.	H	α-helix	trans	-58.9	-39.1	-175.2	0	0	0	0	0	113.9	Q1542 V1543 I1544 E1561	G1540-Q1542 VanDerWaalsContact C-N 3.34Å; G1540-Q1542 PolarHBondContact O-N 3.08Å; G1540-V1543 WeakPolarHBondContact O-CB 3.39Å; G1540-V1543 PolarHBondContact O-N 3.14Å; G1540-V1543 VanDerWaalsContact O-N 3.15Å; G1540-I1544 WeakPolarHBondContact O-CB 3.15Å; G1540-I1544 WeakPolarHBondContact O-CG1 3.26Å; G1540-I1544 PolarHBondContact O-N 3.03Å; G1540-E1561 VanDerWaalsContact CA-CD 3.48Å; G1540-E1561 WeakPolarHBondContact CA-OE2 3.32Å; G1540-E1561 PolarHBondContact N-OE2 3.38Å; G1540-E1561 VanDerWaalsContact N-OE2 3.15Å
1541	E	89.7	Confident	90.1	Very high	149 Å²	149	39.4 Å²	39.4	70%	0.696	21%	0.205	S	C	*	.	H	α-helix	trans	-63.2	-40.1	175	-64.7	-161.4	166.3	0	0	112.7	H1539 V1543 I1544 A1545	H1539-E1541 VanDerWaalsContact C-N 3.31Å; H1539-E1541 PolarHBondContact O-N 3Å; E1541-V1543 VanDerWaalsContact C-N 3.33Å; E1541-V1543 PolarHBondContact O-N 2.75Å; E1541-I1544 PolarHBondContact O-N 3.03Å; E1541-A1545 WeakPolarHBondContact O-CB 3.43Å; E1541-A1545 PolarHBondContact O-N 2.94Å
1542	Q	90.2	Very high	89.9	Confident	64.4 Å²	64.4	42.7 Å²	42.7	30%	0.301	23%	0.227	S	C	.	.	H	α-helix	trans	-64	-40.9	174.2	-65.4	171.9	-31.8	0	0	111.1	E1535 S1536 T1538 H1539 G1540 I1544 A1545 Q1546	E1535-Q1542 PolarHBondContact O-NE2 2.9Å; E1535-Q1542 PolarHBondContact O-OE1 3.32Å; E1535-Q1542 VanDerWaalsContact O-OE1 3.08Å; S1536-Q1542 WeakPolarHBondContact O-CB 3.36Å; S1536-Q1542 PolarHBondContact O-OE1 3.19Å; T1538-Q1542 VanDerWaalsContact N-OE1 3.14Å; H1539-Q1542 HydrophobicContact CB-CB 4.39Å; H1539-Q1542 HydrophobicContact CB-CG 4.06Å; H1539-Q1542 PolarHBondContact CD2-OE1 3.04Å; H1539-Q1542 VanDerWaalsContact N-OE1 3.11Å; H1539-Q1542 PolarHBondContact ND1-OE1 2.78Å; H1539-Q1542 WeakPolarHBondContact O-CB 3.33Å; H1539-Q1542 PolarHBondContact O-N 3.05Å; H1539-Q1542 VanDerWaalsContact O-N 3.08Å; G1540-Q1542 VanDerWaalsContact C-N 3.34Å; G1540-Q1542 PolarHBondContact O-N 3.08Å; Q1542-I1544 VanDerWaalsContact C-N 3.35Å; Q1542-A1545 WeakPolarHBondContact O-CB 3.29Å; Q1542-A1545 PolarHBondContact O-N 2.99Å; Q1542-Q1546 WeakPolarHBondContact O-CG 3.38Å; Q1542-Q1546 PolarHBondContact O-N 3.14Å
1543	V	92.5	Very high	89.6	Confident	3.2 Å²	3.2	46.4 Å²	46.4	2%	0.019	25%	0.247	C	C	.	.	H	α-helix	trans	-63	-43.6	176.7	177.3	0	0	0	0	110.7	I1537 H1539 G1540 E1541 A1545 Q1546 M1547 L1567 C1569 V1603	I1537-V1543 VanDerWaalsContact O-CG2 3.27Å; I1537-V1543 WeakPolarHBondContact O-CG2 3.29Å; H1539-V1543 WeakPolarHBondContact O-CG2 3.38Å; H1539-V1543 PolarHBondContact O-N 3.16Å; G1540-V1543 WeakPolarHBondContact O-CB 3.39Å; G1540-V1543 PolarHBondContact O-N 3.14Å; G1540-V1543 VanDerWaalsContact O-N 3.15Å; E1541-V1543 VanDerWaalsContact C-N 3.33Å; E1541-V1543 PolarHBondContact O-N 2.75Å; V1543-A1545 VanDerWaalsContact C-N 3.34Å; V1543-A1545 PolarHBondContact O-N 3.22Å; V1543-Q1546 WeakPolarHBondContact O-CB 3.12Å; V1543-Q1546 PolarHBondContact O-N 3.09Å; V1543-Q1546 VanDerWaalsContact O-N 3.15Å; V1543-M1547 HydrophobicContact CG1-SD 4.35Å; V1543-M1547 WeakPolarHBondContact O-CG 3.23Å; V1543-M1547 PolarHBondContact O-N 3.08Å; V1543-L1567 HydrophobicContact CB-CD1 4.48Å; V1543-L1567 HydrophobicContact CB-CD2 4.46Å; V1543-L1567 HydrophobicContact CB-CG 4.33Å; V1543-L1567 HydrophobicContact CG1-CD1 3.63Å; V1543-L1567 HydrophobicContact CG1-CD2 4.43Å; V1543-L1567 HydrophobicContact CG1-CG 3.84Å; V1543-C1569 HydrophobicContact CB-CB 4.48Å; V1543-C1569 HydrophobicContact CG1-CB 4.07Å; V1543-C1569 HydrophobicContact CG2-CB 3.86Å; V1543-V1603 HydrophobicContact CG1-CB 4.39Å; V1543-V1603 HydrophobicContact CG1-CG1 3.48Å; V1543-V1603 VanDerWaalsContact CG1-CG1 3.45Å; V1543-V1603 HydrophobicContact CG1-CG2 4.27Å
1544	I	92.9	Very high	89.6	Confident	9.8 Å²	9.8	46.9 Å²	46.9	5%	0.05	25%	0.251	C	S	.	.	H	α-helix	trans	-62.5	-41	175.3	-72.6	166.8	0	0	0	111.1	G1540 E1541 Q1542 Q1546 M1547 K1548 W1556 T1560 F1564 L1567	G1540-I1544 WeakPolarHBondContact O-CB 3.15Å; G1540-I1544 WeakPolarHBondContact O-CG1 3.26Å; G1540-I1544 PolarHBondContact O-N 3.03Å; E1541-I1544 PolarHBondContact O-N 3.03Å; Q1542-I1544 VanDerWaalsContact C-N 3.35Å; I1544-Q1546 VanDerWaalsContact C-N 3.32Å; I1544-Q1546 PolarHBondContact O-N 3.16Å; I1544-M1547 HydrophobicContact CG1-SD 4.4Å; I1544-M1547 WeakPolarHBondContact O-CB 3.35Å; I1544-M1547 PolarHBondContact O-N 3.12Å; I1544-K1548 HydrophobicContact CG2-CD 4.4Å; I1544-K1548 WeakPolarHBondContact O-CG 3.33Å; I1544-K1548 PolarHBondContact O-N 3.05Å; I1544-W1556 HydrophobicContact CG2-CH2 4.04Å; I1544-W1556 HydrophobicContact CG2-CZ2 3.58Å; I1544-W1556 VanDerWaalsContact CG2-CZ2 3.45Å; I1544-T1560 VanDerWaalsContact CD1-C 3.5Å; I1544-F1564 HydrophobicContact CD1-CD2 4.49Å; I1544-F1564 HydrophobicContact CD1-CE2 4.17Å; I1544-F1564 HydrophobicContact CG1-CE2 4.33Å; I1544-L1567 HydrophobicContact CD1-CD2 4.33Å; I1544-L1567 HydrophobicContact CG1-CD2 4.16Å
1545	A	92.3	Very high	89.5	Confident	45.2 Å²	45.2	49.5 Å²	49.5	37%	0.374	27%	0.268	S	S	.	.	H	α-helix	trans	-60.6	-41.1	174.4	0	0	0	0	0	111.8	E1541 Q1542 V1543 K1548 I1549	E1541-A1545 WeakPolarHBondContact O-CB 3.43Å; E1541-A1545 PolarHBondContact O-N 2.94Å; Q1542-A1545 WeakPolarHBondContact O-CB 3.29Å; Q1542-A1545 PolarHBondContact O-N 2.99Å; V1543-A1545 VanDerWaalsContact C-N 3.34Å; V1543-A1545 PolarHBondContact O-N 3.22Å; A1545-K1548 PolarHBondContact O-N 3.19Å; A1545-I1549 WeakPolarHBondContact O-CD1 3.4Å; A1545-I1549 WeakPolarHBondContact O-CG1 3.29Å; A1545-I1549 PolarHBondContact O-N 3.04Å
1546	Q	91.9	Very high	89.5	Confident	32.6 Å²	32.6	47.5 Å²	47.5	15%	0.152	26%	0.256	C	S	.	.	H	α-helix	trans	-65.3	-39.5	173.2	-65.9	-58.7	-72.3	0	0	112.5	I1537 Q1542 V1543 I1544 K1548 I1549 M1550 V1603	I1537-Q1546 HydrophobicContact CG2-CG 3.81Å; Q1542-Q1546 WeakPolarHBondContact O-CG 3.38Å; Q1542-Q1546 PolarHBondContact O-N 3.14Å; V1543-Q1546 WeakPolarHBondContact O-CB 3.12Å; V1543-Q1546 PolarHBondContact O-N 3.09Å; V1543-Q1546 VanDerWaalsContact O-N 3.15Å; I1544-Q1546 VanDerWaalsContact C-N 3.32Å; I1544-Q1546 PolarHBondContact O-N 3.16Å; Q1546-K1548 VanDerWaalsContact C-N 3.32Å; Q1546-K1548 PolarHBondContact O-N 3.06Å; Q1546-I1549 PolarHBondContact O-N 3.05Å; Q1546-I1549 VanDerWaalsContact O-N 3.16Å; Q1546-M1550 HydrophobicContact CB-CE 4.33Å; Q1546-M1550 VanDerWaalsContact O-CG 3.31Å; Q1546-M1550 WeakPolarHBondContact O-CG 3.28Å; Q1546-M1550 PolarHBondContact O-N 2.89Å; Q1546-V1603 HydrophobicContact CB-CG2 4.28Å
1547	M	92.5	Very high	89.4	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-58.9	-44.5	175.8	-69	166.2	69.7	0	0	111.7	V1543 I1544 I1549 M1550 D1551 W1556 F1564 L1567 V1603 A1605 Y1640	V1543-M1547 HydrophobicContact CG1-SD 4.35Å; V1543-M1547 WeakPolarHBondContact O-CG 3.23Å; V1543-M1547 PolarHBondContact O-N 3.08Å; I1544-M1547 HydrophobicContact CG1-SD 4.4Å; I1544-M1547 WeakPolarHBondContact O-CB 3.35Å; I1544-M1547 PolarHBondContact O-N 3.12Å; M1547-I1549 VanDerWaalsContact C-N 3.29Å; M1547-I1549 PolarHBondContact O-N 2.99Å; M1547-M1550 PolarHBondContact O-N 3.07Å; M1547-M1550 VanDerWaalsContact O-N 3.16Å; M1547-D1551 WeakPolarHBondContact O-CB 3.16Å; M1547-D1551 PolarHBondContact O-N 2.87Å; M1547-W1556 HydrophobicContact CB-CH2 3.91Å; M1547-W1556 HydrophobicContact CB-CZ3 4.03Å; M1547-W1556 HydrophobicContact CE-CH2 3.93Å; M1547-W1556 HydrophobicContact CE-CZ3 4.38Å; M1547-W1556 HydrophobicContact CG-CH2 4.48Å; M1547-W1556 HydrophobicContact SD-CH2 4.26Å; M1547-F1564 HydrophobicContact CE-CE1 4.13Å; M1547-F1564 HydrophobicContact CE-CZ 4.09Å; M1547-L1567 HydrophobicContact SD-CD1 3.66Å; M1547-L1567 VanDerWaalsContact SD-CD1 3.55Å; M1547-V1603 HydrophobicContact CG-CB 4.03Å; M1547-V1603 HydrophobicContact CG-CG1 3.55Å; M1547-V1603 HydrophobicContact CG-CG2 4.09Å; M1547-V1603 HydrophobicContact SD-CG1 3.79Å; M1547-A1605 HydrophobicContact CE-CB 3.71Å; M1547-A1605 VanDerWaalsContact CE-CB 3.48Å; M1547-A1605 HydrophobicContact SD-CB 4.31Å; M1547-Y1640 HydrophobicContact CB-CD1 4.37Å; M1547-Y1640 HydrophobicContact CB-CE1 4.44Å; M1547-Y1640 HydrophobicContact CB-CG 4.44Å; M1547-Y1640 HydrophobicContact CE-CD2 3.88Å; M1547-Y1640 HydrophobicContact CE-CE1 4.28Å; M1547-Y1640 HydrophobicContact CE-CE2 3.44Å; M1547-Y1640 VanDerWaalsContact CE-CE2 3.47Å; M1547-Y1640 HydrophobicContact CE-CG 4.44Å; M1547-Y1640 HydrophobicContact CG-CD1 4.47Å; M1547-Y1640 HydrophobicContact CG-CD2 4.26Å; M1547-Y1640 HydrophobicContact CG-CG 4.23Å
1548	K	92.2	Very high	89.3	Confident	95.2 Å²	95.2	55.2 Å²	55.2	41%	0.414	30%	0.297	S	S	.	.	H	α-helix	trans	-62.8	-31.2	176.8	-70	176	178.2	-176.5	0	113.5	I1544 A1545 Q1546 D1551 S1552 W1556	I1544-K1548 HydrophobicContact CG2-CD 4.4Å; I1544-K1548 WeakPolarHBondContact O-CG 3.33Å; I1544-K1548 PolarHBondContact O-N 3.05Å; A1545-K1548 PolarHBondContact O-N 3.19Å; Q1546-K1548 VanDerWaalsContact C-N 3.32Å; Q1546-K1548 PolarHBondContact O-N 3.06Å; K1548-D1551 CarbonylContact O-C 3.49Å; K1548-S1552 WeakPolarHBondContact O-CA 3.16Å; K1548-S1552 PolarHBondContact O-N 2.98Å; K1548-W1556 HydrophobicContact CD-CD2 4.35Å; K1548-W1556 HydrophobicContact CD-CG 4.41Å; K1548-W1556 VanDerWaalsContact CE-CE2 3.42Å; K1548-W1556 VanDerWaalsContact CE-CG 3.4Å; K1548-W1556 HydrophobicContact CG-CD2 3.79Å; K1548-W1556 HydrophobicContact CG-CE3 3.86Å; K1548-W1556 HydrophobicContact CG-CG 4.23Å; K1548-W1556 HydrophobicContact CG-CH2 4.45Å; K1548-W1556 HydrophobicContact CG-CZ2 4.37Å; K1548-W1556 HydrophobicContact CG-CZ3 4.21Å
1549	I	92.1	Very high	89.5	Confident	113.6 Å²	113.6	54.5 Å²	54.5	58%	0.583	29%	0.292	S	S	*	.	H	α-helix	trans	-74.6	-41.2	176.5	-66.9	164.1	0	0	0	110.3	A1545 Q1546 M1547 D1551	A1545-I1549 WeakPolarHBondContact O-CD1 3.4Å; A1545-I1549 WeakPolarHBondContact O-CG1 3.29Å; A1545-I1549 PolarHBondContact O-N 3.04Å; Q1546-I1549 PolarHBondContact O-N 3.05Å; Q1546-I1549 VanDerWaalsContact O-N 3.16Å; M1547-I1549 VanDerWaalsContact C-N 3.29Å; M1547-I1549 PolarHBondContact O-N 2.99Å; I1549-D1551 VanDerWaalsContact C-N 3.32Å; I1549-D1551 PolarHBondContact O-N 3.05Å
1550	M	92.5	Very high	89.6	Confident	9.4 Å²	9.4	53.1 Å²	53.1	5%	0.046	29%	0.29	C	S	.	.	H	α-helix	trans	-71.6	-28.1	178.1	-67.4	168.5	178.6	0	0	113	Q1546 M1547 K1601 V1603 Y1640 D1642 G1696	Q1546-M1550 HydrophobicContact CB-CE 4.33Å; Q1546-M1550 VanDerWaalsContact O-CG 3.31Å; Q1546-M1550 WeakPolarHBondContact O-CG 3.28Å; Q1546-M1550 PolarHBondContact O-N 2.89Å; M1547-M1550 PolarHBondContact O-N 3.07Å; M1547-M1550 VanDerWaalsContact O-N 3.16Å; M1550-K1601 HydrophobicContact CE-CB 3.34Å; M1550-K1601 VanDerWaalsContact CE-CB 3.41Å; M1550-K1601 HydrophobicContact CE-CD 4.12Å; M1550-K1601 HydrophobicContact CE-CG 4.4Å; M1550-V1603 HydrophobicContact CE-CG2 4.24Å; M1550-V1603 HydrophobicContact SD-CG2 3.91Å; M1550-Y1640 VanDerWaalsContact SD-C 3.55Å; M1550-D1642 HydrophobicContact CE-CB 4.26Å; M1550-D1642 HydrophobicContact CG-CB 4.32Å; M1550-G1696 WeakPolarHBondContact O-CA 3.33Å; M1550-G1696 PolarHBondContact O-N 2.9Å
1551	D	91.8	Very high	89.4	Confident	10.2 Å²	10.2	57.8 Å²	57.8	6%	0.055	31%	0.311	C	S	.	.			trans	-128.7	71.4	-178.3	-179	24.7	0	0	0	109.7	M1547 K1548 I1549 D1553 S1554 Y1640 H1695 H1783	M1547-D1551 WeakPolarHBondContact O-CB 3.16Å; M1547-D1551 PolarHBondContact O-N 2.87Å; K1548-D1551 CarbonylContact O-C 3.49Å; I1549-D1551 VanDerWaalsContact C-N 3.32Å; I1549-D1551 PolarHBondContact O-N 3.05Å; D1551-D1553 VanDerWaalsContact C-N 3.29Å; D1551-S1554 VanDerWaalsContact CG-OG 3.29Å; D1551-S1554 WeakPolarHBondContact OD1-CB 3.25Å; D1551-S1554 PolarHBondContact OD1-N 2.9Å; D1551-S1554 PolarHBondContact OD1-OG 2.87Å; D1551-S1554 VanDerWaalsContact OD2-CB 3.27Å; D1551-S1554 WeakPolarHBondContact OD2-CB 3.27Å; D1551-S1554 PolarHBondContact OD2-OG 3.14Å; D1551-S1554 VanDerWaalsContact OD2-OG 3.1Å; D1551-Y1640 HydrophobicContact CB-CD1 3.8Å; D1551-Y1640 HydrophobicContact CB-CE1 3.96Å; D1551-Y1640 WeakPolarHBondContact OD2-CE1 3.43Å; D1551-H1695 HydrophobicContact CB-CB 4.15Å; D1551-H1783 IonicContact OD2-CD2 2.98Å; D1551-H1783 IonicContact OD2-CE1 3Å; D1551-H1783 IonicContact OD2-NE2 3.36Å; D1551-H1783 PolarHBondContact OD2-NE2 3.05Å; D1551-H1783 VanDerWaalsContact OD2-NE2 3.15Å
1552	S	89.7	Confident	89.2	Confident	85 Å²	85	58.8 Å²	58.8	59%	0.594	32%	0.316	S	S	*	.			trans	-77.3	-20.9	-179.5	56.7	0	0	0	0	113.5	K1548	K1548-S1552 WeakPolarHBondContact O-CA 3.16Å; K1548-S1552 PolarHBondContact O-N 2.98Å
1553	D	87.4	Confident	89.1	Confident	78.6 Å²	78.6	58.6 Å²	58.6	42%	0.42	32%	0.317	S	S	.	.	S	Bend	trans	-83.7	-18.1	-174.1	-61.7	-31.1	0	0	0	113.1	D1551 N1735 N1781	D1551-D1553 VanDerWaalsContact C-N 3.29Å; D1553-N1735 WeakPolarHBondContact OD2-CB 3.27Å; D1553-N1735 PolarHBondContact OD2-ND2 3.09Å; D1553-N1781 WeakPolarHBondContact CB-ND2 3.39Å; D1553-N1781 WeakPolarHBondContact O-CB 3Å; D1553-N1781 PolarHBondContact O-ND2 3.47Å
1554	S	90.4	Very high	89	Confident	11.4 Å²	11.4	59.4 Å²	59.4	8%	0.08	32%	0.32	C	S	.	.	S	Bend	trans	-88.1	137.8	-178.5	-22.2	0	0	0	0	112	D1551 W1556 N1781	D1551-S1554 VanDerWaalsContact CG-OG 3.29Å; D1551-S1554 WeakPolarHBondContact OD1-CB 3.25Å; D1551-S1554 PolarHBondContact OD1-N 2.9Å; D1551-S1554 PolarHBondContact OD1-OG 2.87Å; D1551-S1554 VanDerWaalsContact OD2-CB 3.27Å; D1551-S1554 WeakPolarHBondContact OD2-CB 3.27Å; D1551-S1554 PolarHBondContact OD2-OG 3.14Å; D1551-S1554 VanDerWaalsContact OD2-OG 3.1Å; S1554-W1556 VanDerWaalsContact C-N 3.35Å; S1554-W1556 PolarHBondContact O-N 2.88Å; S1554-N1781 VanDerWaalsContact CB-O 3.24Å; S1554-N1781 WeakPolarHBondContact CB-O 3.21Å; S1554-N1781 PolarHBondContact OG-O 3.31Å; S1554-N1781 VanDerWaalsContact OG-O 3.06Å
1555	P	88.6	Confident	88.6	Confident	56.6 Å²	56.6	61.2 Å²	61.2	37%	0.368	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-69.1	110.9	175.4	26.9	-32.8	0	0	0	110.7	P1557 D1782	P1555-P1557 WeakPolarHBondContact O-CD 3.42Å; P1555-D1782 HydrophobicContact CG-CB 3.64Å
1556	W	86	Confident	88.4	Confident	45.8 Å²	45.8	61.1 Å²	61.1	17%	0.173	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-75.8	119.4	-176.3	-167	-94	0	0	0	112.5	I1544 M1547 K1548 S1554 N1558 L1559 F1564 Y1640 H1784	I1544-W1556 HydrophobicContact CG2-CH2 4.04Å; I1544-W1556 HydrophobicContact CG2-CZ2 3.58Å; I1544-W1556 VanDerWaalsContact CG2-CZ2 3.45Å; M1547-W1556 HydrophobicContact CB-CH2 3.91Å; M1547-W1556 HydrophobicContact CB-CZ3 4.03Å; M1547-W1556 HydrophobicContact CE-CH2 3.93Å; M1547-W1556 HydrophobicContact CE-CZ3 4.38Å; M1547-W1556 HydrophobicContact CG-CH2 4.48Å; M1547-W1556 HydrophobicContact SD-CH2 4.26Å; K1548-W1556 HydrophobicContact CD-CD2 4.35Å; K1548-W1556 HydrophobicContact CD-CG 4.41Å; K1548-W1556 VanDerWaalsContact CE-CE2 3.42Å; K1548-W1556 VanDerWaalsContact CE-CG 3.4Å; K1548-W1556 HydrophobicContact CG-CD2 3.79Å; K1548-W1556 HydrophobicContact CG-CE3 3.86Å; K1548-W1556 HydrophobicContact CG-CG 4.23Å; K1548-W1556 HydrophobicContact CG-CH2 4.45Å; K1548-W1556 HydrophobicContact CG-CZ2 4.37Å; K1548-W1556 HydrophobicContact CG-CZ3 4.21Å; S1554-W1556 VanDerWaalsContact C-N 3.35Å; S1554-W1556 PolarHBondContact O-N 2.88Å; W1556-N1558 VanDerWaalsContact CD1-N 3.29Å; W1556-N1558 PolarHBondContact O-N 3Å; W1556-N1558 VanDerWaalsContact O-N 3.1Å; W1556-L1559 HydrophobicContact CH2-CB 4.37Å; W1556-L1559 HydrophobicContact CH2-CD1 4.45Å; W1556-L1559 HydrophobicContact CZ2-CB 3.91Å; W1556-L1559 HydrophobicContact CZ2-CD1 4.47Å; W1556-L1559 HydrophobicContact CZ2-CG 4.45Å; W1556-L1559 PolarHBondContact NE1-O 2.84Å; W1556-F1564 HydrophobicContact CH2-CZ 4.25Å; W1556-Y1640 HydrophobicContact CZ3-CE1 4.23Å; W1556-H1784 AromaticContact CE3-NE2 3.73Å; W1556-H1784 AromaticContact CZ3-CE1 3.7Å; W1556-H1784 AromaticContact CZ3-NE2 3.64Å
1557	P	81.3	Confident	88.4	Confident	58.2 Å²	58.2	60.8 Å²	60.8	38%	0.378	33%	0.328	S	S	.	.			trans	-80.9	73.6	178.4	18.6	-9.2	0	0	0	112.1	P1555 L1559 H1784	P1555-P1557 WeakPolarHBondContact O-CD 3.42Å; P1557-L1559 VanDerWaalsContact C-N 3.32Å; P1557-L1559 HydrophobicContact CB-CD2 4.24Å; P1557-L1559 HydrophobicContact CB-CG 4.19Å; P1557-L1559 HydrophobicContact CG-CD1 3.98Å; P1557-L1559 HydrophobicContact CG-CD2 4.24Å; P1557-L1559 HydrophobicContact CG-CG 3.9Å; P1557-L1559 PolarHBondContact O-N 3.04Å; P1557-H1784 HydrophobicContact CG-CB 3.61Å
1558	N	84.4	Confident	88.4	Confident	147.8 Å²	147.8	64.3 Å²	64.3	79%	0.79	34%	0.341	S	S	*	.			trans	13.4	46.7	-179	-65.5	-29.5	0	0	0	114.2	W1556	W1556-N1558 VanDerWaalsContact CD1-N 3.29Å; W1556-N1558 PolarHBondContact O-N 3Å; W1556-N1558 VanDerWaalsContact O-N 3.1Å
1559	L	87.1	Confident	88.4	Confident	24 Å²	24	59.9 Å²	59.9	13%	0.126	32%	0.322	C	S	.	.			trans	-72.5	144.7	178	-58.4	173.6	0	0	0	111.6	W1556 P1557 D1563 F1564 H1784	W1556-L1559 HydrophobicContact CH2-CB 4.37Å; W1556-L1559 HydrophobicContact CH2-CD1 4.45Å; W1556-L1559 HydrophobicContact CZ2-CB 3.91Å; W1556-L1559 HydrophobicContact CZ2-CD1 4.47Å; W1556-L1559 HydrophobicContact CZ2-CG 4.45Å; W1556-L1559 PolarHBondContact NE1-O 2.84Å; P1557-L1559 VanDerWaalsContact C-N 3.32Å; P1557-L1559 HydrophobicContact CB-CD2 4.24Å; P1557-L1559 HydrophobicContact CB-CG 4.19Å; P1557-L1559 HydrophobicContact CG-CD1 3.98Å; P1557-L1559 HydrophobicContact CG-CD2 4.24Å; P1557-L1559 HydrophobicContact CG-CG 3.9Å; P1557-L1559 PolarHBondContact O-N 3.04Å; L1559-D1563 WeakPolarHBondContact CA-OD2 3.44Å; L1559-D1563 HydrophobicContact CB-CB 4.4Å; L1559-D1563 HydrophobicContact CD2-CB 4.15Å; L1559-F1564 HydrophobicContact CB-CE2 4.1Å; L1559-F1564 HydrophobicContact CB-CZ 4.34Å; L1559-F1564 HydrophobicContact CD1-CE2 4.48Å; L1559-F1564 HydrophobicContact CD1-CZ 3.94Å; L1559-H1784 WeakPolarHBondContact CD1-ND1 3.37Å
1560	T	88.9	Confident	88.5	Confident	70 Å²	70	55.6 Å²	55.6	43%	0.429	30%	0.298	S	S	.	.			trans	-114	173.2	178.1	66.1	0	0	0	0	111	I1544 Q1562 D1563 F1564	I1544-T1560 VanDerWaalsContact CD1-C 3.5Å; T1560-Q1562 PolarHBondContact O-N 2.99Å; T1560-Q1562 PolarHBondContact OG1-N 3.3Å; T1560-D1563 PolarHBondContact N-OD2 3.05Å; T1560-D1563 WeakPolarHBondContact O-CB 3.35Å; T1560-D1563 PolarHBondContact O-N 2.95Å; T1560-D1563 VanDerWaalsContact O-N 3.12Å; T1560-D1563 PolarHBondContact OG1-OD2 3.1Å; T1560-F1564 VanDerWaalsContact O-CD2 3.27Å; T1560-F1564 WeakPolarHBondContact O-CD2 3.33Å; T1560-F1564 WeakPolarHBondContact O-CE2 3.36Å
1561	E	83.8	Confident	88.6	Confident	104.2 Å²	104.2	56.4 Å²	56.4	49%	0.487	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-57.7	-34	177.5	178.6	172.4	-176.5	0	0	112.7	G1540 D1563 F1564 L1567	G1540-E1561 VanDerWaalsContact CA-CD 3.48Å; G1540-E1561 WeakPolarHBondContact CA-OE2 3.32Å; G1540-E1561 PolarHBondContact N-OE2 3.38Å; G1540-E1561 VanDerWaalsContact N-OE2 3.15Å; E1561-D1563 PolarHBondContact O-N 3.08Å; E1561-F1564 PolarHBondContact O-N 3.19Å; E1561-F1564 VanDerWaalsContact O-N 3.17Å; E1561-L1567 HydrophobicContact CB-CD2 4.39Å; E1561-L1567 HydrophobicContact CG-CD2 4.25Å
1562	Q	85.5	Confident	88.7	Confident	170.4 Å²	170.4	56.8 Å²	56.8	80%	0.796	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-68	-20	-178	-61.1	-177.6	12	0	0	113	T1560 F1564 M1608	T1560-Q1562 PolarHBondContact O-N 2.99Å; T1560-Q1562 PolarHBondContact OG1-N 3.3Å; Q1562-F1564 PolarHBondContact O-N 2.9Å; Q1562-M1608 VanDerWaalsContact O-SD 3.34Å
1563	D	87.9	Confident	88.9	Confident	60.4 Å²	60.4	53.2 Å²	53.2	32%	0.323	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-78.3	0.2	177.9	-60.3	-58.1	0	0	0	112.9	L1559 T1560 E1561 Q1607 M1608	L1559-D1563 WeakPolarHBondContact CA-OD2 3.44Å; L1559-D1563 HydrophobicContact CB-CB 4.4Å; L1559-D1563 HydrophobicContact CD2-CB 4.15Å; T1560-D1563 PolarHBondContact N-OD2 3.05Å; T1560-D1563 WeakPolarHBondContact O-CB 3.35Å; T1560-D1563 PolarHBondContact O-N 2.95Å; T1560-D1563 VanDerWaalsContact O-N 3.12Å; T1560-D1563 PolarHBondContact OG1-OD2 3.1Å; E1561-D1563 PolarHBondContact O-N 3.08Å; D1563-Q1607 CarbonylContact O-C 3.51Å; D1563-Q1607 WeakPolarHBondContact O-CA 3.18Å; D1563-Q1607 WeakPolarHBondContact O-CG 3.38Å; D1563-M1608 WeakPolarHBondContact O-CB 3.3Å; D1563-M1608 PolarHBondContact O-N 3.12Å
1564	F	89.2	Confident	89.4	Confident	19.4 Å²	19.4	50.7 Å²	50.7	9%	0.085	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	128.9	-179	-63.4	-86.2	0	0	0	112.2	I1544 M1547 W1556 L1559 T1560 E1561 Q1562 L1567 A1605 E1606 Q1607	I1544-F1564 HydrophobicContact CD1-CD2 4.49Å; I1544-F1564 HydrophobicContact CD1-CE2 4.17Å; I1544-F1564 HydrophobicContact CG1-CE2 4.33Å; M1547-F1564 HydrophobicContact CE-CE1 4.13Å; M1547-F1564 HydrophobicContact CE-CZ 4.09Å; W1556-F1564 HydrophobicContact CH2-CZ 4.25Å; L1559-F1564 HydrophobicContact CB-CE2 4.1Å; L1559-F1564 HydrophobicContact CB-CZ 4.34Å; L1559-F1564 HydrophobicContact CD1-CE2 4.48Å; L1559-F1564 HydrophobicContact CD1-CZ 3.94Å; T1560-F1564 VanDerWaalsContact O-CD2 3.27Å; T1560-F1564 WeakPolarHBondContact O-CD2 3.33Å; T1560-F1564 WeakPolarHBondContact O-CE2 3.36Å; E1561-F1564 PolarHBondContact O-N 3.19Å; E1561-F1564 VanDerWaalsContact O-N 3.17Å; Q1562-F1564 PolarHBondContact O-N 2.9Å; F1564-L1567 HydrophobicContact CB-CB 3.91Å; F1564-L1567 HydrophobicContact CB-CD2 4.48Å; F1564-L1567 HydrophobicContact CD1-CD1 4.48Å; F1564-L1567 HydrophobicContact CD2-CD1 4.39Å; F1564-L1567 HydrophobicContact CD2-CD2 4.17Å; F1564-L1567 HydrophobicContact CG-CB 4.43Å; F1564-L1567 HydrophobicContact CG-CD1 4.32Å; F1564-L1567 HydrophobicContact CG-CD2 4.43Å; F1564-A1605 HydrophobicContact CD1-CB 3.89Å; F1564-A1605 HydrophobicContact CE1-CB 3.9Å; F1564-E1606 CarbonylContact C-O 3.56Å; F1564-E1606 WeakPolarHBondContact CA-O 3.5Å; F1564-Q1607 HydrophobicContact CD1-CB 4.2Å; F1564-Q1607 HydrophobicContact CD1-CG 4.44Å; F1564-Q1607 HydrophobicContact CE1-CB 4.19Å; F1564-Q1607 HydrophobicContact CE1-CG 4.25Å
1565	S	85.8	Confident	89.7	Confident	47 Å²	47	53 Å²	53	33%	0.329	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	-28.2	172.9	65.5	0	0	0	0	112.8	E1606	S1565-E1606 PolarHBondContact N-O 3.01Å; S1565-E1606 WeakPolarHBondContact OG-CB 3.37Å; S1565-E1606 VanDerWaalsContact OG-CG 3.31Å; S1565-E1606 WeakPolarHBondContact OG-CG 3.26Å; S1565-E1606 PolarHBondContact OG-O 3.05Å; S1565-E1606 PolarHBondContact OG-OE2 2.92Å
1566	T	87.6	Confident	90.1	Very high	42.8 Å²	42.8	50.4 Å²	50.4	26%	0.263	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	124.9	170.8	-61.2	0	0	0	0	107.3	A1605 E1606	T1566-A1605 CarbonylContact O-C 3.54Å; T1566-A1605 VanDerWaalsContact O-CA 3.27Å; T1566-A1605 WeakPolarHBondContact O-CA 3.41Å; T1566-E1606 PolarHBondContact N-O 3.19Å; T1566-E1606 PolarHBondContact O-N 2.99Å; T1566-E1606 PolarHBondContact OG1-OE2 3.01Å
1567	L	91.9	Very high	90.7	Very high	27.4 Å²	27.4	53.1 Å²	53.1	14%	0.143	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	121.1	174.9	-174.8	65.1	0	0	0	109.2	V1543 I1544 M1547 E1561 F1564 V1603 I1604 A1605	V1543-L1567 HydrophobicContact CB-CD1 4.48Å; V1543-L1567 HydrophobicContact CB-CD2 4.46Å; V1543-L1567 HydrophobicContact CB-CG 4.33Å; V1543-L1567 HydrophobicContact CG1-CD1 3.63Å; V1543-L1567 HydrophobicContact CG1-CD2 4.43Å; V1543-L1567 HydrophobicContact CG1-CG 3.84Å; I1544-L1567 HydrophobicContact CD1-CD2 4.33Å; I1544-L1567 HydrophobicContact CG1-CD2 4.16Å; M1547-L1567 HydrophobicContact SD-CD1 3.66Å; M1547-L1567 VanDerWaalsContact SD-CD1 3.55Å; E1561-L1567 HydrophobicContact CB-CD2 4.39Å; E1561-L1567 HydrophobicContact CG-CD2 4.25Å; F1564-L1567 HydrophobicContact CB-CB 3.91Å; F1564-L1567 HydrophobicContact CB-CD2 4.48Å; F1564-L1567 HydrophobicContact CD1-CD1 4.48Å; F1564-L1567 HydrophobicContact CD2-CD1 4.39Å; F1564-L1567 HydrophobicContact CD2-CD2 4.17Å; F1564-L1567 HydrophobicContact CG-CB 4.43Å; F1564-L1567 HydrophobicContact CG-CD1 4.32Å; F1564-L1567 HydrophobicContact CG-CD2 4.43Å; L1567-V1603 HydrophobicContact CD1-CG1 4.38Å; L1567-I1604 WeakPolarHBondContact CA-O 3.38Å; L1567-A1605 HydrophobicContact CD1-CB 4Å
1568	W	91.5	Very high	91.4	Very high	72.6 Å²	72.6	54.7 Å²	54.7	28%	0.275	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.6	150.8	170.9	56	-88.2	0	0	0	111.7	R1570 V1603 I1604	W1568-R1570 HydrophobicContact CE3-CB 4.3Å; W1568-R1570 HydrophobicContact CE3-CG 3.55Å; W1568-R1570 HydrophobicContact CH2-CG 4.48Å; W1568-R1570 HydrophobicContact CZ3-CB 3.94Å; W1568-R1570 HydrophobicContact CZ3-CG 3.43Å; W1568-R1570 VanDerWaalsContact CZ3-CG 3.44Å; W1568-V1603 WeakPolarHBondContact O-CA 3.42Å; W1568-I1604 HydrophobicContact CD2-CB 4.34Å; W1568-I1604 HydrophobicContact CH2-CB 4.45Å; W1568-I1604 HydrophobicContact CH2-CD1 3.62Å; W1568-I1604 HydrophobicContact CH2-CG1 3.9Å; W1568-I1604 HydrophobicContact CZ2-CB 4.03Å; W1568-I1604 HydrophobicContact CZ2-CD1 3.51Å; W1568-I1604 VanDerWaalsContact CZ2-CD1 3.46Å; W1568-I1604 HydrophobicContact CZ2-CG1 3.98Å; W1568-I1604 HydrophobicContact CZ3-CD1 4.4Å; W1568-I1604 HydrophobicContact CZ3-CG1 4.3Å; W1568-I1604 PolarHBondContact N-O 3.09Å; W1568-I1604 VanDerWaalsContact N-O 3.16Å; W1568-I1604 PolarHBondContact O-N 3.16Å
1569	C	93.4	Very high	92	Very high	3.4 Å²	3.4	50 Å²	50	2%	0.023	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	145.7	172.7	-173.1	0	0	0	0	110.6	I1537 V1543 L1602 V1603	I1537-C1569 HydrophobicContact CB-CB 3.93Å; I1537-C1569 HydrophobicContact CD1-CB 4.09Å; I1537-C1569 VanDerWaalsContact CD1-SG 3.58Å; I1537-C1569 HydrophobicContact CG1-CB 4.42Å; V1543-C1569 HydrophobicContact CB-CB 4.48Å; V1543-C1569 HydrophobicContact CG1-CB 4.07Å; V1543-C1569 HydrophobicContact CG2-CB 3.86Å; C1569-L1602 CarbonylContact C-O 3.55Å; C1569-L1602 WeakPolarHBondContact CA-O 3.42Å; C1569-V1603 HydrophobicContact CB-CG2 3.88Å
1570	R	93.6	Very high	92.5	Very high	22 Å²	22	52.2 Å²	52.2	8%	0.083	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	148.5	170.1	-66.8	-65.8	174.9	177.1	3.6	110.8	K1424 Q1425 A1531 L1532 A1533 W1568 I1572 L1602	K1424-R1570 VanDerWaalsContact CB-NH2 3.32Å; K1424-R1570 VanDerWaalsContact CD-NH2 3.31Å; K1424-R1570 PolarHBondContact O-NH2 2.96Å; Q1425-R1570 PolarHBondContact O-NH1 2.83Å; Q1425-R1570 PolarHBondContact O-NH2 2.88Å; A1531-R1570 HydrophobicContact CB-CB 4.26Å; A1531-R1570 HydrophobicContact CB-CG 4.29Å; A1531-R1570 PolarHBondContact O-NH1 3.27Å; A1531-R1570 VanDerWaalsContact O-NH1 3.12Å; L1532-R1570 VanDerWaalsContact C-CD 3.44Å; L1532-R1570 WeakPolarHBondContact O-CA 3.23Å; L1532-R1570 WeakPolarHBondContact O-CD 3.37Å; A1533-R1570 VanDerWaalsContact N-NH1 3.19Å; W1568-R1570 HydrophobicContact CE3-CB 4.3Å; W1568-R1570 HydrophobicContact CE3-CG 3.55Å; W1568-R1570 HydrophobicContact CH2-CG 4.48Å; W1568-R1570 HydrophobicContact CZ3-CB 3.94Å; W1568-R1570 HydrophobicContact CZ3-CG 3.43Å; W1568-R1570 VanDerWaalsContact CZ3-CG 3.44Å; R1570-I1572 HydrophobicContact CB-CG2 4.21Å; R1570-L1602 PolarHBondContact N-O 2.94Å; R1570-L1602 PolarHBondContact O-N 3.19Å
1571	I	94	Very high	92.8	Very high	27.2 Å²	27.2	50.4 Å²	50.4	14%	0.139	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	123	163.3	-64.7	161.8	0	0	0	106.9	L1315 A1531 L1532 D1534 I1537 G1600 K1601	L1315-I1571 HydrophobicContact CD1-CD1 3.5Å; L1315-I1571 VanDerWaalsContact CD1-CD1 3.43Å; A1531-I1571 WeakPolarHBondContact CA-O 3.43Å; L1532-I1571 HydrophobicContact CB-CB 4.47Å; L1532-I1571 PolarHBondContact N-O 2.92Å; L1532-I1571 PolarHBondContact O-N 3.19Å; L1532-I1571 VanDerWaalsContact O-N 3.1Å; D1534-I1571 HydrophobicContact CB-CD1 4.29Å; I1537-I1571 HydrophobicContact CD1-CD1 4.39Å; I1537-I1571 HydrophobicContact CD1-CG1 4.05Å; I1571-G1600 CarbonylContact C-O 3.51Å; I1571-G1600 WeakPolarHBondContact CA-O 3.31Å; I1571-K1601 HydrophobicContact CG1-CG 4.16Å
1572	I	93.8	Very high	93.4	Very high	19 Å²	19	46.5 Å²	46.5	10%	0.097	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	142.5	-176.9	50	172.9	0	0	0	110.7	K1530 A1531 R1570 L1598 W1599 G1600 L1602 L1643	K1530-I1572 CarbonylContact O-C 3.52Å; K1530-I1572 VanDerWaalsContact O-CA 3.27Å; K1530-I1572 WeakPolarHBondContact O-CA 3.27Å; A1531-I1572 HydrophobicContact CB-CG2 4.26Å; R1570-I1572 HydrophobicContact CB-CG2 4.21Å; I1572-L1598 HydrophobicContact CD1-CD2 4.24Å; I1572-L1598 HydrophobicContact CG2-CD2 4.38Å; I1572-W1599 VanDerWaalsContact O-CA 3.26Å; I1572-W1599 WeakPolarHBondContact O-CA 3.14Å; I1572-G1600 PolarHBondContact N-O 3.11Å; I1572-G1600 PolarHBondContact O-N 3.26Å; I1572-L1602 HydrophobicContact CD1-CB 3.99Å; I1572-L1602 HydrophobicContact CD1-CD2 4.08Å; I1572-L1602 HydrophobicContact CD1-CG 4.37Å; I1572-L1602 HydrophobicContact CG1-CB 4.21Å; I1572-L1602 HydrophobicContact CG2-CB 4.21Å; I1572-L1602 HydrophobicContact CG2-CD2 4.38Å; I1572-L1643 HydrophobicContact CB-CD2 4.24Å; I1572-L1643 HydrophobicContact CD1-CD1 4.34Å; I1572-L1643 HydrophobicContact CD1-CD2 3.75Å; I1572-L1643 HydrophobicContact CG1-CD2 3.86Å
1573	T	95.6	Very high	93.8	Very high	9 Å²	9	38.6 Å²	38.6	6%	0.055	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	138.1	154.6	45.1	0	0	0	0	109.2	H1310 I1529 K1530 F1597 L1598 W1599	H1310-T1573 VanDerWaalsContact CE1-CG2 3.4Å; H1310-T1573 WeakPolarHBondContact CE1-CG2 3.38Å; H1310-T1573 PolarHBondContact CE1-OG1 3.45Å; H1310-T1573 WeakPolarHBondContact NE2-CG2 3.39Å; H1310-T1573 PolarHBondContact NE2-OG1 3.13Å; H1310-T1573 VanDerWaalsContact NE2-OG1 3.12Å; I1529-T1573 CarbonylContact C-O 3.49Å; I1529-T1573 VanDerWaalsContact CA-O 3.3Å; I1529-T1573 WeakPolarHBondContact CA-O 3.31Å; K1530-T1573 WeakPolarHBondContact CB-OG1 3.33Å; K1530-T1573 WeakPolarHBondContact CD-OG1 3.37Å; K1530-T1573 WeakPolarHBondContact CG-OG1 3.34Å; K1530-T1573 PolarHBondContact N-O 3.02Å; K1530-T1573 PolarHBondContact O-N 3.18Å; T1573-F1597 HydrophobicContact CG2-CE2 4.05Å; T1573-F1597 VanDerWaalsContact CG2-CE2 3.48Å; T1573-F1597 HydrophobicContact CG2-CZ 4.09Å; T1573-L1598 CarbonylContact C-O 3.48Å; T1573-L1598 VanDerWaalsContact CA-O 3.26Å; T1573-L1598 WeakPolarHBondContact CA-O 3.25Å; T1573-W1599 HydrophobicContact CG2-CB 3.76Å
1574	M	96.2	Very high	93.9	Very high	25.2 Å²	25.2	38.3 Å²	38.3	12%	0.124	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	127.4	175.3	-177.7	179	78.7	0	0	109.1	M1524 L1527 K1528 I1529 V1576 L1596 F1597 L1598	M1524-M1574 HydrophobicContact CE-CE 4.44Å; L1527-M1574 HydrophobicContact CD1-CG 3.87Å; L1527-M1574 HydrophobicContact CD1-SD 4.12Å; K1528-M1574 CarbonylContact O-C 3.52Å; K1528-M1574 VanDerWaalsContact O-CA 3.27Å; K1528-M1574 WeakPolarHBondContact O-CA 3.35Å; I1529-M1574 HydrophobicContact CG1-CB 4.38Å; I1529-M1574 HydrophobicContact CG1-CG 3.96Å; I1529-M1574 HydrophobicContact CG1-SD 4.42Å; M1574-V1576 HydrophobicContact CE-CG2 4.26Å; M1574-V1576 HydrophobicContact CG-CG2 4.07Å; M1574-V1576 HydrophobicContact SD-CG2 4.4Å; M1574-L1596 HydrophobicContact CE-CD2 3.64Å; M1574-L1596 HydrophobicContact CE-CG 4.46Å; M1574-F1597 CarbonylContact O-C 3.54Å; M1574-F1597 WeakPolarHBondContact O-CA 3.32Å; M1574-L1598 HydrophobicContact CB-CB 4.28Å; M1574-L1598 HydrophobicContact CB-CD2 4.34Å; M1574-L1598 HydrophobicContact CE-CB 4.21Å; M1574-L1598 HydrophobicContact CE-CD1 4.29Å; M1574-L1598 HydrophobicContact CE-CD2 3.93Å; M1574-L1598 PolarHBondContact N-O 3.25Å; M1574-L1598 PolarHBondContact O-N 3.1Å
1575	N	97.3	Very high	93.8	Very high	61 Å²	61	41.8 Å²	41.8	33%	0.326	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	131.9	175.2	-161.8	-39.8	0	0	0	108.5	L1527 K1528 L1596 F1597	L1527-N1575 CarbonylContact C-O 3.53Å; L1527-N1575 WeakPolarHBondContact CA-O 3.45Å; K1528-N1575 HydrophobicContact CB-CB 4.38Å; K1528-N1575 PolarHBondContact N-O 3.13Å; K1528-N1575 PolarHBondContact NZ-OD1 2.85Å; K1528-N1575 PolarHBondContact O-N 3.18Å; N1575-L1596 CarbonylContact C-O 3.53Å; N1575-L1596 VanDerWaalsContact CA-O 3.31Å; N1575-L1596 WeakPolarHBondContact CA-O 3.41Å; N1575-L1596 PolarHBondContact ND2-O 2.92Å; N1575-F1597 HydrophobicContact CB-CD2 4.26Å; N1575-F1597 WeakPolarHBondContact OD1-CD2 3.42Å; N1575-F1597 WeakPolarHBondContact OD1-CE2 3.3Å
1576	V	97.2	Very high	94.1	Very high	1.4 Å²	1.4	40.2 Å²	40.2	1%	0.008	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	125.6	179.5	-172.6	0	0	0	0	109	M1524 D1525 L1527 M1574 R1578 W1579 D1595 L1596	M1524-V1576 HydrophobicContact CB-CG1 4.06Å; M1524-V1576 HydrophobicContact CE-CG2 4.4Å; M1524-V1576 HydrophobicContact CG-CG1 4.17Å; M1524-V1576 HydrophobicContact SD-CG2 4.47Å; D1525-V1576 WeakPolarHBondContact O-CG1 3.28Å; L1527-V1576 HydrophobicContact CB-CG2 4.45Å; L1527-V1576 HydrophobicContact CD1-CG2 3.5Å; L1527-V1576 VanDerWaalsContact CD1-CG2 3.48Å; M1574-V1576 HydrophobicContact CE-CG2 4.26Å; M1574-V1576 HydrophobicContact CG-CG2 4.07Å; M1574-V1576 HydrophobicContact SD-CG2 4.4Å; V1576-R1578 VanDerWaalsContact CG1-O 3.32Å; V1576-R1578 WeakPolarHBondContact CG1-O 3.42Å; V1576-W1579 HydrophobicContact CG1-CB 4.16Å; V1576-D1595 CarbonylContact O-C 3.53Å; V1576-L1596 HydrophobicContact CB-CB 4.35Å; V1576-L1596 HydrophobicContact CB-CD2 4.15Å; V1576-L1596 HydrophobicContact CG2-CD2 4.22Å; V1576-L1596 PolarHBondContact N-O 3.07Å; V1576-L1596 PolarHBondContact O-N 3.22Å
1577	E	98.1	Very high	94.3	Very high	102.2 Å²	102.2	41 Å²	41	48%	0.478	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	-42	179.4	-178.1	179.2	154.4	0	0	111.2	D1525 N1526 T1594 D1595	D1525-E1577 PolarHBondContact O-N 3.15Å; D1525-E1577 VanDerWaalsContact O-N 3.11Å; N1526-E1577 HydrophobicContact CB-CB 3.9Å; N1526-E1577 VanDerWaalsContact CB-OE2 3.23Å; N1526-E1577 WeakPolarHBondContact CB-OE2 3.44Å; N1526-E1577 PolarHBondContact ND2-OE2 3.22Å; N1526-E1577 VanDerWaalsContact ND2-OE2 3.16Å; E1577-T1594 CarbonylContact O-C 3.53Å; E1577-T1594 WeakPolarHBondContact O-CA 3.43Å; E1577-D1595 PolarHBondContact O-N 2.93Å
1578	R	97.7	Very high	94.3	Very high	92.4 Å²	92.4	42.5 Å²	42.5	35%	0.349	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	132.9	174.9	-169.3	176.8	-173.1	173.9	6.2	111.7	M1524 D1525 V1576 N1592 I1593 T1594	M1524-R1578 CarbonylContact C-O 3.49Å; M1524-R1578 VanDerWaalsContact CA-O 3.32Å; M1524-R1578 WeakPolarHBondContact CA-O 3.3Å; D1525-R1578 HydrophobicContact CB-CB 4.21Å; D1525-R1578 PolarHBondContact N-O 2.89Å; V1576-R1578 VanDerWaalsContact CG1-O 3.32Å; V1576-R1578 WeakPolarHBondContact CG1-O 3.42Å; R1578-N1592 VanDerWaalsContact CZ-OD1 3.3Å; R1578-N1592 PolarHBondContact NE-OD1 2.92Å; R1578-N1592 PolarHBondContact NH2-OD1 3.25Å; R1578-I1593 CarbonylContact C-O 3.57Å; R1578-I1593 WeakPolarHBondContact CA-O 3.32Å; R1578-T1594 HydrophobicContact CG-CG2 4.45Å
1579	W	97	Very high	94.4	Very high	49.6 Å²	49.6	39.6 Å²	39.6	19%	0.188	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	120.3	172.9	178.6	17.3	0	0	0	109.9	F1522 T1523 M1524 V1576 L1591 N1592 I1593 L1596	F1522-W1579 AromaticContact CD2-NE1 3.78Å; F1522-W1579 AromaticContact CE1-NE1 3.97Å; F1522-W1579 AromaticContact CE2-CE2 3.78Å; F1522-W1579 AromaticContact CE2-CZ2 3.93Å; F1522-W1579 HydrophobicContact CE2-CZ2 3.93Å; F1522-W1579 AromaticContact CE2-NE1 3.11Å; F1522-W1579 AromaticContact CZ-CD1 3.81Å; F1522-W1579 AromaticContact CZ-CE2 3.93Å; F1522-W1579 HydrophobicContact CZ-CZ2 4.37Å; F1522-W1579 AromaticContact CZ-NE1 3.41Å; T1523-W1579 CarbonylContact O-C 3.53Å; T1523-W1579 WeakPolarHBondContact O-CA 3.43Å; M1524-W1579 HydrophobicContact CE-CB 4.36Å; M1524-W1579 HydrophobicContact CE-CD2 3.47Å; M1524-W1579 VanDerWaalsContact CE-CD2 3.46Å; M1524-W1579 VanDerWaalsContact CE-CE2 3.45Å; M1524-W1579 HydrophobicContact CE-CE3 3.87Å; M1524-W1579 HydrophobicContact CE-CG 3.78Å; M1524-W1579 HydrophobicContact CE-CH2 4.17Å; M1524-W1579 HydrophobicContact CE-CZ2 3.92Å; M1524-W1579 HydrophobicContact CE-CZ3 4.16Å; M1524-W1579 HydrophobicContact CG-CB 4.19Å; M1524-W1579 VanDerWaalsContact CG-CD1 3.47Å; M1524-W1579 HydrophobicContact CG-CD2 4.48Å; M1524-W1579 HydrophobicContact CG-CG 3.92Å; V1576-W1579 HydrophobicContact CG1-CB 4.16Å; W1579-L1591 HydrophobicContact CD2-CD2 3.92Å; W1579-L1591 HydrophobicContact CE3-CD2 4.04Å; W1579-L1591 HydrophobicContact CH2-CD2 4.1Å; W1579-L1591 HydrophobicContact CZ2-CD2 3.98Å; W1579-L1591 HydrophobicContact CZ3-CD2 4.09Å; W1579-N1592 CarbonylContact O-C 3.53Å; W1579-N1592 WeakPolarHBondContact O-CA 3.4Å; W1579-I1593 HydrophobicContact CB-CB 4.26Å; W1579-I1593 HydrophobicContact CD2-CD1 4.38Å; W1579-I1593 HydrophobicContact CE3-CD1 3.74Å; W1579-I1593 VanDerWaalsContact CE3-CD1 3.43Å; W1579-I1593 HydrophobicContact CZ3-CD1 4.15Å; W1579-I1593 PolarHBondContact N-O 3.27Å; W1579-I1593 PolarHBondContact O-N 3.14Å; W1579-L1596 HydrophobicContact CE3-CD2 3.97Å; W1579-L1596 HydrophobicContact CZ3-CD2 4.25Å
1580	R	96.6	Very high	94.4	Very high	70.6 Å²	70.6	40.5 Å²	40.5	27%	0.266	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	139.7	-175.9	-176.4	-176.7	-168.3	162.2	2.7	111.9	T1523 Q1582 P1589 L1591	T1523-R1580 PolarHBondContact N-O 3.07Å; T1523-R1580 PolarHBondContact O-N 2.84Å; R1580-Q1582 VanDerWaalsContact NE-OE1 3.15Å; R1580-P1589 HydrophobicContact CG-CB 3.62Å; R1580-P1589 HydrophobicContact CG-CG 4.15Å; R1580-L1591 CarbonylContact C-O 3.52Å; R1580-L1591 VanDerWaalsContact CA-O 3.29Å; R1580-L1591 WeakPolarHBondContact CA-O 3.35Å; R1580-L1591 WeakPolarHBondContact CG-O 3.32Å
1581	L	96.2	Very high	94.5	Very high	31.4 Å²	31.4	40.4 Å²	40.4	16%	0.164	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	123.5	167.1	-54.6	-174.7	0	0	0	109.4	F1520 F1522 P1589 C1590 L1591	F1520-L1581 HydrophobicContact CE2-CB 4.24Å; F1520-L1581 HydrophobicContact CE2-CD1 4.1Å; F1520-L1581 HydrophobicContact CE2-CD2 4.3Å; F1520-L1581 HydrophobicContact CE2-CG 4.47Å; F1520-L1581 HydrophobicContact CZ-CB 4.44Å; F1520-L1581 HydrophobicContact CZ-CD1 4.24Å; F1520-L1581 HydrophobicContact CZ-CD2 4.02Å; F1522-L1581 HydrophobicContact CB-CD2 4Å; F1522-L1581 HydrophobicContact CD2-CD2 3.19Å; F1522-L1581 HydrophobicContact CE2-CD2 3.91Å; F1522-L1581 HydrophobicContact CG-CD2 3.9Å; L1581-P1589 CarbonylContact O-C 3.54Å; L1581-P1589 WeakPolarHBondContact O-CA 3.34Å; L1581-P1589 VanDerWaalsContact O-CB 3.27Å; L1581-P1589 WeakPolarHBondContact O-CB 3.45Å; L1581-C1590 PolarHBondContact O-N 3.14Å; L1581-L1591 HydrophobicContact CB-CB 3.96Å; L1581-L1591 HydrophobicContact CD1-CB 3.94Å; L1581-L1591 HydrophobicContact CD1-CD2 3.87Å; L1581-L1591 HydrophobicContact CD1-CG 4.43Å; L1581-L1591 HydrophobicContact CG-CB 3.84Å; L1581-L1591 HydrophobicContact CG-CD2 4.01Å; L1581-L1591 HydrophobicContact CG-CG 4.47Å; L1581-L1591 PolarHBondContact N-O 3.03Å; L1581-L1591 PolarHBondContact O-N 3.16Å
1582	Q	94.7	Very high	94.7	Very high	21.2 Å²	21.2	40 Å²	40	10%	0.099	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	136	-174.3	-176.7	62.3	45.4	0	0	109.9	F1520 T1521 R1580 R1584 Y1586 P1589	F1520-Q1582 WeakPolarHBondContact CA-O 3.41Å; F1520-Q1582 WeakPolarHBondContact CD2-O 3.27Å; T1521-Q1582 PolarHBondContact N-O 3.02Å; T1521-Q1582 WeakPolarHBondContact O-CB 3.35Å; T1521-Q1582 PolarHBondContact O-N 2.97Å; R1580-Q1582 VanDerWaalsContact NE-OE1 3.15Å; Q1582-R1584 VanDerWaalsContact CG-O 3.3Å; Q1582-R1584 WeakPolarHBondContact CG-O 3.42Å; Q1582-R1584 PolarHBondContact NE2-O 2.86Å; Q1582-Y1586 PolarHBondContact NE2-O 2.9Å; Q1582-P1589 VanDerWaalsContact OE1-CA 3.3Å
1583	L	93.8	Very high	94.8	Very high	6 Å²	6	39.3 Å²	39.3	3%	0.031	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	120.9	172.2	-73.2	171	0	0	0	108.5	L1519 F1520 Y1586 C1590 W1658 T1661 V1662 F1665	L1519-L1583 WeakPolarHBondContact O-CA 3.47Å; F1520-L1583 HydrophobicContact CB-CD2 4.34Å; F1520-L1583 HydrophobicContact CD2-CD2 3.82Å; F1520-L1583 HydrophobicContact CD2-CG 4.48Å; L1583-Y1586 HydrophobicContact CB-CD2 4.08Å; L1583-Y1586 HydrophobicContact CB-CE2 4.26Å; L1583-Y1586 WeakPolarHBondContact O-CB 3.34Å; L1583-Y1586 VanDerWaalsContact O-CD2 3.29Å; L1583-Y1586 WeakPolarHBondContact O-CD2 3.39Å; L1583-Y1586 VanDerWaalsContact O-CG 3.31Å; L1583-Y1586 PolarHBondContact O-N 3.25Å; L1583-C1590 HydrophobicContact CD1-CB 3.97Å; L1583-C1590 WeakPolarHBondContact CD1-SG 3.39Å; L1583-C1590 HydrophobicContact CG-CB 4.48Å; L1583-C1590 WeakPolarHBondContact CG-SG 3.28Å; L1583-W1658 HydrophobicContact CD1-CE3 4.34Å; L1583-T1661 HydrophobicContact CB-CG2 4.33Å; L1583-T1661 HydrophobicContact CD2-CG2 4.35Å; L1583-V1662 HydrophobicContact CD1-CG2 3.62Å; L1583-V1662 HydrophobicContact CD2-CG2 4.47Å; L1583-F1665 HydrophobicContact CD2-CB 4.42Å
1584	R	91.2	Very high	94.9	Very high	54.4 Å²	54.4	40.2 Å²	40.2	21%	0.205	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	43.1	-147.3	-172.7	-65.2	-174.3	170.4	179.1	-1.7	111.8	D1440 E1444 E1518 L1519 Q1582 Y1586 T1661	D1440-R1584 VanDerWaalsContact CG-NH2 3.33Å; D1440-R1584 IonicContact OD1-NH2 3Å; D1440-R1584 PolarHBondContact OD1-NH2 3.09Å; D1440-R1584 IonicContact OD2-CZ 3.2Å; D1440-R1584 IonicContact OD2-NE 2.86Å; D1440-R1584 PolarHBondContact OD2-NE 3.09Å; D1440-R1584 IonicContact OD2-NH2 3.55Å; D1440-R1584 PolarHBondContact OD2-NH2 2.99Å; E1444-R1584 IonicContact OE2-CZ 3.01Å; E1444-R1584 IonicContact OE2-NH1 3.34Å; E1444-R1584 IonicContact OE2-NH2 3.49Å; E1444-R1584 PolarHBondContact OE2-NH2 3.14Å; E1444-R1584 VanDerWaalsContact OE2-NH2 3.17Å; E1518-R1584 VanDerWaalsContact O-CA 3.32Å; E1518-R1584 WeakPolarHBondContact O-CA 3.34Å; L1519-R1584 HydrophobicContact CD1-CG 4.2Å; L1519-R1584 PolarHBondContact O-N 3.07Å; Q1582-R1584 VanDerWaalsContact CG-O 3.3Å; Q1582-R1584 WeakPolarHBondContact CG-O 3.42Å; Q1582-R1584 PolarHBondContact NE2-O 2.86Å; R1584-Y1586 VanDerWaalsContact C-N 3.31Å; R1584-Y1586 HydrophobicContact CB-CD1 4.39Å; R1584-Y1586 HydrophobicContact CB-CE1 4.33Å; R1584-Y1586 PolarHBondContact O-N 2.98Å; R1584-T1661 HydrophobicContact CG-CG2 4.12Å
1585	D	87.6	Confident	95	Very high	92.6 Å²	92.6	42.7 Å²	42.7	50%	0.495	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	20.9	176.2	63.5	-29	0	0	0	113.3	Y1716	D1585-Y1716 VanDerWaalsContact OD1-CE1 3.31Å; D1585-Y1716 WeakPolarHBondContact OD1-CE1 3.37Å; D1585-Y1716 PolarHBondContact OD1-OH 3.04Å; D1585-Y1716 WeakPolarHBondContact OD2-CE1 3.17Å; D1585-Y1716 PolarHBondContact OD2-OH 2.95Å
1586	Y	92.2	Very high	95	Very high	12.8 Å²	12.8	40.1 Å²	40.1	5%	0.05	19%	0.193	C	C	.	.			trans	-61.1	138.4	-178.7	-64.1	-13.5	0	0	0	112.1	Q1582 L1583 R1584 K1588 W1658 T1661 P1715 Y1716	Q1582-Y1586 PolarHBondContact NE2-O 2.9Å; L1583-Y1586 HydrophobicContact CB-CD2 4.08Å; L1583-Y1586 HydrophobicContact CB-CE2 4.26Å; L1583-Y1586 WeakPolarHBondContact O-CB 3.34Å; L1583-Y1586 VanDerWaalsContact O-CD2 3.29Å; L1583-Y1586 WeakPolarHBondContact O-CD2 3.39Å; L1583-Y1586 VanDerWaalsContact O-CG 3.31Å; L1583-Y1586 PolarHBondContact O-N 3.25Å; R1584-Y1586 VanDerWaalsContact C-N 3.31Å; R1584-Y1586 HydrophobicContact CB-CD1 4.39Å; R1584-Y1586 HydrophobicContact CB-CE1 4.33Å; R1584-Y1586 PolarHBondContact O-N 2.98Å; Y1586-K1588 VanDerWaalsContact C-N 3.26Å; Y1586-K1588 PolarHBondContact O-N 2.99Å; Y1586-W1658 AromaticContact CD2-CD1 3.83Å; Y1586-W1658 HydrophobicContact CD2-CD2 4.2Å; Y1586-W1658 AromaticContact CD2-CE2 3.88Å; Y1586-W1658 HydrophobicContact CD2-CG 4.26Å; Y1586-W1658 HydrophobicContact CD2-CZ2 4.4Å; Y1586-W1658 AromaticContact CD2-NE1 3.77Å; Y1586-W1658 AromaticContact CE2-CD1 3.87Å; Y1586-W1658 HydrophobicContact CE2-CD2 4.42Å; Y1586-W1658 HydrophobicContact CE2-CG 4.15Å; Y1586-T1661 HydrophobicContact CE2-CG2 4.34Å; Y1586-T1661 PolarHBondContact OH-OG1 2.86Å; Y1586-P1715 HydrophobicContact CD1-CB 4.07Å; Y1586-P1715 HydrophobicContact CD1-CG 4.44Å; Y1586-P1715 HydrophobicContact CD2-CB 4.2Å; Y1586-P1715 HydrophobicContact CE1-CB 3.65Å; Y1586-P1715 HydrophobicContact CE1-CG 3.79Å; Y1586-P1715 HydrophobicContact CE2-CB 3.8Å; Y1586-P1715 HydrophobicContact CG-CB 4.27Å; Y1586-P1715 VanDerWaalsContact CZ-CB 3.46Å; Y1586-Y1716 HydrophobicContact CD1-CD1 4.27Å; Y1586-Y1716 AromaticContact CD1-CE1 3.81Å; Y1586-Y1716 HydrophobicContact CD1-CE1 3.81Å; Y1586-Y1716 HydrophobicContact CD1-CE2 4.41Å; Y1586-Y1716 AromaticContact CD1-CZ 3.91Å; Y1586-Y1716 AromaticContact CE1-CE1 3.91Å; Y1586-Y1716 HydrophobicContact CE1-CE1 4.21Å; Y1586-Y1716 HydrophobicContact CE1-CE2 4.19Å; Y1586-Y1716 AromaticContact CE1-CZ 3.86Å
1587	P	90.6	Very high	95	Very high	58.6 Å²	58.6	43.2 Å²	43.2	38%	0.381	21%	0.207	S	C	.	.	S	Bend	trans	-66.8	-24.3	-170.3	25.8	-35.4	0	0	0	113.5	A1718	P1587-A1718 HydrophobicContact CB-CB 4.04Å; P1587-A1718 HydrophobicContact CG-CB 3.93Å
1588	K	92	Very high	94.9	Very high	59 Å²	59	39.3 Å²	39.3	26%	0.257	19%	0.189	S	C	.	.	S	Bend	trans	-112.1	129.6	175.6	-63	-66.3	-171.8	171.2	0	109.5	Y1586 Y1653 W1658 A1718 F1721	Y1586-K1588 VanDerWaalsContact C-N 3.26Å; Y1586-K1588 PolarHBondContact O-N 2.99Å; K1588-Y1653 HydrophobicContact CB-CD1 4.02Å; K1588-Y1653 HydrophobicContact CB-CD2 4.33Å; K1588-Y1653 HydrophobicContact CB-CE1 4.42Å; K1588-Y1653 HydrophobicContact CB-CG 3.96Å; K1588-Y1653 HydrophobicContact CD-CD1 4.36Å; K1588-Y1653 HydrophobicContact CD-CE1 3.94Å; K1588-Y1653 HydrophobicContact CD-CE2 4.43Å; K1588-Y1653 HydrophobicContact CG-CD1 4.12Å; K1588-Y1653 HydrophobicContact CG-CE1 4.2Å; K1588-Y1653 HydrophobicContact CG-CG 4.41Å; K1588-W1658 HydrophobicContact CB-CH2 4.25Å; K1588-W1658 HydrophobicContact CB-CZ2 4.34Å; K1588-W1658 WeakPolarHBondContact O-CH2 3.45Å; K1588-W1658 WeakPolarHBondContact O-CZ2 3.46Å; K1588-A1718 HydrophobicContact CG-CB 4.4Å; K1588-F1721 HydrophobicContact CG-CE2 4.15Å; K1588-F1721 HydrophobicContact CG-CZ 3.96Å
1589	P	93.9	Very high	94.8	Very high	12.4 Å²	12.4	37.6 Å²	37.6	8%	0.081	18%	0.182	C	C	.	.			trans	-70.5	154	172.3	27.8	-32.2	0	0	0	111.4	R1580 L1581 Q1582 L1591 N1592 Y1653	R1580-P1589 HydrophobicContact CG-CB 3.62Å; R1580-P1589 HydrophobicContact CG-CG 4.15Å; L1581-P1589 CarbonylContact O-C 3.54Å; L1581-P1589 WeakPolarHBondContact O-CA 3.34Å; L1581-P1589 VanDerWaalsContact O-CB 3.27Å; L1581-P1589 WeakPolarHBondContact O-CB 3.45Å; Q1582-P1589 VanDerWaalsContact OE1-CA 3.3Å; P1589-L1591 VanDerWaalsContact C-N 3.34Å; P1589-N1592 HydrophobicContact CG-CB 3.88Å; P1589-Y1653 WeakPolarHBondContact O-CB 3.33Å; P1589-Y1653 WeakPolarHBondContact O-CD2 3.33Å
1590	C	93.3	Very high	94.7	Very high	23.2 Å²	23.2	35.9 Å²	35.9	16%	0.157	18%	0.18	C	C	.	.	S	Bend	trans	-69.4	-34.6	176.6	-60.7	0	0	0	0	113.2	L1581 L1583 I1652 Y1653 W1658	L1581-C1590 PolarHBondContact O-N 3.14Å; L1583-C1590 HydrophobicContact CD1-CB 3.97Å; L1583-C1590 WeakPolarHBondContact CD1-SG 3.39Å; L1583-C1590 HydrophobicContact CG-CB 4.48Å; L1583-C1590 WeakPolarHBondContact CG-SG 3.28Å; C1590-I1652 WeakPolarHBondContact O-CA 3.36Å; C1590-Y1653 PolarHBondContact O-N 3.12Å; C1590-Y1653 VanDerWaalsContact O-N 3.12Å; C1590-Y1653 PolarHBondContact SG-O 2.74Å; C1590-W1658 HydrophobicContact CB-CE3 4.46Å; C1590-W1658 HydrophobicContact CB-CZ3 3.92Å; C1590-W1658 WeakPolarHBondContact SG-CZ3 3.3Å
1591	L	96.1	Very high	94.6	Very high	19.8 Å²	19.8	35.7 Å²	35.7	10%	0.104	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	135.6	175	-178.9	70.4	0	0	0	108.4	W1579 R1580 L1581 P1589 I1593 F1650 H1651 I1652	W1579-L1591 HydrophobicContact CD2-CD2 3.92Å; W1579-L1591 HydrophobicContact CE3-CD2 4.04Å; W1579-L1591 HydrophobicContact CH2-CD2 4.1Å; W1579-L1591 HydrophobicContact CZ2-CD2 3.98Å; W1579-L1591 HydrophobicContact CZ3-CD2 4.09Å; R1580-L1591 CarbonylContact C-O 3.52Å; R1580-L1591 VanDerWaalsContact CA-O 3.29Å; R1580-L1591 WeakPolarHBondContact CA-O 3.35Å; R1580-L1591 WeakPolarHBondContact CG-O 3.32Å; L1581-L1591 HydrophobicContact CB-CB 3.96Å; L1581-L1591 HydrophobicContact CD1-CB 3.94Å; L1581-L1591 HydrophobicContact CD1-CD2 3.87Å; L1581-L1591 HydrophobicContact CD1-CG 4.43Å; L1581-L1591 HydrophobicContact CG-CB 3.84Å; L1581-L1591 HydrophobicContact CG-CD2 4.01Å; L1581-L1591 HydrophobicContact CG-CG 4.47Å; L1581-L1591 PolarHBondContact N-O 3.03Å; L1581-L1591 PolarHBondContact O-N 3.16Å; P1589-L1591 VanDerWaalsContact C-N 3.34Å; L1591-I1593 HydrophobicContact CD1-CD1 4.09Å; L1591-I1593 HydrophobicContact CD1-CG1 4.1Å; L1591-I1593 HydrophobicContact CD2-CD1 4.06Å; L1591-I1593 HydrophobicContact CG-CD1 4.21Å; L1591-I1593 HydrophobicContact CG-CG1 4.25Å; L1591-F1650 HydrophobicContact CD1-CE1 4.24Å; L1591-F1650 HydrophobicContact CD1-CE2 4.31Å; L1591-F1650 HydrophobicContact CD1-CZ 3.92Å; L1591-H1651 CarbonylContact C-O 3.52Å; L1591-H1651 WeakPolarHBondContact CA-O 3.27Å; L1591-I1652 HydrophobicContact CD1-CD1 4.29Å; L1591-I1652 HydrophobicContact CD1-CG1 3.69Å
1592	N	97.2	Very high	94.5	Very high	17.2 Å²	17.2	35.4 Å²	35.4	9%	0.092	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	115	169.6	-179.7	83.7	0	0	0	109.7	R1578 W1579 P1589 H1651	R1578-N1592 VanDerWaalsContact CZ-OD1 3.3Å; R1578-N1592 PolarHBondContact NE-OD1 2.92Å; R1578-N1592 PolarHBondContact NH2-OD1 3.25Å; W1579-N1592 CarbonylContact O-C 3.53Å; W1579-N1592 WeakPolarHBondContact O-CA 3.4Å; P1589-N1592 HydrophobicContact CG-CB 3.88Å; N1592-H1651 HydrophobicContact CB-CB 4.47Å; N1592-H1651 PolarHBondContact N-O 3.08Å; N1592-H1651 PolarHBondContact O-N 2.95Å
1593	I	97.4	Very high	94.5	Very high	5.2 Å²	5.2	34.4 Å²	34.4	3%	0.027	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	140.6	178.2	-65.5	169.3	0	0	0	108.5	R1578 W1579 L1591 L1596 L1647 S1649 F1650	R1578-I1593 CarbonylContact C-O 3.57Å; R1578-I1593 WeakPolarHBondContact CA-O 3.32Å; W1579-I1593 HydrophobicContact CB-CB 4.26Å; W1579-I1593 HydrophobicContact CD2-CD1 4.38Å; W1579-I1593 HydrophobicContact CE3-CD1 3.74Å; W1579-I1593 VanDerWaalsContact CE3-CD1 3.43Å; W1579-I1593 HydrophobicContact CZ3-CD1 4.15Å; W1579-I1593 PolarHBondContact N-O 3.27Å; W1579-I1593 PolarHBondContact O-N 3.14Å; L1591-I1593 HydrophobicContact CD1-CD1 4.09Å; L1591-I1593 HydrophobicContact CD1-CG1 4.1Å; L1591-I1593 HydrophobicContact CD2-CD1 4.06Å; L1591-I1593 HydrophobicContact CG-CD1 4.21Å; L1591-I1593 HydrophobicContact CG-CG1 4.25Å; I1593-L1596 HydrophobicContact CG2-CB 4.01Å; I1593-L1647 HydrophobicContact CG2-CD2 3.57Å; I1593-L1647 VanDerWaalsContact CG2-CD2 3.42Å; I1593-S1649 VanDerWaalsContact CA-O 3.29Å; I1593-S1649 WeakPolarHBondContact CA-O 3.28Å; I1593-F1650 HydrophobicContact CD1-CD2 3.71Å; I1593-F1650 HydrophobicContact CD1-CE2 3.58Å; I1593-F1650 VanDerWaalsContact CD1-CE2 3.48Å; I1593-F1650 HydrophobicContact CD1-CZ 4.26Å; I1593-F1650 HydrophobicContact CG1-CD2 3.63Å; I1593-F1650 HydrophobicContact CG1-CE2 3.97Å; I1593-F1650 HydrophobicContact CG1-CG 4.28Å
1594	T	97.2	Very high	94.5	Very high	28.4 Å²	28.4	35 Å²	35	17%	0.174	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	145.5	175.5	65.7	0	0	0	0	111.9	E1577 R1578 L1596 K1648 S1649	E1577-T1594 CarbonylContact O-C 3.53Å; E1577-T1594 WeakPolarHBondContact O-CA 3.43Å; R1578-T1594 HydrophobicContact CG-CG2 4.45Å; T1594-L1596 PolarHBondContact O-N 3.16Å; T1594-K1648 PolarHBondContact O-N 3.06Å; T1594-K1648 VanDerWaalsContact O-N 3.1Å; T1594-S1649 WeakPolarHBondContact CG2-OG 3.38Å; T1594-S1649 PolarHBondContact N-O 2.92Å; T1594-S1649 PolarHBondContact O-N 3.15Å; T1594-S1649 WeakPolarHBondContact OG1-CB 3.23Å; T1594-S1649 PolarHBondContact OG1-N 3.3Å; T1594-S1649 PolarHBondContact OG1-OG 3.16Å
1595	D	97.3	Very high	94.6	Very high	76.4 Å²	76.4	32.4 Å²	32.4	41%	0.409	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	50.6	55	177.6	-58.6	-38.6	0	0	0	113	V1576 E1577 K1648	V1576-D1595 CarbonylContact O-C 3.53Å; E1577-D1595 PolarHBondContact O-N 2.93Å; D1595-K1648 HydrophobicContact CB-CB 3.85Å; D1595-K1648 HydrophobicContact CB-CD 4.06Å; D1595-K1648 WeakPolarHBondContact OD2-CD 3.37Å; D1595-K1648 IonicContact OD2-NZ 2.74Å; D1595-K1648 PolarHBondContact OD2-NZ 2.84Å
1596	L	97.2	Very high	94.8	Very high	7.8 Å²	7.8	29.1 Å²	29.1	4%	0.041	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	124.8	177.2	167.8	65.6	0	0	0	110.7	M1574 N1575 V1576 W1579 I1593 T1594 L1598 A1645 D1646 L1647	M1574-L1596 HydrophobicContact CE-CD2 3.64Å; M1574-L1596 HydrophobicContact CE-CG 4.46Å; N1575-L1596 CarbonylContact C-O 3.53Å; N1575-L1596 VanDerWaalsContact CA-O 3.31Å; N1575-L1596 WeakPolarHBondContact CA-O 3.41Å; N1575-L1596 PolarHBondContact ND2-O 2.92Å; V1576-L1596 HydrophobicContact CB-CB 4.35Å; V1576-L1596 HydrophobicContact CB-CD2 4.15Å; V1576-L1596 HydrophobicContact CG2-CD2 4.22Å; V1576-L1596 PolarHBondContact N-O 3.07Å; V1576-L1596 PolarHBondContact O-N 3.22Å; W1579-L1596 HydrophobicContact CE3-CD2 3.97Å; W1579-L1596 HydrophobicContact CZ3-CD2 4.25Å; I1593-L1596 HydrophobicContact CG2-CB 4.01Å; T1594-L1596 PolarHBondContact O-N 3.16Å; L1596-L1598 HydrophobicContact CD1-CB 4.28Å; L1596-A1645 HydrophobicContact CD1-CB 4.08Å; L1596-D1646 CarbonylContact C-O 3.59Å; L1596-D1646 WeakPolarHBondContact CA-O 3.26Å; L1596-L1647 HydrophobicContact CB-CD2 4.38Å; L1596-L1647 HydrophobicContact CD1-CD1 4.24Å; L1596-L1647 HydrophobicContact CD1-CD2 3.72Å; L1596-L1647 HydrophobicContact CD1-CG 3.69Å; L1596-L1647 HydrophobicContact CG-CD2 4.4Å
1597	F	97.6	Very high	94.6	Very high	66.6 Å²	66.6	30 Å²	30	29%	0.292	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	118	163.7	-179	-123.4	0	0	0	109.6	T1573 M1574 N1575 W1599 A1645 D1646	T1573-F1597 HydrophobicContact CG2-CE2 4.05Å; T1573-F1597 VanDerWaalsContact CG2-CE2 3.48Å; T1573-F1597 HydrophobicContact CG2-CZ 4.09Å; M1574-F1597 CarbonylContact O-C 3.54Å; M1574-F1597 WeakPolarHBondContact O-CA 3.32Å; N1575-F1597 HydrophobicContact CB-CD2 4.26Å; N1575-F1597 WeakPolarHBondContact OD1-CD2 3.42Å; N1575-F1597 WeakPolarHBondContact OD1-CE2 3.3Å; F1597-W1599 HydrophobicContact CD1-CD2 4.27Å; F1597-W1599 AromaticContact CD1-CE3 3.27Å; F1597-W1599 HydrophobicContact CD1-CE3 3.27Å; F1597-W1599 HydrophobicContact CD1-CH2 4.36Å; F1597-W1599 AromaticContact CD1-CZ3 3.35Å; F1597-W1599 HydrophobicContact CD1-CZ3 3.35Å; F1597-W1599 VanDerWaalsContact CD1-CZ3 3.48Å; F1597-W1599 AromaticContact CE1-CD2 3.87Å; F1597-W1599 HydrophobicContact CE1-CD2 3.87Å; F1597-W1599 AromaticContact CE1-CE3 3.31Å; F1597-W1599 HydrophobicContact CE1-CE3 3.31Å; F1597-W1599 VanDerWaalsContact CE1-CE3 3.41Å; F1597-W1599 HydrophobicContact CE1-CG 4.44Å; F1597-W1599 HydrophobicContact CE1-CH2 4.45Å; F1597-W1599 AromaticContact CE1-CZ3 3.75Å; F1597-W1599 HydrophobicContact CE1-CZ3 3.75Å; F1597-W1599 AromaticContact CG-CE3 3.97Å; F1597-W1599 HydrophobicContact CG-CE3 4.05Å; F1597-W1599 HydrophobicContact CG-CZ3 4.24Å; F1597-W1599 HydrophobicContact CZ-CB 4.44Å; F1597-W1599 HydrophobicContact CZ-CD2 4.42Å; F1597-W1599 HydrophobicContact CZ-CE3 4.12Å; F1597-W1599 VanDerWaalsContact O-CZ3 3.31Å; F1597-W1599 WeakPolarHBondContact O-CZ3 3.28Å; F1597-A1645 CarbonylContact O-C 3.55Å; F1597-A1645 VanDerWaalsContact O-CA 3.24Å; F1597-A1645 WeakPolarHBondContact O-CA 3.39Å; F1597-A1645 WeakPolarHBondContact O-CB 3.42Å; F1597-D1646 PolarHBondContact N-O 2.91Å; F1597-D1646 PolarHBondContact O-N 3.16Å
1598	L	96.3	Very high	94.4	Very high	19.6 Å²	19.6	31.2 Å²	31.2	10%	0.103	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	134	-178.5	175.9	91.3	0	0	0	109.5	I1572 T1573 M1574 L1596 L1643 N1644 A1645 L1698	I1572-L1598 HydrophobicContact CD1-CD2 4.24Å; I1572-L1598 HydrophobicContact CG2-CD2 4.38Å; T1573-L1598 CarbonylContact C-O 3.48Å; T1573-L1598 VanDerWaalsContact CA-O 3.26Å; T1573-L1598 WeakPolarHBondContact CA-O 3.25Å; M1574-L1598 HydrophobicContact CB-CB 4.28Å; M1574-L1598 HydrophobicContact CB-CD2 4.34Å; M1574-L1598 HydrophobicContact CE-CB 4.21Å; M1574-L1598 HydrophobicContact CE-CD1 4.29Å; M1574-L1598 HydrophobicContact CE-CD2 3.93Å; M1574-L1598 PolarHBondContact N-O 3.25Å; M1574-L1598 PolarHBondContact O-N 3.1Å; L1596-L1598 HydrophobicContact CD1-CB 4.28Å; L1598-L1643 HydrophobicContact CD1-CB 3.95Å; L1598-L1643 HydrophobicContact CD1-CD1 4.29Å; L1598-L1643 HydrophobicContact CD2-CD1 4.38Å; L1598-L1643 HydrophobicContact CD2-CD2 4.1Å; L1598-L1643 HydrophobicContact CG-CD1 4.38Å; L1598-N1644 CarbonylContact C-O 3.49Å; L1598-N1644 WeakPolarHBondContact CA-O 3.39Å; L1598-A1645 HydrophobicContact CB-CB 4.22Å; L1598-A1645 HydrophobicContact CD1-CB 3.86Å; L1598-A1645 HydrophobicContact CG-CB 4.28Å; L1598-L1698 HydrophobicContact CD1-CD1 4.27Å
1599	W	95.4	Very high	94	Very high	57 Å²	57	28.9 Å²	28.9	22%	0.216	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	157.2	176.9	69.2	97.4	0	0	0	112.8	M1313 I1572 T1573 F1597 L1643 N1644 D1646	M1313-W1599 HydrophobicContact CE-CG 4.24Å; I1572-W1599 VanDerWaalsContact O-CA 3.26Å; I1572-W1599 WeakPolarHBondContact O-CA 3.14Å; T1573-W1599 HydrophobicContact CG2-CB 3.76Å; F1597-W1599 HydrophobicContact CD1-CD2 4.27Å; F1597-W1599 AromaticContact CD1-CE3 3.27Å; F1597-W1599 HydrophobicContact CD1-CE3 3.27Å; F1597-W1599 HydrophobicContact CD1-CH2 4.36Å; F1597-W1599 AromaticContact CD1-CZ3 3.35Å; F1597-W1599 HydrophobicContact CD1-CZ3 3.35Å; F1597-W1599 VanDerWaalsContact CD1-CZ3 3.48Å; F1597-W1599 AromaticContact CE1-CD2 3.87Å; F1597-W1599 HydrophobicContact CE1-CD2 3.87Å; F1597-W1599 AromaticContact CE1-CE3 3.31Å; F1597-W1599 HydrophobicContact CE1-CE3 3.31Å; F1597-W1599 VanDerWaalsContact CE1-CE3 3.41Å; F1597-W1599 HydrophobicContact CE1-CG 4.44Å; F1597-W1599 HydrophobicContact CE1-CH2 4.45Å; F1597-W1599 AromaticContact CE1-CZ3 3.75Å; F1597-W1599 HydrophobicContact CE1-CZ3 3.75Å; F1597-W1599 AromaticContact CG-CE3 3.97Å; F1597-W1599 HydrophobicContact CG-CE3 4.05Å; F1597-W1599 HydrophobicContact CG-CZ3 4.24Å; F1597-W1599 HydrophobicContact CZ-CB 4.44Å; F1597-W1599 HydrophobicContact CZ-CD2 4.42Å; F1597-W1599 HydrophobicContact CZ-CE3 4.12Å; F1597-W1599 VanDerWaalsContact O-CZ3 3.31Å; F1597-W1599 WeakPolarHBondContact O-CZ3 3.28Å; W1599-L1643 WeakPolarHBondContact O-CA 3.41Å; W1599-L1643 WeakPolarHBondContact O-CD2 3.32Å; W1599-N1644 HydrophobicContact CD2-CB 4.14Å; W1599-N1644 HydrophobicContact CH2-CB 4.02Å; W1599-N1644 HydrophobicContact CZ2-CB 3.52Å; W1599-N1644 VanDerWaalsContact CZ2-CB 3.48Å; W1599-N1644 PolarHBondContact N-O 3.21Å; W1599-N1644 PolarHBondContact O-N 3.14Å; W1599-D1646 HydrophobicContact CH2-CB 4.43Å; W1599-D1646 VanDerWaalsContact CH2-CG 3.44Å; W1599-D1646 WeakPolarHBondContact CH2-OD1 3.31Å; W1599-D1646 WeakPolarHBondContact CH2-OD2 3.4Å; W1599-D1646 HydrophobicContact CZ3-CB 4.22Å; W1599-D1646 VanDerWaalsContact CZ3-OD2 3.32Å; W1599-D1646 WeakPolarHBondContact CZ3-OD2 3.41Å
1600	G	94.3	Very high	93.5	Very high	13.2 Å²	13.2	32.2 Å²	32.2	14%	0.136	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	145.7	-159.5	174.3	0	0	0	0	0	112.9	I1571 I1572 D1642	I1571-G1600 CarbonylContact C-O 3.51Å; I1571-G1600 WeakPolarHBondContact CA-O 3.31Å; I1572-G1600 PolarHBondContact N-O 3.11Å; I1572-G1600 PolarHBondContact O-N 3.26Å; G1600-D1642 CarbonylContact C-O 3.56Å; G1600-D1642 VanDerWaalsContact CA-O 3.29Å; G1600-D1642 WeakPolarHBondContact CA-O 3.4Å
1601	K	94.2	Very high	93	Very high	67.2 Å²	67.2	37.4 Å²	37.4	29%	0.292	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	139.7	-177.8	-66.8	172	-178.1	171.3	0	110.5	M1550 I1571 Y1641 D1642	M1550-K1601 HydrophobicContact CE-CB 3.34Å; M1550-K1601 VanDerWaalsContact CE-CB 3.41Å; M1550-K1601 HydrophobicContact CE-CD 4.12Å; M1550-K1601 HydrophobicContact CE-CG 4.4Å; I1571-K1601 HydrophobicContact CG1-CG 4.16Å; K1601-Y1641 WeakPolarHBondContact O-CA 3.41Å; K1601-D1642 PolarHBondContact N-O 3.08Å; K1601-D1642 PolarHBondContact O-N 3.06Å; K1601-D1642 VanDerWaalsContact O-N 3.1Å
1602	L	94.6	Very high	92.4	Very high	24 Å²	24	42.2 Å²	42.2	13%	0.126	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	122.8	175.4	175.5	66.3	0	0	0	110.1	C1569 R1570 I1572 I1604 F1639 Y1640	C1569-L1602 CarbonylContact C-O 3.55Å; C1569-L1602 WeakPolarHBondContact CA-O 3.42Å; R1570-L1602 PolarHBondContact N-O 2.94Å; R1570-L1602 PolarHBondContact O-N 3.19Å; I1572-L1602 HydrophobicContact CD1-CB 3.99Å; I1572-L1602 HydrophobicContact CD1-CD2 4.08Å; I1572-L1602 HydrophobicContact CD1-CG 4.37Å; I1572-L1602 HydrophobicContact CG1-CB 4.21Å; I1572-L1602 HydrophobicContact CG2-CB 4.21Å; I1572-L1602 HydrophobicContact CG2-CD2 4.38Å; L1602-I1604 HydrophobicContact CD1-CG1 4.1Å; L1602-I1604 HydrophobicContact CD2-CD1 4.29Å; L1602-I1604 HydrophobicContact CD2-CG1 4.39Å; L1602-I1604 HydrophobicContact CG-CD1 4.37Å; L1602-I1604 HydrophobicContact CG-CG1 4.22Å; L1602-F1639 HydrophobicContact CD1-CB 4.19Å; L1602-F1639 HydrophobicContact CD1-CD1 4.4Å; L1602-Y1640 WeakPolarHBondContact CD1-O 3.41Å
1603	V	95.1	Very high	91.7	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	135.2	168.5	-173.6	0	0	0	0	109.7	V1543 Q1546 M1547 M1550 L1567 W1568 C1569 F1639 Y1640	V1543-V1603 HydrophobicContact CG1-CB 4.39Å; V1543-V1603 HydrophobicContact CG1-CG1 3.48Å; V1543-V1603 VanDerWaalsContact CG1-CG1 3.45Å; V1543-V1603 HydrophobicContact CG1-CG2 4.27Å; Q1546-V1603 HydrophobicContact CB-CG2 4.28Å; M1547-V1603 HydrophobicContact CG-CB 4.03Å; M1547-V1603 HydrophobicContact CG-CG1 3.55Å; M1547-V1603 HydrophobicContact CG-CG2 4.09Å; M1547-V1603 HydrophobicContact SD-CG1 3.79Å; M1550-V1603 HydrophobicContact CE-CG2 4.24Å; M1550-V1603 HydrophobicContact SD-CG2 3.91Å; L1567-V1603 HydrophobicContact CD1-CG1 4.38Å; W1568-V1603 WeakPolarHBondContact O-CA 3.42Å; C1569-V1603 HydrophobicContact CB-CG2 3.88Å; V1603-F1639 WeakPolarHBondContact O-CA 3.21Å; V1603-Y1640 PolarHBondContact N-O 3.04Å; V1603-Y1640 PolarHBondContact O-N 3.09Å
1604	I	93.8	Very high	91.1	Very high	19 Å²	19	42.9 Å²	42.9	10%	0.097	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	123.5	171.8	-61.4	-166	0	0	0	108.7	L1567 W1568 L1602 T1637 F1639	L1567-I1604 WeakPolarHBondContact CA-O 3.38Å; W1568-I1604 HydrophobicContact CD2-CB 4.34Å; W1568-I1604 HydrophobicContact CH2-CB 4.45Å; W1568-I1604 HydrophobicContact CH2-CD1 3.62Å; W1568-I1604 HydrophobicContact CH2-CG1 3.9Å; W1568-I1604 HydrophobicContact CZ2-CB 4.03Å; W1568-I1604 HydrophobicContact CZ2-CD1 3.51Å; W1568-I1604 VanDerWaalsContact CZ2-CD1 3.46Å; W1568-I1604 HydrophobicContact CZ2-CG1 3.98Å; W1568-I1604 HydrophobicContact CZ3-CD1 4.4Å; W1568-I1604 HydrophobicContact CZ3-CG1 4.3Å; W1568-I1604 PolarHBondContact N-O 3.09Å; W1568-I1604 VanDerWaalsContact N-O 3.16Å; W1568-I1604 PolarHBondContact O-N 3.16Å; L1602-I1604 HydrophobicContact CD1-CG1 4.1Å; L1602-I1604 HydrophobicContact CD2-CD1 4.29Å; L1602-I1604 HydrophobicContact CD2-CG1 4.39Å; L1602-I1604 HydrophobicContact CG-CD1 4.37Å; L1602-I1604 HydrophobicContact CG-CG1 4.22Å; I1604-T1637 HydrophobicContact CG2-CG2 3.35Å; I1604-T1637 VanDerWaalsContact CG2-CG2 3.5Å; I1604-F1639 HydrophobicContact CD1-CD1 3.85Å; I1604-F1639 HydrophobicContact CD1-CE1 3.59Å; I1604-F1639 VanDerWaalsContact CD1-CE1 3.4Å; I1604-F1639 HydrophobicContact CD1-CZ 4.32Å; I1604-F1639 HydrophobicContact CG1-CD1 3.9Å; I1604-F1639 HydrophobicContact CG1-CE1 4.12Å; I1604-F1639 HydrophobicContact CG1-CG 4.31Å
1605	A	93.3	Very high	90.4	Very high	1.2 Å²	1.2	43.6 Å²	43.6	1%	0.01	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	126.5	-176.3	0	0	0	0	0	111.5	M1547 F1564 T1566 L1567 K1638 Y1640	M1547-A1605 HydrophobicContact CE-CB 3.71Å; M1547-A1605 VanDerWaalsContact CE-CB 3.48Å; M1547-A1605 HydrophobicContact SD-CB 4.31Å; F1564-A1605 HydrophobicContact CD1-CB 3.89Å; F1564-A1605 HydrophobicContact CE1-CB 3.9Å; T1566-A1605 CarbonylContact O-C 3.54Å; T1566-A1605 VanDerWaalsContact O-CA 3.27Å; T1566-A1605 WeakPolarHBondContact O-CA 3.41Å; L1567-A1605 HydrophobicContact CD1-CB 4Å; A1605-K1638 PolarHBondContact N-O 3.02Å; A1605-K1638 PolarHBondContact O-N 3.01Å; A1605-Y1640 HydrophobicContact CB-CD2 4.44Å; A1605-Y1640 HydrophobicContact CB-CE2 4.09Å
1606	E	90.8	Very high	89.7	Confident	22.8 Å²	22.8	46.8 Å²	46.8	11%	0.107	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	100.5	171	-173.4	-172.8	172.9	0	0	107.2	K1352 F1564 S1565 T1566	K1352-E1606 IonicContact NZ-OE1 3.09Å; K1352-E1606 PolarHBondContact NZ-OE1 3.23Å; K1352-E1606 IonicContact NZ-OE2 3.34Å; K1352-E1606 PolarHBondContact NZ-OE2 3.33Å; K1352-E1606 VanDerWaalsContact NZ-OE2 3.15Å; F1564-E1606 CarbonylContact C-O 3.56Å; F1564-E1606 WeakPolarHBondContact CA-O 3.5Å; S1565-E1606 PolarHBondContact N-O 3.01Å; S1565-E1606 WeakPolarHBondContact OG-CB 3.37Å; S1565-E1606 VanDerWaalsContact OG-CG 3.31Å; S1565-E1606 WeakPolarHBondContact OG-CG 3.26Å; S1565-E1606 PolarHBondContact OG-O 3.05Å; S1565-E1606 PolarHBondContact OG-OE2 2.92Å; T1566-E1606 PolarHBondContact N-O 3.19Å; T1566-E1606 PolarHBondContact O-N 2.99Å; T1566-E1606 PolarHBondContact OG1-OE2 3.01Å
1607	Q	89.5	Confident	89.1	Confident	30.4 Å²	30.4	48.2 Å²	48.2	14%	0.142	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	139.5	179.6	-170.1	177.9	-0	0	0	110.4	D1563 F1564 A1609 S1635	D1563-Q1607 CarbonylContact O-C 3.51Å; D1563-Q1607 WeakPolarHBondContact O-CA 3.18Å; D1563-Q1607 WeakPolarHBondContact O-CG 3.38Å; F1564-Q1607 HydrophobicContact CD1-CB 4.2Å; F1564-Q1607 HydrophobicContact CD1-CG 4.44Å; F1564-Q1607 HydrophobicContact CE1-CB 4.19Å; F1564-Q1607 HydrophobicContact CE1-CG 4.25Å; Q1607-A1609 PolarHBondContact O-N 3.13Å; Q1607-S1635 WeakPolarHBondContact O-CB 3.38Å; Q1607-S1635 PolarHBondContact O-OG 3.14Å
1608	M	85.8	Confident	88.5	Confident	84.8 Å²	84.8	48.7 Å²	48.7	42%	0.418	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-62.9	136	174.5	-105.3	-173.4	138.2	0	0	110.2	Q1562 D1563 F1633	Q1562-M1608 VanDerWaalsContact O-SD 3.34Å; D1563-M1608 WeakPolarHBondContact O-CB 3.3Å; D1563-M1608 PolarHBondContact O-N 3.12Å; M1608-F1633 HydrophobicContact CE-CE1 4.14Å; M1608-F1633 HydrophobicContact CE-CE2 4.32Å; M1608-F1633 HydrophobicContact CE-CZ 3.89Å; M1608-F1633 VanDerWaalsContact CE-CZ 3.47Å; M1608-F1633 HydrophobicContact CG-CE1 4.19Å; M1608-F1633 HydrophobicContact CG-CZ 4.4Å
1609	A	83.9	Confident	87.9	Confident	11 Å²	11	48.6 Å²	48.6	9%	0.091	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-87.1	143.4	179.4	0	0	0	0	0	111.2	Q1607 G1613 Q1614 F1633 S1635	Q1607-A1609 PolarHBondContact O-N 3.13Å; A1609-G1613 WeakPolarHBondContact CB-O 3.26Å; A1609-Q1614 HydrophobicContact CB-CG 4.47Å; A1609-Q1614 WeakPolarHBondContact O-CG 3.33Å; A1609-Q1614 PolarHBondContact O-NE2 3.19Å; A1609-F1633 HydrophobicContact CB-CB 4.15Å; A1609-F1633 HydrophobicContact CB-CD1 4.06Å; A1609-F1633 HydrophobicContact CB-CG 4.43Å; A1609-S1635 WeakPolarHBondContact CB-OG 3.36Å
1610	D	83.5	Confident	87.3	Confident	82.2 Å²	82.2	52.8 Å²	52.8	44%	0.44	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-59.5	166.9	168.9	-57	-1.1	0	0	0	111.2	K1612 G1613 Q1614 K1787	D1610-K1612 PolarHBondContact O-N 2.96Å; D1610-G1613 CarbonylContact O-C 3.57Å; D1610-G1613 WeakPolarHBondContact O-CA 3.32Å; D1610-G1613 PolarHBondContact O-N 3.1Å; D1610-Q1614 WeakPolarHBondContact O-CG 3.37Å; D1610-Q1614 PolarHBondContact O-N 3.21Å; D1610-K1787 WeakPolarHBondContact OD1-CD 3.22Å; D1610-K1787 WeakPolarHBondContact OD1-CE 3.45Å; D1610-K1787 IonicContact OD1-NZ 3.39Å; D1610-K1787 PolarHBondContact OD1-NZ 2.95Å; D1610-K1787 VanDerWaalsContact OD2-CD 3.29Å; D1610-K1787 WeakPolarHBondContact OD2-CD 3.3Å; D1610-K1787 WeakPolarHBondContact OD2-CE 3.43Å; D1610-K1787 IonicContact OD2-NZ 3.2Å; D1610-K1787 PolarHBondContact OD2-NZ 3Å
1611	N	81.7	Confident	86.4	Confident	130.8 Å²	130.8	54 Å²	54	70%	0.699	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-49.8	-36.8	-177.4	-66.5	-8.4	0	0	0	114.1	G1613 Q1614	N1611-G1613 VanDerWaalsContact C-N 3.31Å; N1611-G1613 PolarHBondContact O-N 3.2Å; N1611-Q1614 PolarHBondContact O-N 3.13Å
1612	K	83.5	Confident	85.6	Confident	120.6 Å²	120.6	52.5 Å²	52.5	52%	0.524	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-71.3	-21.1	177.5	-67.1	-170.2	177.7	-172.1	0	114.1	D1610 Y1790 Y1793	D1610-K1612 PolarHBondContact O-N 2.96Å; K1612-Y1790 WeakPolarHBondContact O-CB 3.32Å; K1612-Y1790 PolarHBondContact O-N 3.07Å; K1612-Y1793 WeakPolarHBondContact O-CD2 3.35Å
1613	G	83.1	Confident	84.4	Confident	0.6 Å²	0.6	60.5 Å²	60.5	1%	0.006	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-96.4	6.2	176.6	0	0	0	0	0	113.7	A1609 D1610 N1611 F1633 S1634 Y1788 Y1790	A1609-G1613 WeakPolarHBondContact CB-O 3.26Å; D1610-G1613 CarbonylContact O-C 3.57Å; D1610-G1613 WeakPolarHBondContact O-CA 3.32Å; D1610-G1613 PolarHBondContact O-N 3.1Å; N1611-G1613 VanDerWaalsContact C-N 3.31Å; N1611-G1613 PolarHBondContact O-N 3.2Å; G1613-F1633 CarbonylContact O-C 3.49Å; G1613-F1633 WeakPolarHBondContact O-CA 3.45Å; G1613-S1634 VanDerWaalsContact CA-OG 3.27Å; G1613-S1634 WeakPolarHBondContact CA-OG 3.32Å; G1613-S1634 WeakPolarHBondContact O-CB 3.21Å; G1613-S1634 PolarHBondContact O-N 3.1Å; G1613-S1634 PolarHBondContact O-OG 3.18Å; G1613-S1634 VanDerWaalsContact O-OG 3.04Å; G1613-Y1788 WeakPolarHBondContact CA-O 3.23Å; G1613-Y1788 PolarHBondContact N-O 3.4Å; G1613-Y1790 VanDerWaalsContact O-CE2 3.32Å; G1613-Y1790 WeakPolarHBondContact O-CE2 3.34Å
1614	Q	84.9	Confident	83.4	Confident	38.2 Å²	38.2	63.9 Å²	63.9	18%	0.179	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	139.4	177.4	-64.3	-179.3	24.5	0	0	110.8	A1609 D1610 N1611 I1631 R1632 F1633 Y1793	A1609-Q1614 HydrophobicContact CB-CG 4.47Å; A1609-Q1614 WeakPolarHBondContact O-CG 3.33Å; A1609-Q1614 PolarHBondContact O-NE2 3.19Å; D1610-Q1614 WeakPolarHBondContact O-CG 3.37Å; D1610-Q1614 PolarHBondContact O-N 3.21Å; N1611-Q1614 PolarHBondContact O-N 3.13Å; Q1614-I1631 HydrophobicContact CB-CG2 3.99Å; Q1614-I1631 HydrophobicContact CG-CG2 4.16Å; Q1614-R1632 CarbonylContact C-O 3.49Å; Q1614-R1632 WeakPolarHBondContact CA-O 3.38Å; Q1614-F1633 HydrophobicContact CB-CD1 4.43Å; Q1614-F1633 HydrophobicContact CG-CD1 3.68Å; Q1614-F1633 HydrophobicContact CG-CE1 3.75Å; Q1614-Y1793 WeakPolarHBondContact O-CE2 3.23Å; Q1614-Y1793 VanDerWaalsContact O-CZ 3.27Å; Q1614-Y1793 PolarHBondContact O-OH 3.22Å
1615	H	82.2	Confident	82.6	Confident	41.6 Å²	41.6	67 Å²	67	19%	0.193	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	138.7	172.2	137.4	-79.2	0	0	0	110.5	V1617 R1632 K1677 Y1790	H1615-V1617 VanDerWaalsContact ND1-CG2 3.28Å; H1615-V1617 WeakPolarHBondContact ND1-CG2 3.3Å; H1615-R1632 WeakPolarHBondContact CE1-CB 3.47Å; H1615-R1632 PolarHBondContact N-O 2.96Å; H1615-R1632 PolarHBondContact ND1-O 3.42Å; H1615-R1632 VanDerWaalsContact ND1-O 3.12Å; H1615-R1632 VanDerWaalsContact NE2-CB 3.33Å; H1615-R1632 WeakPolarHBondContact NE2-CB 3.38Å; H1615-R1632 PolarHBondContact O-N 3.12Å; H1615-K1677 PolarHBondContact CE1-NZ 3.29Å; H1615-K1677 PolarHBondContact NE2-NZ 3.08Å; H1615-Y1790 HydrophobicContact CB-CD1 4.18Å; H1615-Y1790 HydrophobicContact CB-CD2 4.08Å; H1615-Y1790 HydrophobicContact CB-CE1 3.92Å; H1615-Y1790 HydrophobicContact CB-CE2 3.75Å; H1615-Y1790 VanDerWaalsContact CB-CE2 3.45Å; H1615-Y1790 HydrophobicContact CB-CG 4.3Å
1616	K	83.7	Confident	82	Confident	145 Å²	145	70.2 Å²	70.2	63%	0.63	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.3	124.6	179.5	-68	179.5	-178.7	-179.4	0	109.9	T1629 L1630 I1631	K1616-T1629 HydrophobicContact CB-CG2 3.75Å; K1616-T1629 HydrophobicContact CD-CG2 4.14Å; K1616-T1629 HydrophobicContact CG-CG2 4.02Å; K1616-L1630 CarbonylContact C-O 3.52Å; K1616-L1630 WeakPolarHBondContact CA-O 3.39Å; K1616-I1631 HydrophobicContact CG-CG1 4.38Å
1617	V	83.6	Confident	81.7	Confident	37.2 Å²	37.2	73.3 Å²	73.3	23%	0.225	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	118.2	174.9	-179.3	0	0	0	0	108.3	L1208 H1615 I1619 L1630 R1632	L1208-V1617 HydrophobicContact CD1-CG1 4.42Å; H1615-V1617 VanDerWaalsContact ND1-CG2 3.28Å; H1615-V1617 WeakPolarHBondContact ND1-CG2 3.3Å; V1617-I1619 HydrophobicContact CG1-CG1 4.4Å; V1617-I1619 PolarHBondContact O-N 3.08Å; V1617-L1630 PolarHBondContact N-O 3.13Å; V1617-L1630 PolarHBondContact O-N 3.07Å; V1617-R1632 HydrophobicContact CB-CG 4.42Å; V1617-R1632 HydrophobicContact CG2-CB 4.45Å; V1617-R1632 HydrophobicContact CG2-CG 3.87Å
1618	V	85.4	Confident	81.4	Confident	76.2 Å²	76.2	74.7 Å²	74.7	46%	0.462	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	120.7	175.3	-176.9	0	0	0	0	109.1	K1620 N1627 Y1628 T1629	V1618-K1620 HydrophobicContact CG1-CG 4.18Å; V1618-N1627 HydrophobicContact CG1-CB 4.09Å; V1618-Y1628 CarbonylContact C-O 3.58Å; V1618-Y1628 WeakPolarHBondContact CA-O 3.34Å; V1618-T1629 HydrophobicContact CG2-CG2 4.45Å
1619	I	82.7	Confident	81.4	Confident	16.8 Å²	16.8	73.2 Å²	73.2	9%	0.086	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	124.8	174.1	-63.1	179.1	0	0	0	107.2	L1129 L1208 F1353 V1617 P1621 N1627 Y1628 L1630	L1129-I1619 HydrophobicContact CD2-CG2 3.3Å; L1208-I1619 HydrophobicContact CD1-CD1 4.15Å; L1208-I1619 HydrophobicContact CD1-CG1 3.99Å; L1208-I1619 HydrophobicContact CD2-CB 4.19Å; L1208-I1619 HydrophobicContact CD2-CD1 4.28Å; L1208-I1619 HydrophobicContact CD2-CG1 3.88Å; L1208-I1619 HydrophobicContact CD2-CG2 3.71Å; F1353-I1619 HydrophobicContact CB-CD1 3.55Å; F1353-I1619 HydrophobicContact CD1-CD1 4.45Å; F1353-I1619 HydrophobicContact CD1-CG2 4.08Å; F1353-I1619 HydrophobicContact CD2-CD1 3.88Å; F1353-I1619 HydrophobicContact CE1-CG2 4.09Å; F1353-I1619 HydrophobicContact CE2-CD1 4.43Å; F1353-I1619 HydrophobicContact CG-CD1 3.75Å; F1353-I1619 HydrophobicContact CG-CG2 4.33Å; F1353-I1619 HydrophobicContact CZ-CG2 4.35Å; V1617-I1619 HydrophobicContact CG1-CG1 4.4Å; V1617-I1619 PolarHBondContact O-N 3.08Å; I1619-P1621 VanDerWaalsContact C-CD 3.44Å; I1619-P1621 HydrophobicContact CG2-CG 4.44Å; I1619-P1621 VanDerWaalsContact O-CD 3.24Å; I1619-P1621 WeakPolarHBondContact O-CD 3.34Å; I1619-N1627 CarbonylContact O-C 3.57Å; I1619-N1627 WeakPolarHBondContact O-CA 3.22Å; I1619-Y1628 WeakPolarHBondContact CB-O 3.36Å; I1619-Y1628 PolarHBondContact N-O 3.22Å; I1619-Y1628 PolarHBondContact O-N 3.13Å; I1619-L1630 HydrophobicContact CD1-CB 3.82Å; I1619-L1630 HydrophobicContact CD1-CD1 3.21Å; I1619-L1630 HydrophobicContact CD1-CD2 3.97Å; I1619-L1630 HydrophobicContact CD1-CG 4.29Å; I1619-L1630 HydrophobicContact CG1-CB 4.37Å; I1619-L1630 HydrophobicContact CG1-CD1 4.14Å; I1619-L1630 HydrophobicContact CG1-CG 4.22Å
1620	K	83.5	Confident	81.4	Confident	145.2 Å²	145.2	73.7 Å²	73.7	63%	0.631	37%	0.372	S	S	*	.			trans	-110.5	86.1	179.3	-56.6	-170.6	178.5	-179.2	0	109	V1618 G1622 N1627	V1618-K1620 HydrophobicContact CG1-CG 4.18Å; K1620-G1622 PolarHBondContact O-N 3.16Å; K1620-N1627 WeakPolarHBondContact CA-OD1 3.38Å; K1620-N1627 WeakPolarHBondContact CB-OD1 3.43Å; K1620-N1627 HydrophobicContact CG-CB 4.49Å; K1620-N1627 VanDerWaalsContact CG-OD1 3.32Å; K1620-N1627 WeakPolarHBondContact CG-OD1 3.24Å
1621	P	76.4	Confident	81.3	Confident	38.6 Å²	38.6	73 Å²	73	25%	0.251	37%	0.368	S	S	.	.			trans	-66.8	-18.3	-177.8	13.8	-13.9	0	0	0	113.4	L1129 L1133 F1353 I1619 W1625 P1626 Y1628	L1129-P1621 HydrophobicContact CB-CB 4.35Å; L1129-P1621 HydrophobicContact CD2-CB 3.96Å; L1129-P1621 HydrophobicContact CD2-CG 4.06Å; L1129-P1621 HydrophobicContact CG-CB 4.12Å; L1129-P1621 HydrophobicContact CG-CG 4.48Å; L1133-P1621 HydrophobicContact CD1-CB 3.83Å; L1133-P1621 HydrophobicContact CD1-CG 3.84Å; F1353-P1621 HydrophobicContact CZ-CB 4.49Å; I1619-P1621 VanDerWaalsContact C-CD 3.44Å; I1619-P1621 HydrophobicContact CG2-CG 4.44Å; I1619-P1621 VanDerWaalsContact O-CD 3.24Å; I1619-P1621 WeakPolarHBondContact O-CD 3.34Å; P1621-W1625 HydrophobicContact CB-CB 3.87Å; P1621-W1625 HydrophobicContact CB-CG 4.36Å; P1621-W1625 HydrophobicContact CG-CB 3.59Å; P1621-W1625 VanDerWaalsContact CG-CB 3.43Å; P1621-W1625 HydrophobicContact CG-CG 4.45Å; P1621-P1626 WeakPolarHBondContact CD-O 3.28Å; P1621-P1626 WeakPolarHBondContact CG-O 3.45Å; P1621-Y1628 HydrophobicContact CG-CD2 3.77Å; P1621-Y1628 HydrophobicContact CG-CE2 3.82Å
1622	G	75.9	Confident	81.4	Confident	35.8 Å²	35.8	69 Å²	69	37%	0.369	34%	0.343	S	S	.	.			trans	90	162.3	-174.9	0	0	0	0	0	112.3	K1620 W1625	K1620-G1622 PolarHBondContact O-N 3.16Å; G1622-W1625 WeakPolarHBondContact O-CA 3.41Å; G1622-W1625 VanDerWaalsContact O-CB 3.31Å; G1622-W1625 WeakPolarHBondContact O-CB 3.34Å; G1622-W1625 PolarHBondContact O-N 2.97Å; G1622-W1625 VanDerWaalsContact O-O 3.09Å
1623	Y	70.4	Confident	81.3	Confident	192.8 Å²	192.8	65.3 Å²	65.3	76%	0.756	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	138.9	179	-179	-90.9	0	0	0	111.2	Y1030 Y1032 W1625	Y1030-Y1623 PolarHBondContact OH-O 3.49Å; Y1030-Y1623 VanDerWaalsContact OH-O 3.13Å; Y1032-Y1623 HydrophobicContact CD1-CD1 4.32Å; Y1032-Y1623 AromaticContact CD2-CD1 3.7Å; Y1032-Y1623 HydrophobicContact CD2-CD1 3.7Å; Y1032-Y1623 AromaticContact CD2-CE1 3.38Å; Y1032-Y1623 HydrophobicContact CD2-CE1 3.73Å; Y1032-Y1623 HydrophobicContact CE1-CD1 4.32Å; Y1032-Y1623 AromaticContact CE2-CD1 3.58Å; Y1032-Y1623 HydrophobicContact CE2-CD1 3.58Å; Y1032-Y1623 AromaticContact CE2-CE1 3.55Å; Y1032-Y1623 HydrophobicContact CE2-CE1 3.55Å; Y1032-Y1623 HydrophobicContact CG-CD1 4.09Å; Y1032-Y1623 HydrophobicContact CG-CE1 4.04Å; Y1032-Y1623 AromaticContact CZ-CD1 3.96Å; Y1623-W1625 VanDerWaalsContact C-N 3.35Å
1624	P	72.9	Confident	81.2	Confident	71.4 Å²	71.4	65.9 Å²	65.9	46%	0.464	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	cis	-88	5.6	6	35	-35.6	0	0	0	115.2	T988 Y1030	T988-P1624 VanDerWaalsContact CG2-CD 3.49Å; T988-P1624 HydrophobicContact CG2-CG 3.12Å; Y1030-P1624 VanDerWaalsContact OH-CD 3.28Å; Y1030-P1624 WeakPolarHBondContact OH-CD 3.36Å
1625	W	77.3	Confident	81.2	Confident	84.6 Å²	84.6	64.9 Å²	64.9	32%	0.32	33%	0.329	S	S	.	.	S	Bend	trans	-80.2	134.5	-175	-57.6	101.7	0	0	0	111.6	T988 Y1030 G1130 L1133 C1134 N1137 P1621 G1622 Y1623 Y1628	T988-W1625 HydrophobicContact CG2-CZ2 4.27Å; Y1030-W1625 PolarHBondContact OH-NE1 3.02Å; G1130-W1625 PolarHBondContact O-NE1 2.94Å; G1130-W1625 VanDerWaalsContact O-NE1 3.14Å; L1133-W1625 VanDerWaalsContact C-CZ2 3.46Å; L1133-W1625 HydrophobicContact CB-CD2 3.74Å; L1133-W1625 VanDerWaalsContact CB-CE2 3.41Å; L1133-W1625 HydrophobicContact CB-CE3 3.96Å; L1133-W1625 HydrophobicContact CB-CG 4.45Å; L1133-W1625 HydrophobicContact CB-CH2 3.75Å; L1133-W1625 HydrophobicContact CB-CZ2 3.54Å; L1133-W1625 VanDerWaalsContact CB-CZ2 3.46Å; L1133-W1625 HydrophobicContact CB-CZ3 3.95Å; L1133-W1625 HydrophobicContact CD1-CB 4.09Å; L1133-W1625 HydrophobicContact CD1-CD2 3.69Å; L1133-W1625 HydrophobicContact CD1-CE3 3.99Å; L1133-W1625 HydrophobicContact CD1-CG 3.71Å; L1133-W1625 HydrophobicContact CG-CD2 4.36Å; L1133-W1625 HydrophobicContact CG-CE3 4.49Å; C1134-W1625 HydrophobicContact CB-CZ2 4.14Å; C1134-W1625 VanDerWaalsContact N-CZ2 3.33Å; C1134-W1625 VanDerWaalsContact SG-CZ2 3.5Å; N1137-W1625 HydrophobicContact CB-CH2 4.44Å; N1137-W1625 VanDerWaalsContact ND2-CH2 3.31Å; N1137-W1625 WeakPolarHBondContact ND2-CH2 3.4Å; N1137-W1625 VanDerWaalsContact ND2-CZ3 3.27Å; N1137-W1625 WeakPolarHBondContact ND2-CZ3 3.31Å; P1621-W1625 HydrophobicContact CB-CB 3.87Å; P1621-W1625 HydrophobicContact CB-CG 4.36Å; P1621-W1625 HydrophobicContact CG-CB 3.59Å; P1621-W1625 VanDerWaalsContact CG-CB 3.43Å; P1621-W1625 HydrophobicContact CG-CG 4.45Å; G1622-W1625 WeakPolarHBondContact O-CA 3.41Å; G1622-W1625 VanDerWaalsContact O-CB 3.31Å; G1622-W1625 WeakPolarHBondContact O-CB 3.34Å; G1622-W1625 PolarHBondContact O-N 2.97Å; G1622-W1625 VanDerWaalsContact O-O 3.09Å; Y1623-W1625 VanDerWaalsContact C-N 3.35Å; W1625-Y1628 HydrophobicContact CB-CE2 4.35Å; W1625-Y1628 HydrophobicContact CE3-CE2 4.36Å
1626	P	81.2	Confident	81.4	Confident	67 Å²	67	64.1 Å²	64.1	44%	0.435	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-67.6	161.1	173.4	29.7	-34.9	0	0	0	111.1	Y1364 H1366 P1621 Y1628	Y1364-P1626 HydrophobicContact CD1-CG 4.36Å; Y1364-P1626 HydrophobicContact CE1-CG 3.99Å; H1366-P1626 VanDerWaalsContact NE2-CB 3.26Å; H1366-P1626 WeakPolarHBondContact NE2-CB 3.26Å; H1366-P1626 WeakPolarHBondContact NE2-CG 3.25Å; P1621-P1626 WeakPolarHBondContact CD-O 3.28Å; P1621-P1626 WeakPolarHBondContact CG-O 3.45Å; P1626-Y1628 HydrophobicContact CG-CE1 4.21Å; P1626-Y1628 HydrophobicContact CG-CE2 4.37Å; P1626-Y1628 VanDerWaalsContact O-CD2 3.26Å; P1626-Y1628 WeakPolarHBondContact O-CD2 3.37Å; P1626-Y1628 VanDerWaalsContact O-CE2 3.23Å; P1626-Y1628 WeakPolarHBondContact O-CE2 3.41Å; P1626-Y1628 PolarHBondContact O-N 3.03Å
1627	N	84.9	Confident	81.7	Confident	89 Å²	89	59.5 Å²	59.5	48%	0.476	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-67.8	130.3	173.1	-65.4	-31.4	0	0	0	110	V1618 I1619 K1620	V1618-N1627 HydrophobicContact CG1-CB 4.09Å; I1619-N1627 CarbonylContact O-C 3.57Å; I1619-N1627 WeakPolarHBondContact O-CA 3.22Å; K1620-N1627 WeakPolarHBondContact CA-OD1 3.38Å; K1620-N1627 WeakPolarHBondContact CB-OD1 3.43Å; K1620-N1627 HydrophobicContact CG-CB 4.49Å; K1620-N1627 VanDerWaalsContact CG-OD1 3.32Å; K1620-N1627 WeakPolarHBondContact CG-OD1 3.24Å
1628	Y	83.1	Confident	82.2	Confident	59.8 Å²	59.8	58.2 Å²	58.2	24%	0.235	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	137.4	179.8	-102.8	-88.2	0	0	0	110.6	L1133 F1353 K1356 Y1364 V1618 I1619 P1621 W1625 P1626 L1630	L1133-Y1628 HydrophobicContact CD1-CE2 3.93Å; F1353-Y1628 AromaticContact CD2-CD1 3.4Å; F1353-Y1628 HydrophobicContact CD2-CD1 3.4Å; F1353-Y1628 HydrophobicContact CD2-CD2 4.42Å; F1353-Y1628 AromaticContact CD2-CE1 3.95Å; F1353-Y1628 HydrophobicContact CD2-CE1 3.95Å; F1353-Y1628 AromaticContact CD2-CG 3.68Å; F1353-Y1628 HydrophobicContact CD2-CG 3.68Å; F1353-Y1628 AromaticContact CE2-CD1 3.82Å; F1353-Y1628 HydrophobicContact CE2-CD1 4.02Å; F1353-Y1628 HydrophobicContact CE2-CD2 4.13Å; F1353-Y1628 AromaticContact CE2-CG 3.68Å; F1353-Y1628 HydrophobicContact CE2-CG 3.68Å; F1353-Y1628 HydrophobicContact CG-CD1 4.45Å; F1353-Y1628 HydrophobicContact CZ-CD1 4.41Å; F1353-Y1628 AromaticContact CZ-CD2 3.94Å; F1353-Y1628 HydrophobicContact CZ-CD2 3.94Å; F1353-Y1628 HydrophobicContact CZ-CE2 4.28Å; F1353-Y1628 AromaticContact CZ-CG 4Å; F1353-Y1628 HydrophobicContact CZ-CG 4.01Å; K1356-Y1628 VanDerWaalsContact CD-OH 3.3Å; K1356-Y1628 WeakPolarHBondContact CD-OH 3.48Å; K1356-Y1628 WeakPolarHBondContact CG-OH 3.21Å; Y1364-Y1628 HydrophobicContact CD1-CD1 4.2Å; Y1364-Y1628 HydrophobicContact CD2-CD1 4.27Å; Y1364-Y1628 HydrophobicContact CD2-CE1 4.4Å; Y1364-Y1628 AromaticContact CG-CD1 3.76Å; Y1364-Y1628 HydrophobicContact CG-CD1 3.92Å; Y1364-Y1628 HydrophobicContact CG-CE1 4.3Å; V1618-Y1628 CarbonylContact C-O 3.58Å; V1618-Y1628 WeakPolarHBondContact CA-O 3.34Å; I1619-Y1628 WeakPolarHBondContact CB-O 3.36Å; I1619-Y1628 PolarHBondContact N-O 3.22Å; I1619-Y1628 PolarHBondContact O-N 3.13Å; P1621-Y1628 HydrophobicContact CG-CD2 3.77Å; P1621-Y1628 HydrophobicContact CG-CE2 3.82Å; W1625-Y1628 HydrophobicContact CB-CE2 4.35Å; W1625-Y1628 HydrophobicContact CE3-CE2 4.36Å; P1626-Y1628 HydrophobicContact CG-CE1 4.21Å; P1626-Y1628 HydrophobicContact CG-CE2 4.37Å; P1626-Y1628 VanDerWaalsContact O-CD2 3.26Å; P1626-Y1628 WeakPolarHBondContact O-CD2 3.37Å; P1626-Y1628 VanDerWaalsContact O-CE2 3.23Å; P1626-Y1628 WeakPolarHBondContact O-CE2 3.41Å; P1626-Y1628 PolarHBondContact O-N 3.03Å; Y1628-L1630 HydrophobicContact CD1-CB 4.11Å; Y1628-L1630 HydrophobicContact CE1-CB 3.98Å; Y1628-L1630 HydrophobicContact CE1-CD1 4.04Å
1629	T	85.9	Confident	82.7	Confident	53.8 Å²	53.8	56.7 Å²	56.7	33%	0.33	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	109.2	173.9	-57.7	0	0	0	0	110	V1367 K1616 V1618 I1631	V1367-T1629 WeakPolarHBondContact CG2-OG1 3.35Å; K1616-T1629 HydrophobicContact CB-CG2 3.75Å; K1616-T1629 HydrophobicContact CD-CG2 4.14Å; K1616-T1629 HydrophobicContact CG-CG2 4.02Å; V1618-T1629 HydrophobicContact CG2-CG2 4.45Å; T1629-I1631 PolarHBondContact O-N 3.07Å
1630	L	83	Confident	83.3	Confident	20.8 Å²	20.8	56 Å²	56	11%	0.109	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	125.8	175.2	-165.2	83	0	0	0	110.6	C1349 K1352 F1353 K1356 K1616 V1617 I1619 Y1628 R1632	C1349-L1630 HydrophobicContact CB-CD2 4.23Å; C1349-L1630 WeakPolarHBondContact O-CD2 3.48Å; K1352-L1630 HydrophobicContact CB-CD1 4.24Å; K1352-L1630 HydrophobicContact CB-CD2 4.19Å; F1353-L1630 HydrophobicContact CB-CD2 4.4Å; K1356-L1630 HydrophobicContact CD-CD1 3.82Å; K1616-L1630 CarbonylContact C-O 3.52Å; K1616-L1630 WeakPolarHBondContact CA-O 3.39Å; V1617-L1630 PolarHBondContact N-O 3.13Å; V1617-L1630 PolarHBondContact O-N 3.07Å; I1619-L1630 HydrophobicContact CD1-CB 3.82Å; I1619-L1630 HydrophobicContact CD1-CD1 3.21Å; I1619-L1630 HydrophobicContact CD1-CD2 3.97Å; I1619-L1630 HydrophobicContact CD1-CG 4.29Å; I1619-L1630 HydrophobicContact CG1-CB 4.37Å; I1619-L1630 HydrophobicContact CG1-CD1 4.14Å; I1619-L1630 HydrophobicContact CG1-CG 4.22Å; Y1628-L1630 HydrophobicContact CD1-CB 4.11Å; Y1628-L1630 HydrophobicContact CE1-CB 3.98Å; Y1628-L1630 HydrophobicContact CE1-CD1 4.04Å; L1630-R1632 HydrophobicContact CD2-CG 4.27Å; L1630-R1632 HydrophobicContact CG-CG 4.34Å
1631	I	83	Confident	83.9	Confident	67.2 Å²	67.2	50.2 Å²	50.2	35%	0.345	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	126.5	170.7	-58.6	173.7	0	0	0	109	Q1614 K1616 T1629 F1633	Q1614-I1631 HydrophobicContact CB-CG2 3.99Å; Q1614-I1631 HydrophobicContact CG-CG2 4.16Å; K1616-I1631 HydrophobicContact CG-CG1 4.38Å; T1629-I1631 PolarHBondContact O-N 3.07Å; I1631-F1633 HydrophobicContact CG2-CD1 4.47Å; I1631-F1633 HydrophobicContact CG2-CE1 4.01Å; I1631-F1633 HydrophobicContact CG2-CZ 4.22Å
1632	R	82.8	Confident	84.8	Confident	46 Å²	46	51.4 Å²	51.4	17%	0.174	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	131.4	177.5	-68.8	-69.1	-81.9	-158.7	-1.7	110.1	S1348 C1349 Q1614 H1615 V1617 L1630 Y1790	S1348-R1632 PolarHBondContact O-NH1 3.4Å; S1348-R1632 PolarHBondContact OG-NH1 3.03Å; S1348-R1632 VanDerWaalsContact OG-NH1 3.07Å; S1348-R1632 PolarHBondContact OG-NH2 3.19Å; C1349-R1632 VanDerWaalsContact SG-CZ 3.54Å; C1349-R1632 PolarHBondContact SG-NE 2.96Å; Q1614-R1632 CarbonylContact C-O 3.49Å; Q1614-R1632 WeakPolarHBondContact CA-O 3.38Å; H1615-R1632 WeakPolarHBondContact CE1-CB 3.47Å; H1615-R1632 PolarHBondContact N-O 2.96Å; H1615-R1632 PolarHBondContact ND1-O 3.42Å; H1615-R1632 VanDerWaalsContact ND1-O 3.12Å; H1615-R1632 VanDerWaalsContact NE2-CB 3.33Å; H1615-R1632 WeakPolarHBondContact NE2-CB 3.38Å; H1615-R1632 PolarHBondContact O-N 3.12Å; V1617-R1632 HydrophobicContact CB-CG 4.42Å; V1617-R1632 HydrophobicContact CG2-CB 4.45Å; V1617-R1632 HydrophobicContact CG2-CG 3.87Å; L1630-R1632 HydrophobicContact CD2-CG 4.27Å; L1630-R1632 HydrophobicContact CG-CG 4.34Å; R1632-Y1790 WeakPolarHBondContact O-CE2 3.45Å; R1632-Y1790 PolarHBondContact O-OH 2.87Å
1633	F	81.4	Confident	85.8	Confident	43 Å²	43	50.4 Å²	50.4	19%	0.189	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	151.7	177.1	-50.4	-67.3	0	0	0	111.5	M1608 A1609 G1613 Q1614 I1631 S1635 K1677 Y1790	M1608-F1633 HydrophobicContact CE-CE1 4.14Å; M1608-F1633 HydrophobicContact CE-CE2 4.32Å; M1608-F1633 HydrophobicContact CE-CZ 3.89Å; M1608-F1633 VanDerWaalsContact CE-CZ 3.47Å; M1608-F1633 HydrophobicContact CG-CE1 4.19Å; M1608-F1633 HydrophobicContact CG-CZ 4.4Å; A1609-F1633 HydrophobicContact CB-CB 4.15Å; A1609-F1633 HydrophobicContact CB-CD1 4.06Å; A1609-F1633 HydrophobicContact CB-CG 4.43Å; G1613-F1633 CarbonylContact O-C 3.49Å; G1613-F1633 WeakPolarHBondContact O-CA 3.45Å; Q1614-F1633 HydrophobicContact CB-CD1 4.43Å; Q1614-F1633 HydrophobicContact CG-CD1 3.68Å; Q1614-F1633 HydrophobicContact CG-CE1 3.75Å; I1631-F1633 HydrophobicContact CG2-CD1 4.47Å; I1631-F1633 HydrophobicContact CG2-CE1 4.01Å; I1631-F1633 HydrophobicContact CG2-CZ 4.22Å; F1633-S1635 WeakPolarHBondContact CB-OG 3.48Å; F1633-K1677 PolarHBondContact O-NZ 3.36Å; F1633-Y1790 PolarHBondContact O-OH 2.91Å
1634	S	80.1	Confident	87	Confident	14.4 Å²	14.4	43.2 Å²	43.2	10%	0.101	23%	0.225	C	C	.	.			trans	-96.9	-8.8	172.2	42.5	0	0	0	0	113.5	G1613 Y1788	G1613-S1634 VanDerWaalsContact CA-OG 3.27Å; G1613-S1634 WeakPolarHBondContact CA-OG 3.32Å; G1613-S1634 WeakPolarHBondContact O-CB 3.21Å; G1613-S1634 PolarHBondContact O-N 3.1Å; G1613-S1634 PolarHBondContact O-OG 3.18Å; G1613-S1634 VanDerWaalsContact O-OG 3.04Å; S1634-Y1788 VanDerWaalsContact OG-CB 3.28Å; S1634-Y1788 WeakPolarHBondContact OG-CB 3.28Å
1635	S	84.8	Confident	88.1	Confident	17 Å²	17	39.9 Å²	39.9	12%	0.119	20%	0.204	C	C	.	.	P	Polyproline II helix	trans	-58.7	135.4	-179.4	3.3	0	0	0	0	111.8	Q1607 A1609 F1633	Q1607-S1635 WeakPolarHBondContact O-CB 3.38Å; Q1607-S1635 PolarHBondContact O-OG 3.14Å; A1609-S1635 WeakPolarHBondContact CB-OG 3.36Å; F1633-S1635 WeakPolarHBondContact CB-OG 3.48Å
1636	P	88.1	Confident	89.1	Confident	24.8 Å²	24.8	39.4 Å²	39.4	16%	0.161	21%	0.208	C	C	.	.	P	Polyproline II helix	trans	-75.7	149.6	178.9	31.8	-35.8	0	0	0	111	K1638 L1693 Y1788	P1636-K1638 PolarHBondContact O-N 3.06Å; P1636-L1693 HydrophobicContact CB-CD2 3.53Å; P1636-L1693 HydrophobicContact CG-CD2 4.14Å; P1636-Y1788 VanDerWaalsContact CD-CZ 3.4Å; P1636-Y1788 HydrophobicContact CG-CD2 4.38Å; P1636-Y1788 HydrophobicContact CG-CE2 3.64Å; P1636-Y1788 WeakPolarHBondContact CG-OH 3.43Å
1637	T	90.1	Very high	89.8	Confident	47.2 Å²	47.2	36.7 Å²	36.7	29%	0.29	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	118	163.9	-50.6	0	0	0	0	109	I1604 F1639	I1604-T1637 HydrophobicContact CG2-CG2 3.35Å; I1604-T1637 VanDerWaalsContact CG2-CG2 3.5Å; T1637-F1639 HydrophobicContact CG2-CD2 4.37Å; T1637-F1639 HydrophobicContact CG2-CE2 4.23Å; T1637-F1639 HydrophobicContact CG2-CZ 4.15Å; T1637-F1639 WeakPolarHBondContact O-CD2 3.42Å; T1637-F1639 WeakPolarHBondContact O-CE2 3.24Å
1638	K	94.1	Very high	90.4	Very high	11 Å²	11	37.8 Å²	37.8	5%	0.048	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	148.9	174.7	-63.5	177.9	174.4	-178.2	0	109.8	A1605 P1636 Y1640 L1693 H1783 H1784	A1605-K1638 PolarHBondContact N-O 3.02Å; A1605-K1638 PolarHBondContact O-N 3.01Å; P1636-K1638 PolarHBondContact O-N 3.06Å; K1638-Y1640 HydrophobicContact CB-CD2 4.38Å; K1638-Y1640 HydrophobicContact CB-CE2 3.73Å; K1638-Y1640 HydrophobicContact CD-CE2 4.32Å; K1638-L1693 WeakPolarHBondContact CA-O 3.4Å; K1638-H1783 VanDerWaalsContact CE-ND1 3.27Å; K1638-H1783 WeakPolarHBondContact CE-ND1 3.29Å; K1638-H1783 PolarHBondContact NZ-CE1 3.11Å; K1638-H1783 PolarHBondContact NZ-ND1 3.02Å; K1638-H1783 VanDerWaalsContact NZ-ND1 3.14Å; K1638-H1783 PolarHBondContact NZ-O 3.29Å; K1638-H1784 PolarHBondContact NZ-ND1 2.85Å
1639	F	95	Very high	91.1	Very high	45.2 Å²	45.2	35.4 Å²	35.4	20%	0.198	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	122.7	-178.4	-59.9	-98.7	0	0	0	108.4	L1602 V1603 I1604 T1637 L1693 Y1694 H1695	L1602-F1639 HydrophobicContact CD1-CB 4.19Å; L1602-F1639 HydrophobicContact CD1-CD1 4.4Å; V1603-F1639 WeakPolarHBondContact O-CA 3.21Å; I1604-F1639 HydrophobicContact CD1-CD1 3.85Å; I1604-F1639 HydrophobicContact CD1-CE1 3.59Å; I1604-F1639 VanDerWaalsContact CD1-CE1 3.4Å; I1604-F1639 HydrophobicContact CD1-CZ 4.32Å; I1604-F1639 HydrophobicContact CG1-CD1 3.9Å; I1604-F1639 HydrophobicContact CG1-CE1 4.12Å; I1604-F1639 HydrophobicContact CG1-CG 4.31Å; T1637-F1639 HydrophobicContact CG2-CD2 4.37Å; T1637-F1639 HydrophobicContact CG2-CE2 4.23Å; T1637-F1639 HydrophobicContact CG2-CZ 4.15Å; T1637-F1639 WeakPolarHBondContact O-CD2 3.42Å; T1637-F1639 WeakPolarHBondContact O-CE2 3.24Å; F1639-L1693 PolarHBondContact N-O 3.12Å; F1639-Y1694 HydrophobicContact CB-CD1 3.93Å; F1639-Y1694 HydrophobicContact CB-CE1 4.2Å; F1639-Y1694 HydrophobicContact CD2-CD1 4.14Å; F1639-Y1694 AromaticContact CD2-CE1 3.67Å; F1639-Y1694 HydrophobicContact CD2-CE1 3.67Å; F1639-Y1694 HydrophobicContact CE2-CE1 4.28Å; F1639-Y1694 HydrophobicContact CG-CD1 4.26Å; F1639-Y1694 AromaticContact CG-CE1 3.99Å; F1639-Y1694 HydrophobicContact CG-CE1 4.03Å; F1639-H1695 PolarHBondContact O-N 3.12Å
1640	Y	96	Very high	91.6	Very high	1.2 Å²	1.2	34.4 Å²	34.4	1%	0.005	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	131.1	174.8	-54.4	-106.9	0	0	0	107.8	M1547 M1550 D1551 W1556 L1602 V1603 A1605 K1638 H1695 H1783 H1784	M1547-Y1640 HydrophobicContact CB-CD1 4.37Å; M1547-Y1640 HydrophobicContact CB-CE1 4.44Å; M1547-Y1640 HydrophobicContact CB-CG 4.44Å; M1547-Y1640 HydrophobicContact CE-CD2 3.88Å; M1547-Y1640 HydrophobicContact CE-CE1 4.28Å; M1547-Y1640 HydrophobicContact CE-CE2 3.44Å; M1547-Y1640 VanDerWaalsContact CE-CE2 3.47Å; M1547-Y1640 HydrophobicContact CE-CG 4.44Å; M1547-Y1640 HydrophobicContact CG-CD1 4.47Å; M1547-Y1640 HydrophobicContact CG-CD2 4.26Å; M1547-Y1640 HydrophobicContact CG-CG 4.23Å; M1550-Y1640 VanDerWaalsContact SD-C 3.55Å; D1551-Y1640 HydrophobicContact CB-CD1 3.8Å; D1551-Y1640 HydrophobicContact CB-CE1 3.96Å; D1551-Y1640 WeakPolarHBondContact OD2-CE1 3.43Å; W1556-Y1640 HydrophobicContact CZ3-CE1 4.23Å; L1602-Y1640 WeakPolarHBondContact CD1-O 3.41Å; V1603-Y1640 PolarHBondContact N-O 3.04Å; V1603-Y1640 PolarHBondContact O-N 3.09Å; A1605-Y1640 HydrophobicContact CB-CD2 4.44Å; A1605-Y1640 HydrophobicContact CB-CE2 4.09Å; K1638-Y1640 HydrophobicContact CB-CD2 4.38Å; K1638-Y1640 HydrophobicContact CB-CE2 3.73Å; K1638-Y1640 HydrophobicContact CD-CE2 4.32Å; Y1640-H1695 CarbonylContact C-O 3.56Å; Y1640-H1695 VanDerWaalsContact CA-O 3.23Å; Y1640-H1695 WeakPolarHBondContact CA-O 3.31Å; Y1640-H1695 HydrophobicContact CD1-CB 3.68Å; Y1640-H1695 HydrophobicContact CE1-CB 4Å; Y1640-H1695 AromaticContact CE1-CD2 3.83Å; Y1640-H1695 AromaticContact CE1-CG 4Å; Y1640-H1695 HydrophobicContact CG-CB 4.36Å; Y1640-H1783 AromaticContact CZ-CE1 3.93Å; Y1640-H1783 PolarHBondContact OH-CE1 3.19Å; Y1640-H1783 VanDerWaalsContact OH-CE1 3.3Å; Y1640-H1783 PolarHBondContact OH-NE2 2.83Å; Y1640-H1784 PolarHBondContact OH-CE1 3.17Å; Y1640-H1784 VanDerWaalsContact OH-CE1 3.25Å; Y1640-H1784 PolarHBondContact OH-NE2 2.92Å
1641	Y	95.3	Very high	92.2	Very high	22.6 Å²	22.6	34.8 Å²	34.8	9%	0.089	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	151.1	-169.2	59.8	-99.3	0	0	0	112.9	K1601 L1643 Y1694 H1695 G1696 H1697 L1698 W1733	K1601-Y1641 WeakPolarHBondContact O-CA 3.41Å; Y1641-L1643 HydrophobicContact CD2-CD1 4.25Å; Y1641-L1643 HydrophobicContact CD2-CG 4.35Å; Y1641-L1643 HydrophobicContact CG-CD1 4.16Å; Y1641-L1643 HydrophobicContact CG-CG 4.45Å; Y1641-Y1694 HydrophobicContact CE1-CD1 4.4Å; Y1641-H1695 VanDerWaalsContact CD1-O 3.27Å; Y1641-H1695 WeakPolarHBondContact CD1-O 3.37Å; Y1641-H1695 WeakPolarHBondContact CE1-O 3.35Å; Y1641-H1695 PolarHBondContact N-O 3.12Å; Y1641-G1696 VanDerWaalsContact CE2-C 3.47Å; Y1641-G1696 VanDerWaalsContact CE2-O 3.3Å; Y1641-G1696 WeakPolarHBondContact CE2-O 3.38Å; Y1641-G1696 CarbonylContact O-C 3.5Å; Y1641-G1696 VanDerWaalsContact O-CA 3.27Å; Y1641-G1696 WeakPolarHBondContact O-CA 3.4Å; Y1641-G1696 PolarHBondContact OH-O 2.99Å; Y1641-H1697 VanDerWaalsContact CD2-O 3.29Å; Y1641-H1697 WeakPolarHBondContact CD2-O 3.25Å; Y1641-H1697 PolarHBondContact O-N 3.05Å; Y1641-H1697 VanDerWaalsContact O-N 3.12Å; Y1641-L1698 HydrophobicContact CD2-CD2 3.41Å; Y1641-L1698 VanDerWaalsContact CD2-CD2 3.41Å; Y1641-L1698 HydrophobicContact CD2-CG 4.02Å; Y1641-L1698 HydrophobicContact CE2-CB 3.97Å; Y1641-L1698 HydrophobicContact CE2-CD1 4.11Å; Y1641-L1698 HydrophobicContact CE2-CD2 3.34Å; Y1641-L1698 HydrophobicContact CE2-CG 3.4Å; Y1641-L1698 VanDerWaalsContact CE2-CG 3.4Å; Y1641-L1698 HydrophobicContact CG-CD2 4.34Å; Y1641-W1733 WeakPolarHBondContact OH-CZ3 3.36Å
1642	D	95.6	Very high	92.8	Very high	64.6 Å²	64.6	34 Å²	34	35%	0.345	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	99.4	166.5	172.7	23	0	0	0	105.5	M1550 G1600 K1601 H1697	M1550-D1642 HydrophobicContact CE-CB 4.26Å; M1550-D1642 HydrophobicContact CG-CB 4.32Å; G1600-D1642 CarbonylContact C-O 3.56Å; G1600-D1642 VanDerWaalsContact CA-O 3.29Å; G1600-D1642 WeakPolarHBondContact CA-O 3.4Å; K1601-D1642 PolarHBondContact N-O 3.08Å; K1601-D1642 PolarHBondContact O-N 3.06Å; K1601-D1642 VanDerWaalsContact O-N 3.1Å; D1642-H1697 WeakPolarHBondContact CA-O 3.09Å; D1642-H1697 IonicContact OD1-ND1 3.69Å; D1642-H1697 PolarHBondContact OD1-ND1 2.85Å
1643	L	95.8	Very high	93.4	Very high	14 Å²	14	33.1 Å²	33.1	7%	0.073	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	138.5	-168.5	-61.9	174.8	0	0	0	111.4	I1572 L1598 W1599 Y1641 H1697 L1698 L1699	I1572-L1643 HydrophobicContact CB-CD2 4.24Å; I1572-L1643 HydrophobicContact CD1-CD1 4.34Å; I1572-L1643 HydrophobicContact CD1-CD2 3.75Å; I1572-L1643 HydrophobicContact CG1-CD2 3.86Å; L1598-L1643 HydrophobicContact CD1-CB 3.95Å; L1598-L1643 HydrophobicContact CD1-CD1 4.29Å; L1598-L1643 HydrophobicContact CD2-CD1 4.38Å; L1598-L1643 HydrophobicContact CD2-CD2 4.1Å; L1598-L1643 HydrophobicContact CG-CD1 4.38Å; W1599-L1643 WeakPolarHBondContact O-CA 3.41Å; W1599-L1643 WeakPolarHBondContact O-CD2 3.32Å; Y1641-L1643 HydrophobicContact CD2-CD1 4.25Å; Y1641-L1643 HydrophobicContact CD2-CG 4.35Å; Y1641-L1643 HydrophobicContact CG-CD1 4.16Å; Y1641-L1643 HydrophobicContact CG-CG 4.45Å; L1643-H1697 PolarHBondContact N-O 3.17Å; L1643-H1697 VanDerWaalsContact N-O 3.08Å; L1643-L1698 HydrophobicContact CB-CD1 3.76Å; L1643-L1698 HydrophobicContact CB-CD2 3.77Å; L1643-L1698 HydrophobicContact CD1-CD2 3.96Å; L1643-L1698 HydrophobicContact CG-CD2 4.26Å; L1643-L1698 WeakPolarHBondContact O-CA 3.34Å; L1643-L1699 PolarHBondContact O-N 3.23Å
1644	N	96.7	Very high	93.8	Very high	43 Å²	43	34.3 Å²	34.3	23%	0.23	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	143.2	172.1	-59.5	-79.1	0	0	0	108.5	L1598 W1599 L1699	L1598-N1644 CarbonylContact C-O 3.49Å; L1598-N1644 WeakPolarHBondContact CA-O 3.39Å; W1599-N1644 HydrophobicContact CD2-CB 4.14Å; W1599-N1644 HydrophobicContact CH2-CB 4.02Å; W1599-N1644 HydrophobicContact CZ2-CB 3.52Å; W1599-N1644 VanDerWaalsContact CZ2-CB 3.48Å; W1599-N1644 PolarHBondContact N-O 3.21Å; W1599-N1644 PolarHBondContact O-N 3.14Å; N1644-L1699 CarbonylContact C-O 3.53Å; N1644-L1699 VanDerWaalsContact CA-O 3.25Å; N1644-L1699 WeakPolarHBondContact CA-O 3.35Å; N1644-L1699 HydrophobicContact CB-CB 4.45Å; N1644-L1699 VanDerWaalsContact OD1-CB 3.29Å; N1644-L1699 WeakPolarHBondContact OD1-CB 3.41Å; N1644-L1699 VanDerWaalsContact OD1-CD2 3.28Å; N1644-L1699 WeakPolarHBondContact OD1-CD2 3.39Å
1645	A	96.7	Very high	94.3	Very high	1.8 Å²	1.8	33.6 Å²	33.6	2%	0.015	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	132	179.8	0	0	0	0	0	111.9	L1596 F1597 L1598 L1647 L1699 F1700 A1701	L1596-A1645 HydrophobicContact CD1-CB 4.08Å; F1597-A1645 CarbonylContact O-C 3.55Å; F1597-A1645 VanDerWaalsContact O-CA 3.24Å; F1597-A1645 WeakPolarHBondContact O-CA 3.39Å; F1597-A1645 WeakPolarHBondContact O-CB 3.42Å; L1598-A1645 HydrophobicContact CB-CB 4.22Å; L1598-A1645 HydrophobicContact CD1-CB 3.86Å; L1598-A1645 HydrophobicContact CG-CB 4.28Å; A1645-L1647 HydrophobicContact CB-CD1 3.88Å; A1645-L1647 WeakPolarHBondContact O-CD1 3.41Å; A1645-L1699 PolarHBondContact N-O 3.1Å; A1645-F1700 HydrophobicContact CB-CB 3.91Å; A1645-F1700 HydrophobicContact CB-CD1 3.81Å; A1645-F1700 HydrophobicContact CB-CE1 4.35Å; A1645-F1700 CarbonylContact O-C 3.56Å; A1645-F1700 VanDerWaalsContact O-CA 3.29Å; A1645-F1700 WeakPolarHBondContact O-CA 3.42Å; A1645-F1700 WeakPolarHBondContact O-CB 3.39Å; A1645-A1701 PolarHBondContact O-N 3.15Å
1646	D	97.5	Very high	94.5	Very high	74.8 Å²	74.8	33.5 Å²	33.5	40%	0.4	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	134.7	169.6	-63.3	-29.1	0	0	0	108.9	L1596 F1597 W1599 A1701	L1596-D1646 CarbonylContact C-O 3.59Å; L1596-D1646 WeakPolarHBondContact CA-O 3.26Å; F1597-D1646 PolarHBondContact N-O 2.91Å; F1597-D1646 PolarHBondContact O-N 3.16Å; W1599-D1646 HydrophobicContact CH2-CB 4.43Å; W1599-D1646 VanDerWaalsContact CH2-CG 3.44Å; W1599-D1646 WeakPolarHBondContact CH2-OD1 3.31Å; W1599-D1646 WeakPolarHBondContact CH2-OD2 3.4Å; W1599-D1646 HydrophobicContact CZ3-CB 4.22Å; W1599-D1646 VanDerWaalsContact CZ3-OD2 3.32Å; W1599-D1646 WeakPolarHBondContact CZ3-OD2 3.41Å; D1646-A1701 CarbonylContact C-O 3.49Å; D1646-A1701 WeakPolarHBondContact CA-O 3.32Å
1647	L	96.5	Very high	94.5	Very high	9.4 Å²	9.4	32.9 Å²	32.9	5%	0.049	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	142.9	-177.3	-51.9	92.4	0	0	0	110.7	I1593 L1596 A1645 F1650 F1700 A1701 V1702 D1703	I1593-L1647 HydrophobicContact CG2-CD2 3.57Å; I1593-L1647 VanDerWaalsContact CG2-CD2 3.42Å; L1596-L1647 HydrophobicContact CB-CD2 4.38Å; L1596-L1647 HydrophobicContact CD1-CD1 4.24Å; L1596-L1647 HydrophobicContact CD1-CD2 3.72Å; L1596-L1647 HydrophobicContact CD1-CG 3.69Å; L1596-L1647 HydrophobicContact CG-CD2 4.4Å; A1645-L1647 HydrophobicContact CB-CD1 3.88Å; A1645-L1647 WeakPolarHBondContact O-CD1 3.41Å; L1647-F1650 HydrophobicContact CD2-CD2 4.14Å; L1647-F1700 HydrophobicContact CD1-CB 3.97Å; L1647-F1700 HydrophobicContact CD1-CD1 3.88Å; L1647-F1700 HydrophobicContact CD1-CD2 4.05Å; L1647-F1700 HydrophobicContact CD1-CG 4.39Å; L1647-A1701 PolarHBondContact N-O 3.18Å; L1647-V1702 HydrophobicContact CB-CB 4.49Å; L1647-V1702 HydrophobicContact CB-CG1 4.19Å; L1647-V1702 HydrophobicContact CB-CG2 4.26Å; L1647-V1702 HydrophobicContact CD1-CG2 3.96Å; L1647-V1702 VanDerWaalsContact O-CA 3.28Å; L1647-V1702 WeakPolarHBondContact O-CA 3.3Å; L1647-D1703 PolarHBondContact O-N 3.15Å; L1647-D1703 VanDerWaalsContact O-N 3.12Å
1648	K	97.4	Very high	94.6	Very high	111.2 Å²	111.2	30.9 Å²	30.9	48%	0.483	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	-46.8	173.3	-179.4	179	-178	175.2	0	112.7	T1594 D1595 D1703 T1704	T1594-K1648 PolarHBondContact O-N 3.06Å; T1594-K1648 VanDerWaalsContact O-N 3.1Å; D1595-K1648 HydrophobicContact CB-CB 3.85Å; D1595-K1648 HydrophobicContact CB-CD 4.06Å; D1595-K1648 WeakPolarHBondContact OD2-CD 3.37Å; D1595-K1648 IonicContact OD2-NZ 2.74Å; D1595-K1648 PolarHBondContact OD2-NZ 2.84Å; K1648-D1703 WeakPolarHBondContact O-CB 3.44Å; K1648-T1704 PolarHBondContact O-N 3.03Å; K1648-T1704 VanDerWaalsContact O-N 3.14Å; K1648-T1704 PolarHBondContact O-OG1 2.93Å; K1648-T1704 VanDerWaalsContact O-OG1 3.08Å
1649	S	96.7	Very high	94.3	Very high	11.4 Å²	11.4	32.7 Å²	32.7	8%	0.08	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	141.2	178.3	78.6	0	0	0	0	112.1	I1593 T1594 H1651 T1704	I1593-S1649 VanDerWaalsContact CA-O 3.29Å; I1593-S1649 WeakPolarHBondContact CA-O 3.28Å; T1594-S1649 WeakPolarHBondContact CG2-OG 3.38Å; T1594-S1649 PolarHBondContact N-O 2.92Å; T1594-S1649 PolarHBondContact O-N 3.15Å; T1594-S1649 WeakPolarHBondContact OG1-CB 3.23Å; T1594-S1649 PolarHBondContact OG1-N 3.3Å; T1594-S1649 PolarHBondContact OG1-OG 3.16Å; S1649-H1651 WeakPolarHBondContact CB-NE2 3.27Å; S1649-T1704 CarbonylContact C-O 3.58Å; S1649-T1704 VanDerWaalsContact CA-O 3.28Å; S1649-T1704 WeakPolarHBondContact CA-O 3.3Å; S1649-T1704 WeakPolarHBondContact CB-OG1 3.22Å
1650	F	96.8	Very high	94.1	Very high	31 Å²	31	32.8 Å²	32.8	14%	0.136	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	106.3	176.1	-172.7	-76.6	0	0	0	109.6	L1591 I1593 L1647 I1652 V1702 T1704 M1705 H1706	L1591-F1650 HydrophobicContact CD1-CE1 4.24Å; L1591-F1650 HydrophobicContact CD1-CE2 4.31Å; L1591-F1650 HydrophobicContact CD1-CZ 3.92Å; I1593-F1650 HydrophobicContact CD1-CD2 3.71Å; I1593-F1650 HydrophobicContact CD1-CE2 3.58Å; I1593-F1650 VanDerWaalsContact CD1-CE2 3.48Å; I1593-F1650 HydrophobicContact CD1-CZ 4.26Å; I1593-F1650 HydrophobicContact CG1-CD2 3.63Å; I1593-F1650 HydrophobicContact CG1-CE2 3.97Å; I1593-F1650 HydrophobicContact CG1-CG 4.28Å; L1647-F1650 HydrophobicContact CD2-CD2 4.14Å; F1650-I1652 HydrophobicContact CD1-CD1 4.48Å; F1650-I1652 HydrophobicContact CD1-CG1 4.27Å; F1650-I1652 HydrophobicContact CE1-CD1 3.45Å; F1650-I1652 VanDerWaalsContact CE1-CD1 3.41Å; F1650-I1652 HydrophobicContact CE1-CG1 3.58Å; F1650-I1652 VanDerWaalsContact CE1-CG1 3.5Å; F1650-I1652 HydrophobicContact CZ-CD1 3.9Å; F1650-I1652 HydrophobicContact CZ-CG1 4.24Å; F1650-V1702 HydrophobicContact CB-CG1 3.94Å; F1650-T1704 PolarHBondContact N-O 2.94Å; F1650-M1705 HydrophobicContact CB-CB 4.32Å; F1650-M1705 HydrophobicContact CB-CG 4.24Å; F1650-M1705 HydrophobicContact CD1-CE 4.21Å; F1650-M1705 HydrophobicContact CD1-CG 3.94Å; F1650-M1705 HydrophobicContact CD1-SD 4.28Å; F1650-M1705 HydrophobicContact CE1-CE 4.19Å; F1650-M1705 HydrophobicContact CG-CG 4.37Å; F1650-M1705 CarbonylContact O-C 3.55Å; F1650-M1705 VanDerWaalsContact O-CA 3.25Å; F1650-M1705 WeakPolarHBondContact O-CA 3.38Å; F1650-H1706 PolarHBondContact O-N 3.03Å
1651	H	96.3	Very high	93.9	Very high	30.6 Å²	30.6	33.1 Å²	33.1	14%	0.142	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	127.3	-179	-58.4	-86.5	0	0	0	111.4	L1591 N1592 S1649 Y1653 H1706	L1591-H1651 CarbonylContact C-O 3.52Å; L1591-H1651 WeakPolarHBondContact CA-O 3.27Å; N1592-H1651 HydrophobicContact CB-CB 4.47Å; N1592-H1651 PolarHBondContact N-O 3.08Å; N1592-H1651 PolarHBondContact O-N 2.95Å; S1649-H1651 WeakPolarHBondContact CB-NE2 3.27Å; H1651-Y1653 HydrophobicContact CB-CD2 4.45Å; H1651-Y1653 HydrophobicContact CB-CE2 3.78Å; H1651-H1706 WeakPolarHBondContact CA-O 3.35Å; H1651-H1706 AromaticContact CE1-CD2 3.59Å; H1651-H1706 PolarHBondContact CE1-CD2 3.2Å; H1651-H1706 AromaticContact CE1-CE1 3.79Å; H1651-H1706 AromaticContact CE1-CG 3.6Å; H1651-H1706 AromaticContact CE1-ND1 3.65Å; H1651-H1706 PolarHBondContact CE1-ND1 3.16Å; H1651-H1706 AromaticContact CE1-NE2 3.82Å; H1651-H1706 VanDerWaalsContact ND1-CB 3.34Å; H1651-H1706 WeakPolarHBondContact ND1-CB 3.37Å; H1651-H1706 AromaticContact ND1-CD2 3.75Å; H1651-H1706 PolarHBondContact ND1-CD2 3.39Å; H1651-H1706 VanDerWaalsContact ND1-CD2 3.34Å; H1651-H1706 AromaticContact ND1-CG 3.35Å; H1651-H1706 AromaticContact ND1-ND1 3.59Å; H1651-H1706 PolarHBondContact ND1-ND1 2.95Å
1652	I	95.5	Very high	93.7	Very high	48.8 Å²	48.8	33.2 Å²	33.2	25%	0.25	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	130	168.8	-68.6	-179.8	0	0	0	109.4	C1590 L1591 F1650 H1706 S1708	C1590-I1652 WeakPolarHBondContact O-CA 3.36Å; L1591-I1652 HydrophobicContact CD1-CD1 4.29Å; L1591-I1652 HydrophobicContact CD1-CG1 3.69Å; F1650-I1652 HydrophobicContact CD1-CD1 4.48Å; F1650-I1652 HydrophobicContact CD1-CG1 4.27Å; F1650-I1652 HydrophobicContact CE1-CD1 3.45Å; F1650-I1652 VanDerWaalsContact CE1-CD1 3.41Å; F1650-I1652 HydrophobicContact CE1-CG1 3.58Å; F1650-I1652 VanDerWaalsContact CE1-CG1 3.5Å; F1650-I1652 HydrophobicContact CZ-CD1 3.9Å; F1650-I1652 HydrophobicContact CZ-CG1 4.24Å; I1652-H1706 PolarHBondContact N-O 3.1Å; I1652-S1708 PolarHBondContact O-N 3.36Å
1653	Y	93.9	Very high	93.4	Very high	28.6 Å²	28.6	30.8 Å²	30.8	11%	0.112	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	134.1	170.9	-61	-94.8	0	0	0	109.2	K1588 P1589 C1590 H1651 W1658 S1708 F1721	K1588-Y1653 HydrophobicContact CB-CD1 4.02Å; K1588-Y1653 HydrophobicContact CB-CD2 4.33Å; K1588-Y1653 HydrophobicContact CB-CE1 4.42Å; K1588-Y1653 HydrophobicContact CB-CG 3.96Å; K1588-Y1653 HydrophobicContact CD-CD1 4.36Å; K1588-Y1653 HydrophobicContact CD-CE1 3.94Å; K1588-Y1653 HydrophobicContact CD-CE2 4.43Å; K1588-Y1653 HydrophobicContact CG-CD1 4.12Å; K1588-Y1653 HydrophobicContact CG-CE1 4.2Å; K1588-Y1653 HydrophobicContact CG-CG 4.41Å; P1589-Y1653 WeakPolarHBondContact O-CB 3.33Å; P1589-Y1653 WeakPolarHBondContact O-CD2 3.33Å; C1590-Y1653 PolarHBondContact O-N 3.12Å; C1590-Y1653 VanDerWaalsContact O-N 3.12Å; C1590-Y1653 PolarHBondContact SG-O 2.74Å; H1651-Y1653 HydrophobicContact CB-CD2 4.45Å; H1651-Y1653 HydrophobicContact CB-CE2 3.78Å; Y1653-W1658 WeakPolarHBondContact O-CZ3 3.31Å; Y1653-S1708 WeakPolarHBondContact CA-O 3.33Å; Y1653-S1708 VanDerWaalsContact CD1-CB 3.47Å; Y1653-F1721 HydrophobicContact CD1-CD1 4.28Å; Y1653-F1721 AromaticContact CD1-CE1 3.83Å; Y1653-F1721 HydrophobicContact CD1-CE1 3.98Å; Y1653-F1721 HydrophobicContact CD1-CZ 4.25Å
1654	Y	91.6	Very high	93.2	Very high	68 Å²	68	30.9 Å²	30.9	27%	0.267	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	157.3	176.9	-174.8	-101.3	0	0	0	111.4	W1658 E1659 V1662 S1708 Y1709 S1710	Y1654-W1658 HydrophobicContact CD2-CE3 4.39Å; Y1654-E1659 PolarHBondContact OH-OE1 2.83Å; Y1654-E1659 PolarHBondContact OH-OE2 2.91Å; Y1654-V1662 HydrophobicContact CE2-CG2 4.33Å; Y1654-S1708 PolarHBondContact N-O 3.07Å; Y1654-S1708 VanDerWaalsContact N-O 3.1Å; Y1654-Y1709 HydrophobicContact CD1-CD2 4.42Å; Y1654-Y1709 HydrophobicContact CD1-CE2 4.37Å; Y1654-Y1709 CarbonylContact O-C 3.52Å; Y1654-Y1709 VanDerWaalsContact O-CA 3.24Å; Y1654-Y1709 WeakPolarHBondContact O-CA 3.3Å; Y1654-S1710 PolarHBondContact O-N 3.15Å
1655	G	90.2	Very high	93	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.15	C	C	.	.			trans	-170.2	167.2	172.8	0	0	0	0	0	112.6	N1657 W1658	G1655-N1657 VanDerWaalsContact C-OD1 3.3Å; G1655-N1657 WeakPolarHBondContact CA-OD1 3.28Å; G1655-N1657 PolarHBondContact O-N 3.05Å; G1655-N1657 PolarHBondContact O-OD1 3.02Å; G1655-W1658 PolarHBondContact O-N 3.2Å; G1655-W1658 VanDerWaalsContact O-N 3.07Å
1656	A	88.7	Confident	92.6	Very high	14.8 Å²	14.8	32.6 Å²	32.6	12%	0.122	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-26.6	176.7	0	0	0	0	0	113	W1658 E1659 Y1709 C1853 Q1856	A1656-W1658 VanDerWaalsContact C-N 3.27Å; A1656-W1658 PolarHBondContact O-N 3.23Å; A1656-E1659 WeakPolarHBondContact O-CB 3.43Å; A1656-E1659 PolarHBondContact O-N 3.12Å; A1656-Y1709 PolarHBondContact N-OH 2.98Å; A1656-C1853 VanDerWaalsContact CB-O 3.28Å; A1656-C1853 WeakPolarHBondContact CB-O 3.32Å; A1656-Q1856 HydrophobicContact CB-CB 4.35Å
1657	N	88.4	Confident	92.2	Very high	12.4 Å²	12.4	29.5 Å²	29.5	7%	0.066	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-24	173.2	57.8	-8.5	0	0	0	114.1	G1655 S1710 S1712 L1713 S1714 P1715	G1655-N1657 VanDerWaalsContact C-OD1 3.3Å; G1655-N1657 WeakPolarHBondContact CA-OD1 3.28Å; G1655-N1657 PolarHBondContact O-N 3.05Å; G1655-N1657 PolarHBondContact O-OD1 3.02Å; N1657-S1710 WeakPolarHBondContact ND2-CB 3.06Å; N1657-S1710 PolarHBondContact ND2-OG 3.19Å; N1657-S1712 WeakPolarHBondContact CB-O 3.26Å; N1657-S1712 PolarHBondContact ND2-O 3.08Å; N1657-S1712 VanDerWaalsContact ND2-O 3.11Å; N1657-L1713 VanDerWaalsContact CB-O 3.27Å; N1657-L1713 WeakPolarHBondContact CB-O 3.44Å; N1657-S1714 PolarHBondContact ND2-O 3.22Å; N1657-S1714 VanDerWaalsContact ND2-O 3.07Å; N1657-P1715 HydrophobicContact CB-CB 4.44Å; N1657-P1715 WeakPolarHBondContact ND2-CA 3.38Å
1658	W	90.9	Very high	91.9	Very high	3.6 Å²	3.6	29.8 Å²	29.8	1%	0.014	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-15.7	-178.3	-66.7	7	0	0	0	113.5	L1583 Y1586 K1588 C1590 Y1653 Y1654 G1655 A1656 P1660 T1661 V1662 P1715	L1583-W1658 HydrophobicContact CD1-CE3 4.34Å; Y1586-W1658 AromaticContact CD2-CD1 3.83Å; Y1586-W1658 HydrophobicContact CD2-CD2 4.2Å; Y1586-W1658 AromaticContact CD2-CE2 3.88Å; Y1586-W1658 HydrophobicContact CD2-CG 4.26Å; Y1586-W1658 HydrophobicContact CD2-CZ2 4.4Å; Y1586-W1658 AromaticContact CD2-NE1 3.77Å; Y1586-W1658 AromaticContact CE2-CD1 3.87Å; Y1586-W1658 HydrophobicContact CE2-CD2 4.42Å; Y1586-W1658 HydrophobicContact CE2-CG 4.15Å; K1588-W1658 HydrophobicContact CB-CH2 4.25Å; K1588-W1658 HydrophobicContact CB-CZ2 4.34Å; K1588-W1658 WeakPolarHBondContact O-CH2 3.45Å; K1588-W1658 WeakPolarHBondContact O-CZ2 3.46Å; C1590-W1658 HydrophobicContact CB-CE3 4.46Å; C1590-W1658 HydrophobicContact CB-CZ3 3.92Å; C1590-W1658 WeakPolarHBondContact SG-CZ3 3.3Å; Y1653-W1658 WeakPolarHBondContact O-CZ3 3.31Å; Y1654-W1658 HydrophobicContact CD2-CE3 4.39Å; G1655-W1658 PolarHBondContact O-N 3.2Å; G1655-W1658 VanDerWaalsContact O-N 3.07Å; A1656-W1658 VanDerWaalsContact C-N 3.27Å; A1656-W1658 PolarHBondContact O-N 3.23Å; W1658-P1660 VanDerWaalsContact C-CD 3.44Å; W1658-P1660 VanDerWaalsContact C-N 3.33Å; W1658-P1660 VanDerWaalsContact O-N 3.16Å; W1658-T1661 WeakPolarHBondContact O-CB 3.31Å; W1658-T1661 PolarHBondContact O-N 3Å; W1658-T1661 VanDerWaalsContact O-N 3.09Å; W1658-V1662 WeakPolarHBondContact O-CG2 3.29Å; W1658-V1662 PolarHBondContact O-N 3.16Å; W1658-V1662 VanDerWaalsContact O-N 3.08Å; W1658-P1715 PolarHBondContact NE1-O 3.15Å
1659	E	89.6	Confident	91.5	Very high	49 Å²	49	25.6 Å²	25.6	23%	0.229	13%	0.129	C	C	.	.	H	α-helix	trans	-52.2	-39.4	179.3	-140.9	19.8	-166.3	0	0	114.3	Y1654 A1656 T1661 V1662 S1663 P1858	Y1654-E1659 PolarHBondContact OH-OE1 2.83Å; Y1654-E1659 PolarHBondContact OH-OE2 2.91Å; A1656-E1659 WeakPolarHBondContact O-CB 3.43Å; A1656-E1659 PolarHBondContact O-N 3.12Å; E1659-T1661 VanDerWaalsContact C-N 3.34Å; E1659-T1661 PolarHBondContact O-N 2.96Å; E1659-V1662 PolarHBondContact O-N 3Å; E1659-S1663 VanDerWaalsContact O-CB 3.27Å; E1659-S1663 WeakPolarHBondContact O-CB 3.41Å; E1659-S1663 PolarHBondContact O-N 2.97Å; E1659-P1858 HydrophobicContact CB-CB 4.17Å; E1659-P1858 HydrophobicContact CB-CG 4.22Å; E1659-P1858 HydrophobicContact CG-CB 3.5Å; E1659-P1858 HydrophobicContact CG-CG 3.88Å
1660	P	90	Very high	91	Very high	48 Å²	48	27.7 Å²	27.7	31%	0.312	14%	0.14	S	C	.	.	H	α-helix	trans	-56	-48.9	173	-28.6	38.3	0	0	0	113.2	W1658 V1662 S1663 W1664 I1861	W1658-P1660 VanDerWaalsContact C-CD 3.44Å; W1658-P1660 VanDerWaalsContact C-N 3.33Å; W1658-P1660 VanDerWaalsContact O-N 3.16Å; P1660-V1662 PolarHBondContact O-N 3.22Å; P1660-S1663 WeakPolarHBondContact O-CB 3.45Å; P1660-S1663 PolarHBondContact O-N 3Å; P1660-W1664 PolarHBondContact O-N 3.07Å; P1660-I1861 HydrophobicContact CB-CD1 3.87Å; P1660-I1861 HydrophobicContact CB-CG1 3.98Å; P1660-I1861 HydrophobicContact CG-CD1 4.24Å; P1660-I1861 WeakPolarHBondContact O-CD1 3.44Å
1661	T	91.4	Very high	90.5	Very high	7 Å²	7	28.7 Å²	28.7	4%	0.043	15%	0.146	C	C	.	.	H	α-helix	trans	-69.6	-40.1	-177.8	-51.4	0	0	0	0	111.1	L1519 L1583 R1584 Y1586 W1658 E1659 S1663 W1664 F1665	L1519-T1661 HydrophobicContact CD1-CG2 3.76Å; L1583-T1661 HydrophobicContact CB-CG2 4.33Å; L1583-T1661 HydrophobicContact CD2-CG2 4.35Å; R1584-T1661 HydrophobicContact CG-CG2 4.12Å; Y1586-T1661 HydrophobicContact CE2-CG2 4.34Å; Y1586-T1661 PolarHBondContact OH-OG1 2.86Å; W1658-T1661 WeakPolarHBondContact O-CB 3.31Å; W1658-T1661 PolarHBondContact O-N 3Å; W1658-T1661 VanDerWaalsContact O-N 3.09Å; E1659-T1661 VanDerWaalsContact C-N 3.34Å; E1659-T1661 PolarHBondContact O-N 2.96Å; T1661-S1663 VanDerWaalsContact C-N 3.33Å; T1661-S1663 PolarHBondContact O-N 3.08Å; T1661-W1664 WeakPolarHBondContact O-CB 3.46Å; T1661-W1664 PolarHBondContact O-N 3.04Å; T1661-W1664 VanDerWaalsContact O-N 3.12Å; T1661-F1665 WeakPolarHBondContact O-CB 3.38Å; T1661-F1665 PolarHBondContact O-N 3.07Å
1662	V	91.1	Very high	90.2	Very high	24.4 Å²	24.4	29.1 Å²	29.1	15%	0.148	15%	0.149	C	C	.	.	H	α-helix	trans	-64.5	-40.2	173.6	178.2	0	0	0	0	111.4	L1583 Y1654 W1658 E1659 P1660 W1664 F1665 N1666	L1583-V1662 HydrophobicContact CD1-CG2 3.62Å; L1583-V1662 HydrophobicContact CD2-CG2 4.47Å; Y1654-V1662 HydrophobicContact CE2-CG2 4.33Å; W1658-V1662 WeakPolarHBondContact O-CG2 3.29Å; W1658-V1662 PolarHBondContact O-N 3.16Å; W1658-V1662 VanDerWaalsContact O-N 3.08Å; E1659-V1662 PolarHBondContact O-N 3Å; P1660-V1662 PolarHBondContact O-N 3.22Å; V1662-W1664 VanDerWaalsContact C-N 3.31Å; V1662-W1664 PolarHBondContact O-N 3.01Å; V1662-F1665 HydrophobicContact CG1-CD1 4.03Å; V1662-F1665 PolarHBondContact O-N 3.08Å; V1662-N1666 WeakPolarHBondContact CG1-ND2 3.46Å; V1662-N1666 WeakPolarHBondContact O-CB 3.38Å; V1662-N1666 VanDerWaalsContact O-CG 3.22Å; V1662-N1666 PolarHBondContact O-N 3.09Å; V1662-N1666 PolarHBondContact O-ND2 3.14Å
1663	S	89.5	Confident	89.6	Confident	14.6 Å²	14.6	31.3 Å²	31.3	10%	0.102	16%	0.157	C	C	.	.	H	α-helix	trans	-63.2	-34.6	174.2	174.1	0	0	0	0	111.7	E1659 P1660 T1661 Q1667 R1863	E1659-S1663 VanDerWaalsContact O-CB 3.27Å; E1659-S1663 WeakPolarHBondContact O-CB 3.41Å; E1659-S1663 PolarHBondContact O-N 2.97Å; P1660-S1663 WeakPolarHBondContact O-CB 3.45Å; P1660-S1663 PolarHBondContact O-N 3Å; T1661-S1663 VanDerWaalsContact C-N 3.33Å; T1661-S1663 PolarHBondContact O-N 3.08Å; S1663-Q1667 WeakPolarHBondContact O-CG 3.38Å; S1663-Q1667 PolarHBondContact O-N 3.11Å; S1663-Q1667 PolarHBondContact O-NE2 3.05Å; S1663-Q1667 VanDerWaalsContact O-NE2 3.16Å; S1663-R1863 PolarHBondContact OG-NH2 3.28Å; S1663-R1863 VanDerWaalsContact OG-NH2 3.09Å
1664	W	91.7	Very high	89	Confident	17.2 Å²	17.2	32.8 Å²	32.8	7%	0.065	17%	0.17	C	C	.	.	H	α-helix	trans	-73.5	-46.6	176.2	179.1	-137.6	0	0	0	112.2	Y1336 D1440 D1441 L1519 P1660 T1661 V1662 N1666 Q1667 R1668 I1861 R1862	Y1336-W1664 HydrophobicContact CD2-CZ2 4.46Å; Y1336-W1664 AromaticContact CE2-CH2 3.91Å; Y1336-W1664 HydrophobicContact CE2-CH2 4.05Å; Y1336-W1664 AromaticContact CE2-CZ2 3.76Å; Y1336-W1664 HydrophobicContact CE2-CZ2 3.76Å; D1440-W1664 PolarHBondContact OD1-NE1 3.15Å; D1441-W1664 HydrophobicContact CB-CZ2 4.33Å; L1519-W1664 VanDerWaalsContact CD1-CD1 3.48Å; L1519-W1664 HydrophobicContact CD1-CG 4.39Å; L1519-W1664 HydrophobicContact CD2-CG 4.2Å; P1660-W1664 PolarHBondContact O-N 3.07Å; T1661-W1664 WeakPolarHBondContact O-CB 3.46Å; T1661-W1664 PolarHBondContact O-N 3.04Å; T1661-W1664 VanDerWaalsContact O-N 3.12Å; V1662-W1664 VanDerWaalsContact C-N 3.31Å; V1662-W1664 PolarHBondContact O-N 3.01Å; W1664-N1666 VanDerWaalsContact C-N 3.28Å; W1664-N1666 PolarHBondContact O-N 2.93Å; W1664-Q1667 HydrophobicContact CE3-CB 3.93Å; W1664-Q1667 HydrophobicContact CE3-CG 4.3Å; W1664-Q1667 HydrophobicContact CZ3-CB 4.09Å; W1664-Q1667 WeakPolarHBondContact O-CA 3.39Å; W1664-Q1667 WeakPolarHBondContact O-CB 3.28Å; W1664-Q1667 PolarHBondContact O-N 3Å; W1664-R1668 HydrophobicContact CD2-CG 4.33Å; W1664-R1668 HydrophobicContact CE3-CG 4.46Å; W1664-R1668 HydrophobicContact CH2-CG 4.31Å; W1664-R1668 VanDerWaalsContact CZ2-CD 3.45Å; W1664-R1668 HydrophobicContact CZ2-CG 4.08Å; W1664-R1668 HydrophobicContact CZ3-CG 4.42Å; W1664-R1668 PolarHBondContact O-N 3.16Å; W1664-I1861 HydrophobicContact CB-CG2 4.29Å; W1664-R1862 HydrophobicContact CE3-CB 4.48Å; W1664-R1862 VanDerWaalsContact CH2-CD 3.49Å; W1664-R1862 HydrophobicContact CZ3-CB 4.31Å; W1664-R1862 VanDerWaalsContact CZ3-CD 3.41Å; W1664-R1862 HydrophobicContact CZ3-CG 4.42Å
1665	F	92.3	Very high	88.2	Confident	24.8 Å²	24.8	35.3 Å²	35.3	11%	0.109	19%	0.188	C	C	.	.	H	α-helix	trans	-52.9	-45.3	171.3	166.6	-110.5	0	0	0	112.1	I1438 L1519 F1520 L1583 T1661 V1662 Q1667 R1668 L1669	I1438-F1665 HydrophobicContact CD1-CD2 4.25Å; I1438-F1665 HydrophobicContact CD1-CE2 3.63Å; I1438-F1665 HydrophobicContact CD1-CZ 4.46Å; L1519-F1665 HydrophobicContact CD2-CB 4.3Å; L1519-F1665 HydrophobicContact CG-CB 4.31Å; F1520-F1665 HydrophobicContact CB-CD2 3.54Å; F1520-F1665 HydrophobicContact CB-CE2 3.63Å; F1520-F1665 HydrophobicContact CB-CG 4.46Å; F1520-F1665 HydrophobicContact CB-CZ 4.49Å; F1520-F1665 HydrophobicContact CD1-CD2 4.29Å; F1520-F1665 AromaticContact CD1-CE2 3.47Å; F1520-F1665 HydrophobicContact CD1-CE2 3.47Å; F1520-F1665 VanDerWaalsContact CD1-CE2 3.45Å; F1520-F1665 AromaticContact CD1-CZ 3.92Å; F1520-F1665 HydrophobicContact CD1-CZ 4Å; F1520-F1665 HydrophobicContact CD2-CD2 4.15Å; F1520-F1665 HydrophobicContact CD2-CE1 4.42Å; F1520-F1665 AromaticContact CD2-CE2 3.76Å; F1520-F1665 HydrophobicContact CD2-CE2 3.76Å; F1520-F1665 AromaticContact CD2-CZ 3.86Å; F1520-F1665 HydrophobicContact CD2-CZ 3.95Å; F1520-F1665 AromaticContact CE1-CE2 3.92Å; F1520-F1665 HydrophobicContact CE1-CE2 3.98Å; F1520-F1665 AromaticContact CE1-CZ 3.96Å; F1520-F1665 HydrophobicContact CE1-CZ 4.04Å; F1520-F1665 HydrophobicContact CE2-CE1 4.45Å; F1520-F1665 AromaticContact CE2-CE2 3.93Å; F1520-F1665 HydrophobicContact CE2-CE2 4.23Å; F1520-F1665 AromaticContact CE2-CZ 3.9Å; F1520-F1665 HydrophobicContact CE2-CZ 3.99Å; F1520-F1665 AromaticContact CG-CD2 3.75Å; F1520-F1665 HydrophobicContact CG-CD2 3.75Å; F1520-F1665 AromaticContact CG-CE2 3.32Å; F1520-F1665 HydrophobicContact CG-CE2 3.32Å; F1520-F1665 AromaticContact CG-CZ 3.9Å; F1520-F1665 HydrophobicContact CG-CZ 3.93Å; F1520-F1665 HydrophobicContact CZ-CE2 4.32Å; F1520-F1665 AromaticContact CZ-CZ 3.99Å; F1520-F1665 HydrophobicContact CZ-CZ 4.03Å; L1583-F1665 HydrophobicContact CD2-CB 4.42Å; T1661-F1665 WeakPolarHBondContact O-CB 3.38Å; T1661-F1665 PolarHBondContact O-N 3.07Å; V1662-F1665 HydrophobicContact CG1-CD1 4.03Å; V1662-F1665 PolarHBondContact O-N 3.08Å; F1665-Q1667 VanDerWaalsContact C-N 3.25Å; F1665-Q1667 PolarHBondContact O-N 3.28Å; F1665-R1668 WeakPolarHBondContact O-CB 3.41Å; F1665-R1668 PolarHBondContact O-N 2.94Å; F1665-R1668 VanDerWaalsContact O-N 3.13Å; F1665-L1669 HydrophobicContact CD1-CD1 4.11Å; F1665-L1669 HydrophobicContact CD1-CG 4.48Å; F1665-L1669 HydrophobicContact CD2-CD1 4.43Å; F1665-L1669 HydrophobicContact CD2-CG 4.35Å; F1665-L1669 HydrophobicContact CE1-CD1 3.52Å; F1665-L1669 VanDerWaalsContact CE1-CD1 3.45Å; F1665-L1669 HydrophobicContact CE1-CG 4.24Å; F1665-L1669 HydrophobicContact CE2-CD1 4.14Å; F1665-L1669 HydrophobicContact CE2-CD2 4.06Å; F1665-L1669 HydrophobicContact CE2-CG 3.99Å; F1665-L1669 HydrophobicContact CG-CD1 4.49Å; F1665-L1669 HydrophobicContact CZ-CD1 3.56Å; F1665-L1669 VanDerWaalsContact CZ-CD1 3.41Å; F1665-L1669 HydrophobicContact CZ-CD2 4.07Å; F1665-L1669 HydrophobicContact CZ-CG 3.92Å; F1665-L1669 WeakPolarHBondContact O-CG 3.33Å; F1665-L1669 PolarHBondContact O-N 3.14Å
1666	N	88.9	Confident	87.3	Confident	54 Å²	54	40.3 Å²	40.3	29%	0.289	21%	0.213	S	C	.	.	H	α-helix	trans	-60.7	-30.3	176.1	-81.7	-57.7	0	0	0	113.5	V1662 W1664 D1670	V1662-N1666 WeakPolarHBondContact CG1-ND2 3.46Å; V1662-N1666 WeakPolarHBondContact O-CB 3.38Å; V1662-N1666 VanDerWaalsContact O-CG 3.22Å; V1662-N1666 PolarHBondContact O-N 3.09Å; V1662-N1666 PolarHBondContact O-ND2 3.14Å; W1664-N1666 VanDerWaalsContact C-N 3.28Å; W1664-N1666 PolarHBondContact O-N 2.93Å; N1666-D1670 PolarHBondContact O-N 2.75Å; N1666-D1670 VanDerWaalsContact O-N 3.16Å
1667	Q	88.9	Confident	86.6	Confident	9.8 Å²	9.8	42.9 Å²	42.9	5%	0.046	22%	0.222	C	C	.	.	H	α-helix	trans	-74.7	-41.7	174.8	-66.8	173.9	53.4	0	0	111.2	S1663 W1664 F1665 L1669 D1670 I1861 Y1869	S1663-Q1667 WeakPolarHBondContact O-CG 3.38Å; S1663-Q1667 PolarHBondContact O-N 3.11Å; S1663-Q1667 PolarHBondContact O-NE2 3.05Å; S1663-Q1667 VanDerWaalsContact O-NE2 3.16Å; W1664-Q1667 HydrophobicContact CE3-CB 3.93Å; W1664-Q1667 HydrophobicContact CE3-CG 4.3Å; W1664-Q1667 HydrophobicContact CZ3-CB 4.09Å; W1664-Q1667 WeakPolarHBondContact O-CA 3.39Å; W1664-Q1667 WeakPolarHBondContact O-CB 3.28Å; W1664-Q1667 PolarHBondContact O-N 3Å; F1665-Q1667 VanDerWaalsContact C-N 3.25Å; F1665-Q1667 PolarHBondContact O-N 3.28Å; Q1667-L1669 VanDerWaalsContact C-N 3.28Å; Q1667-L1669 PolarHBondContact O-N 3.07Å; Q1667-D1670 VanDerWaalsContact O-CB 3.32Å; Q1667-D1670 WeakPolarHBondContact O-CB 3.39Å; Q1667-D1670 PolarHBondContact O-N 2.94Å; Q1667-D1670 VanDerWaalsContact O-N 3.1Å; Q1667-I1861 PolarHBondContact NE2-O 3.06Å; Q1667-I1861 PolarHBondContact OE1-O 3.01Å; Q1667-Y1869 HydrophobicContact CB-CE1 4.41Å; Q1667-Y1869 HydrophobicContact CG-CD1 4.35Å; Q1667-Y1869 HydrophobicContact CG-CE1 3.52Å; Q1667-Y1869 VanDerWaalsContact CG-CE1 3.48Å; Q1667-Y1869 VanDerWaalsContact OE1-CD1 3.29Å
1668	R	90.4	Very high	86.1	Confident	16.6 Å²	16.6	42.7 Å²	42.7	6%	0.063	22%	0.221	C	C	.	.	H	α-helix	trans	-61.6	-33.6	174.1	-65	-62.5	-49	138.3	8.2	112.1	F1334 P1335 R1337 I1438 K1439 L1519 W1664 F1665 D1670 D1671 I1672	F1334-R1668 PolarHBondContact O-NH2 2.84Å; F1334-R1668 VanDerWaalsContact O-NH2 3.16Å; P1335-R1668 PolarHBondContact O-NH2 3.25Å; R1337-R1668 VanDerWaalsContact N-NH1 3.17Å; R1337-R1668 VanDerWaalsContact N-NH2 3.2Å; I1438-R1668 HydrophobicContact CG2-CB 3.96Å; I1438-R1668 HydrophobicContact CG2-CG 4.22Å; K1439-R1668 PolarHBondContact O-NE 3.46Å; K1439-R1668 VanDerWaalsContact O-NE 3.07Å; K1439-R1668 PolarHBondContact O-NH2 3.4Å; L1519-R1668 HydrophobicContact CD2-CB 4.26Å; L1519-R1668 HydrophobicContact CD2-CG 3.58Å; L1519-R1668 VanDerWaalsContact CD2-CG 3.48Å; W1664-R1668 HydrophobicContact CD2-CG 4.33Å; W1664-R1668 HydrophobicContact CE3-CG 4.46Å; W1664-R1668 HydrophobicContact CH2-CG 4.31Å; W1664-R1668 VanDerWaalsContact CZ2-CD 3.45Å; W1664-R1668 HydrophobicContact CZ2-CG 4.08Å; W1664-R1668 HydrophobicContact CZ3-CG 4.42Å; W1664-R1668 PolarHBondContact O-N 3.16Å; F1665-R1668 WeakPolarHBondContact O-CB 3.41Å; F1665-R1668 PolarHBondContact O-N 2.94Å; F1665-R1668 VanDerWaalsContact O-N 3.13Å; R1668-D1670 VanDerWaalsContact C-N 3.29Å; R1668-D1670 PolarHBondContact O-N 2.96Å; R1668-D1671 IonicContact CZ-OD2 3.53Å; R1668-D1671 IonicContact NE-OD2 2.68Å; R1668-D1671 IonicContact NH1-OD2 3.39Å; R1668-D1671 PolarHBondContact NH1-OD2 2.96Å; R1668-D1671 IonicContact NH2-OD2 3.78Å; R1668-D1671 PolarHBondContact NH2-OD2 3.06Å; R1668-D1671 WeakPolarHBondContact O-CB 3.33Å; R1668-D1671 PolarHBondContact O-N 3.06Å; R1668-D1671 VanDerWaalsContact O-N 3.17Å; R1668-I1672 WeakPolarHBondContact O-CD1 3.34Å; R1668-I1672 WeakPolarHBondContact O-CG1 3.26Å
1669	L	89.3	Confident	85.5	Confident	22.2 Å²	22.2	49.4 Å²	49.4	12%	0.116	25%	0.25	C	C	.	.	H	α-helix	trans	-64	-23.9	173.1	-73.8	179.8	0	0	0	113.7	I1438 F1665 Q1667 D1671 I1672 K1673	I1438-L1669 HydrophobicContact CD1-CD2 3.82Å; I1438-L1669 HydrophobicContact CD1-CG 4.43Å; F1665-L1669 HydrophobicContact CD1-CD1 4.11Å; F1665-L1669 HydrophobicContact CD1-CG 4.48Å; F1665-L1669 HydrophobicContact CD2-CD1 4.43Å; F1665-L1669 HydrophobicContact CD2-CG 4.35Å; F1665-L1669 HydrophobicContact CE1-CD1 3.52Å; F1665-L1669 VanDerWaalsContact CE1-CD1 3.45Å; F1665-L1669 HydrophobicContact CE1-CG 4.24Å; F1665-L1669 HydrophobicContact CE2-CD1 4.14Å; F1665-L1669 HydrophobicContact CE2-CD2 4.06Å; F1665-L1669 HydrophobicContact CE2-CG 3.99Å; F1665-L1669 HydrophobicContact CG-CD1 4.49Å; F1665-L1669 HydrophobicContact CZ-CD1 3.56Å; F1665-L1669 VanDerWaalsContact CZ-CD1 3.41Å; F1665-L1669 HydrophobicContact CZ-CD2 4.07Å; F1665-L1669 HydrophobicContact CZ-CG 3.92Å; F1665-L1669 WeakPolarHBondContact O-CG 3.33Å; F1665-L1669 PolarHBondContact O-N 3.14Å; Q1667-L1669 VanDerWaalsContact C-N 3.28Å; Q1667-L1669 PolarHBondContact O-N 3.07Å; L1669-D1671 VanDerWaalsContact C-N 3.25Å; L1669-D1671 PolarHBondContact O-N 3.03Å; L1669-I1672 HydrophobicContact CD2-CD1 4.38Å; L1669-I1672 HydrophobicContact CD2-CG2 4.43Å; L1669-I1672 PolarHBondContact O-N 2.97Å; L1669-K1673 HydrophobicContact CB-CD 4.31Å; L1669-K1673 VanDerWaalsContact O-CB 3.27Å; L1669-K1673 WeakPolarHBondContact O-CB 3.33Å; L1669-K1673 WeakPolarHBondContact O-CD 3.49Å; L1669-K1673 WeakPolarHBondContact O-CG 3.4Å; L1669-K1673 PolarHBondContact O-N 3.19Å
1670	D	85.7	Confident	85.3	Confident	56.6 Å²	56.6	47.6 Å²	47.6	30%	0.303	24%	0.243	S	C	.	.	H	α-helix	trans	-70.9	-23.8	176.7	-69.5	-23.2	0	0	0	112.1	R1341 N1666 Q1667 R1668 I1672 Y1869 K1874	R1341-D1670 PolarHBondContact NH1-O 3.16Å; N1666-D1670 PolarHBondContact O-N 2.75Å; N1666-D1670 VanDerWaalsContact O-N 3.16Å; Q1667-D1670 VanDerWaalsContact O-CB 3.32Å; Q1667-D1670 WeakPolarHBondContact O-CB 3.39Å; Q1667-D1670 PolarHBondContact O-N 2.94Å; Q1667-D1670 VanDerWaalsContact O-N 3.1Å; R1668-D1670 VanDerWaalsContact C-N 3.29Å; R1668-D1670 PolarHBondContact O-N 2.96Å; D1670-I1672 VanDerWaalsContact C-N 3.3Å; D1670-Y1869 WeakPolarHBondContact OD2-CE2 3.22Å; D1670-Y1869 PolarHBondContact OD2-OH 3.12Å; D1670-K1874 IonicContact OD1-NZ 3.91Å; D1670-K1874 IonicContact OD2-NZ 3.59Å
1671	D	86.9	Confident	84.9	Confident	51.2 Å²	51.2	51.1 Å²	51.1	27%	0.274	25%	0.25	S	S	.	.	H	α-helix	trans	-77.9	-22.5	174.8	-63.4	-22.2	0	0	0	112.5	F1340 R1341 R1668 L1669	F1340-D1671 PolarHBondContact N-O 3.14Å; R1341-D1671 VanDerWaalsContact CB-O 3.25Å; R1341-D1671 WeakPolarHBondContact CB-O 3.38Å; R1341-D1671 PolarHBondContact N-O 3.12Å; R1668-D1671 IonicContact CZ-OD2 3.53Å; R1668-D1671 IonicContact NE-OD2 2.68Å; R1668-D1671 IonicContact NH1-OD2 3.39Å; R1668-D1671 PolarHBondContact NH1-OD2 2.96Å; R1668-D1671 IonicContact NH2-OD2 3.78Å; R1668-D1671 PolarHBondContact NH2-OD2 3.06Å; R1668-D1671 WeakPolarHBondContact O-CB 3.33Å; R1668-D1671 PolarHBondContact O-N 3.06Å; R1668-D1671 VanDerWaalsContact O-N 3.17Å; L1669-D1671 VanDerWaalsContact C-N 3.25Å; L1669-D1671 PolarHBondContact O-N 3.03Å
1672	I	88.8	Confident	84.5	Confident	38.6 Å²	38.6	52.3 Å²	52.3	20%	0.198	26%	0.258	C	S	.	.	H	α-helix	trans	-96.4	-46.3	-177.2	-60.7	168.2	0	0	0	110.3	F1334 F1340 R1341 I1438 R1668 L1669 D1670	F1334-I1672 HydrophobicContact CB-CD1 3.74Å; F1334-I1672 HydrophobicContact CB-CG1 4.21Å; F1334-I1672 HydrophobicContact CD1-CD1 4.25Å; F1334-I1672 HydrophobicContact CD1-CG1 4.09Å; F1334-I1672 HydrophobicContact CD1-CG2 4.27Å; F1334-I1672 HydrophobicContact CD2-CD1 3.86Å; F1334-I1672 HydrophobicContact CD2-CG1 4.44Å; F1334-I1672 HydrophobicContact CE1-CG1 4.48Å; F1334-I1672 HydrophobicContact CE1-CG2 3.93Å; F1334-I1672 HydrophobicContact CE2-CD1 4.35Å; F1334-I1672 HydrophobicContact CE2-CG2 4.29Å; F1334-I1672 HydrophobicContact CG-CD1 3.66Å; F1334-I1672 HydrophobicContact CG-CG1 4.01Å; F1334-I1672 HydrophobicContact CZ-CG2 3.93Å; F1340-I1672 HydrophobicContact CD1-CG2 4.23Å; R1341-I1672 WeakPolarHBondContact CA-O 3.39Å; R1341-I1672 WeakPolarHBondContact CB-O 3.15Å; I1438-I1672 HydrophobicContact CD1-CD1 3.68Å; I1438-I1672 HydrophobicContact CG1-CD1 3.82Å; I1438-I1672 HydrophobicContact CG2-CD1 4.19Å; R1668-I1672 WeakPolarHBondContact O-CD1 3.34Å; R1668-I1672 WeakPolarHBondContact O-CG1 3.26Å; L1669-I1672 HydrophobicContact CD2-CD1 4.38Å; L1669-I1672 HydrophobicContact CD2-CG2 4.43Å; L1669-I1672 PolarHBondContact O-N 2.97Å; D1670-I1672 VanDerWaalsContact C-N 3.3Å
1673	K	84.1	Confident	84.2	Confident	95.2 Å²	95.2	52.2 Å²	52.2	41%	0.414	26%	0.258	S	S	.	.	S	Bend	trans	-74.7	136.3	-174.8	-69.5	177.1	-179.2	178.1	0	110.8	R1341 L1669 L1675	R1341-K1673 WeakPolarHBondContact CD-O 3.34Å; R1341-K1673 WeakPolarHBondContact CG-O 3Å; L1669-K1673 HydrophobicContact CB-CD 4.31Å; L1669-K1673 VanDerWaalsContact O-CB 3.27Å; L1669-K1673 WeakPolarHBondContact O-CB 3.33Å; L1669-K1673 WeakPolarHBondContact O-CD 3.49Å; L1669-K1673 WeakPolarHBondContact O-CG 3.4Å; L1669-K1673 PolarHBondContact O-N 3.19Å; K1673-L1675 PolarHBondContact O-N 3.09Å
1674	P	80.3	Confident	84.1	Confident	61.2 Å²	61.2	52.4 Å²	52.4	40%	0.397	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-50.9	137.6	170.1	-19.3	24.6	0	0	0	112	R1341 Y1344 I1676	R1341-P1674 HydrophobicContact CG-CB 4.46Å; R1341-P1674 HydrophobicContact CG-CG 4.31Å; Y1344-P1674 HydrophobicContact CD1-CG 3.71Å; Y1344-P1674 VanDerWaalsContact CD1-CG 3.49Å; Y1344-P1674 HydrophobicContact CE1-CG 3.65Å; P1674-I1676 PolarHBondContact O-N 3.01Å
1675	L	74.7	Confident	83.9	Confident	120.4 Å²	120.4	51.6 Å²	51.6	63%	0.63	26%	0.256	S	S	*	.	P	Polyproline II helix	trans	-59.6	136.4	177.8	-72.8	169.2	0	0	0	109.7	R1341 K1673 K1677	R1341-L1675 VanDerWaalsContact CZ-CG 3.44Å; R1341-L1675 VanDerWaalsContact NH1-CD2 3.32Å; R1341-L1675 VanDerWaalsContact NH1-CG 3.34Å; K1673-L1675 PolarHBondContact O-N 3.09Å; L1675-K1677 PolarHBondContact O-N 3.06Å; L1675-K1677 VanDerWaalsContact O-N 3.1Å
1676	I	72.7	Confident	83.7	Confident	104.6 Å²	104.6	56.4 Å²	56.4	54%	0.536	27%	0.273	S	S	.	.			trans	-64.5	114.4	174.4	-49.3	176	0	0	0	107.3	P1674 D1678	P1674-I1676 PolarHBondContact O-N 3.01Å; I1676-D1678 VanDerWaalsContact CG2-O 3.25Å; I1676-D1678 WeakPolarHBondContact CG2-O 3.45Å
1677	K	72.9	Confident	83.8	Confident	70.2 Å²	70.2	54.2 Å²	54.2	31%	0.305	26%	0.261	S	S	.	.	S	Bend	trans	-74.8	-37.2	-176	-69.8	175.6	168.8	-168.1	0	112.3	H1615 F1633 L1675 K1679 Y1790	H1615-K1677 PolarHBondContact CE1-NZ 3.29Å; H1615-K1677 PolarHBondContact NE2-NZ 3.08Å; F1633-K1677 PolarHBondContact O-NZ 3.36Å; L1675-K1677 PolarHBondContact O-N 3.06Å; L1675-K1677 VanDerWaalsContact O-N 3.1Å; K1677-K1679 PolarHBondContact O-N 3.25Å; K1677-Y1790 HydrophobicContact CB-CD1 4.21Å; K1677-Y1790 HydrophobicContact CB-CD2 3.91Å; K1677-Y1790 HydrophobicContact CB-CE1 3.87Å; K1677-Y1790 HydrophobicContact CB-CE2 3.88Å; K1677-Y1790 HydrophobicContact CD-CD2 4.28Å; K1677-Y1790 HydrophobicContact CD-CE1 3.86Å; K1677-Y1790 HydrophobicContact CD-CE2 3.92Å; K1677-Y1790 WeakPolarHBondContact CD-OH 3.42Å; K1677-Y1790 WeakPolarHBondContact CE-OH 3.25Å; K1677-Y1790 HydrophobicContact CG-CD2 4.45Å; K1677-Y1790 HydrophobicContact CG-CE1 4.03Å; K1677-Y1790 HydrophobicContact CG-CE2 4.12Å; K1677-Y1790 PolarHBondContact NZ-OH 2.98Å; K1677-Y1790 VanDerWaalsContact NZ-OH 3.11Å
1678	D	78.8	Confident	83.9	Confident	7.6 Å²	7.6	53.7 Å²	53.7	4%	0.041	26%	0.259	C	S	.	.			trans	-83.2	111.2	170.8	-174	-35.8	0	0	0	109.3	I1676 S1680 Y1788 C1789 H1802 S1804	I1676-D1678 VanDerWaalsContact CG2-O 3.25Å; I1676-D1678 WeakPolarHBondContact CG2-O 3.45Å; D1678-S1680 VanDerWaalsContact C-N 3.29Å; D1678-S1680 PolarHBondContact O-N 3.18Å; D1678-S1680 VanDerWaalsContact OD1-CB 3.27Å; D1678-S1680 WeakPolarHBondContact OD1-CB 3.35Å; D1678-S1680 PolarHBondContact OD1-N 3.06Å; D1678-S1680 PolarHBondContact OD1-OG 3.08Å; D1678-Y1788 HydrophobicContact CB-CD1 3.82Å; D1678-Y1788 HydrophobicContact CB-CE1 4.44Å; D1678-Y1788 WeakPolarHBondContact OD2-CA 3.19Å; D1678-C1789 WeakPolarHBondContact CA-O 3.31Å; D1678-C1789 WeakPolarHBondContact CB-O 3.16Å; D1678-C1789 PolarHBondContact OD2-N 3.27Å; D1678-C1789 VanDerWaalsContact OD2-N 3.14Å; D1678-H1802 IonicContact OD1-CD2 3.27Å; D1678-H1802 IonicContact OD1-NE2 3.2Å; D1678-H1802 IonicContact OD2-NE2 2.7Å; D1678-S1804 VanDerWaalsContact OD2-CB 3.27Å; D1678-S1804 WeakPolarHBondContact OD2-CB 3.32Å; D1678-S1804 PolarHBondContact OD2-OG 3.15Å
1679	K	78.6	Confident	84	Confident	144.8 Å²	144.8	56.3 Å²	56.3	63%	0.63	27%	0.271	S	S	*	.			trans	-94.9	38.6	-178.8	-64	-176.6	-176	169.6	0	112.6	K1677 Y1681 M1791	K1677-K1679 PolarHBondContact O-N 3.25Å; K1679-Y1681 PolarHBondContact O-N 3.11Å; K1679-M1791 HydrophobicContact CB-CE 4.26Å; K1679-M1791 HydrophobicContact CB-CG 4.18Å; K1679-M1791 HydrophobicContact CB-SD 4Å; K1679-M1791 HydrophobicContact CD-CG 4.15Å; K1679-M1791 HydrophobicContact CD-SD 3.92Å; K1679-M1791 HydrophobicContact CG-CG 4.1Å; K1679-M1791 HydrophobicContact CG-SD 4.35Å; K1679-M1791 PolarHBondContact NZ-SD 2.82Å
1680	S	85.2	Confident	84.1	Confident	11 Å²	11	57.8 Å²	57.8	8%	0.077	28%	0.278	C	S	.	.			trans	-49.1	133.5	172.6	-72.5	0	0	0	0	112.6	D1678 P1682 H1802 S1804	D1678-S1680 VanDerWaalsContact C-N 3.29Å; D1678-S1680 PolarHBondContact O-N 3.18Å; D1678-S1680 VanDerWaalsContact OD1-CB 3.27Å; D1678-S1680 WeakPolarHBondContact OD1-CB 3.35Å; D1678-S1680 PolarHBondContact OD1-N 3.06Å; D1678-S1680 PolarHBondContact OD1-OG 3.08Å; S1680-P1682 CarbonylContact O-C 3.52Å; S1680-H1802 WeakPolarHBondContact CA-O 3.37Å; S1680-S1804 WeakPolarHBondContact OG-CB 3.39Å; S1680-S1804 PolarHBondContact OG-N 2.98Å; S1680-S1804 PolarHBondContact OG-OG 2.84Å
1681	Y	80	Confident	84.4	Confident	120.6 Å²	120.6	56.1 Å²	56.1	47%	0.473	27%	0.267	S	S	.	.	S	Bend	trans	-117.1	131.8	179.1	-176.7	-95.2	0	0	0	111.7	K1679 H1802	K1679-Y1681 PolarHBondContact O-N 3.11Å; Y1681-H1802 PolarHBondContact N-O 2.98Å; Y1681-H1802 VanDerWaalsContact N-O 3.11Å
1682	P	82.8	Confident	84.7	Confident	32.2 Å²	32.2	53.8 Å²	53.8	21%	0.209	26%	0.255	C	S	.	.	S	Bend	cis	-69.6	158.4	-2.4	28.5	-36.5	0	0	0	113.8	S1680 L1684 R1809	S1680-P1682 CarbonylContact O-C 3.52Å; P1682-L1684 PolarHBondContact O-N 3.45Å; P1682-R1809 VanDerWaalsContact CD-NH1 3.34Å; P1682-R1809 PolarHBondContact O-NH2 3.1Å
1683	P	85.1	Confident	84.9	Confident	23.4 Å²	23.4	53.6 Å²	53.6	15%	0.152	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-60.6	141.7	177.3	18	-24	0	0	0	111.5	G1685 P1872 R1873 K1874 P1875	P1683-G1685 PolarHBondContact O-N 3.13Å; P1683-P1872 HydrophobicContact CG-CB 4.12Å; P1683-P1872 HydrophobicContact CG-CG 4.15Å; P1683-R1873 VanDerWaalsContact CG-O 3.26Å; P1683-R1873 WeakPolarHBondContact CG-O 3.45Å; P1683-K1874 HydrophobicContact CB-CG 4.45Å; P1683-K1874 HydrophobicContact CG-CG 4.35Å; P1683-P1875 VanDerWaalsContact O-CD 3.29Å; P1683-P1875 WeakPolarHBondContact O-CD 3.39Å
1684	L	87.4	Confident	85.3	Confident	17.2 Å²	17.2	53.3 Å²	53.3	9%	0.09	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-62.5	130.6	-178	-160	65.3	0	0	0	111.6	P1682 D1688 K1689 L1692 F1805 R1809	P1682-L1684 PolarHBondContact O-N 3.45Å; L1684-D1688 HydrophobicContact CD1-CB 3.5Å; L1684-D1688 VanDerWaalsContact CD1-CB 3.48Å; L1684-D1688 HydrophobicContact CD2-CB 4.19Å; L1684-D1688 HydrophobicContact CG-CB 3.66Å; L1684-K1689 HydrophobicContact CB-CG 4.25Å; L1684-K1689 HydrophobicContact CD2-CB 4.49Å; L1684-K1689 HydrophobicContact CD2-CG 3.7Å; L1684-K1689 HydrophobicContact CG-CG 4.05Å; L1684-K1689 VanDerWaalsContact O-CE 3.31Å; L1684-K1689 WeakPolarHBondContact O-CE 3.34Å; L1684-L1692 HydrophobicContact CD2-CD2 4.11Å; L1684-F1805 HydrophobicContact CB-CD2 4.16Å; L1684-F1805 HydrophobicContact CB-CE2 4.28Å; L1684-F1805 HydrophobicContact CB-CG 4.5Å; L1684-F1805 HydrophobicContact CD1-CB 3.95Å; L1684-F1805 HydrophobicContact CD1-CD1 4.17Å; L1684-F1805 HydrophobicContact CD1-CD2 4.25Å; L1684-F1805 HydrophobicContact CD1-CG 3.84Å; L1684-F1805 HydrophobicContact CD2-CD1 3.98Å; L1684-F1805 HydrophobicContact CD2-CD2 4.33Å; L1684-F1805 HydrophobicContact CD2-CE1 3.92Å; L1684-F1805 HydrophobicContact CD2-CE2 4.36Å; L1684-F1805 HydrophobicContact CD2-CG 4.33Å; L1684-F1805 HydrophobicContact CD2-CZ 4.21Å; L1684-F1805 HydrophobicContact CG-CD1 4.45Å; L1684-F1805 HydrophobicContact CG-CD2 4.45Å; L1684-F1805 HydrophobicContact CG-CG 4.3Å; L1684-R1809 HydrophobicContact CD1-CB 4.35Å; L1684-R1809 HydrophobicContact CD1-CG 4.13Å
1685	G	88.1	Confident	86	Confident	2.4 Å²	2.4	51 Å²	51	3%	0.025	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-64.7	159	174.9	0	0	0	0	0	111.9	P1683 W1687 D1688 K1689	P1683-G1685 PolarHBondContact O-N 3.13Å; G1685-W1687 VanDerWaalsContact C-N 3.28Å; G1685-W1687 PolarHBondContact O-N 3.1Å; G1685-D1688 PolarHBondContact O-N 3.17Å; G1685-K1689 WeakPolarHBondContact O-CG 3.41Å; G1685-K1689 PolarHBondContact O-N 3.14Å; G1685-K1689 VanDerWaalsContact O-N 3.1Å
1686	W	87.6	Confident	86.9	Confident	124.4 Å²	124.4	45.8 Å²	45.8	47%	0.471	21%	0.211	S	C	.	.	H	α-helix	trans	-66	-32.8	-179.5	66.9	-96.9	0	0	0	112.1	K1689 I1690 F1877	W1686-K1689 WeakPolarHBondContact O-CB 3.34Å; W1686-K1689 PolarHBondContact O-N 3.01Å; W1686-I1690 HydrophobicContact CE3-CD1 3.57Å; W1686-I1690 HydrophobicContact CE3-CG1 4.45Å; W1686-I1690 HydrophobicContact CZ3-CD1 3.71Å; W1686-I1690 WeakPolarHBondContact O-CD1 3.26Å; W1686-I1690 VanDerWaalsContact O-CG1 3.28Å; W1686-I1690 WeakPolarHBondContact O-CG1 3.18Å; W1686-I1690 PolarHBondContact O-N 2.98Å; W1686-F1877 HydrophobicContact CZ2-CB 4.38Å; W1686-F1877 AromaticContact CZ2-CD2 3.99Å; W1686-F1877 HydrophobicContact CZ2-CD2 4.03Å; W1686-F1877 HydrophobicContact CZ2-CE2 4.45Å; W1686-F1877 HydrophobicContact CZ2-CG 4.13Å
1687	W	91.2	Very high	87.9	Confident	7.2 Å²	7.2	43.4 Å²	43.4	3%	0.027	20%	0.197	C	C	.	.	H	α-helix	trans	-64.4	-47.3	175.7	54.3	88.5	0	0	0	111.9	G1685 K1689 I1690 R1691 W1774 P1875 F1877 L1880	G1685-W1687 VanDerWaalsContact C-N 3.28Å; G1685-W1687 PolarHBondContact O-N 3.1Å; W1687-K1689 VanDerWaalsContact C-N 3.28Å; W1687-K1689 PolarHBondContact O-N 2.98Å; W1687-I1690 WeakPolarHBondContact O-CB 3.45Å; W1687-I1690 PolarHBondContact O-N 3.06Å; W1687-I1690 VanDerWaalsContact O-N 3.14Å; W1687-R1691 VanDerWaalsContact O-CG 3.25Å; W1687-R1691 WeakPolarHBondContact O-CG 3.37Å; W1687-R1691 PolarHBondContact O-N 3.14Å; W1687-W1774 HydrophobicContact CB-CH2 3.69Å; W1687-W1774 VanDerWaalsContact CB-CH2 3.48Å; W1687-W1774 HydrophobicContact CB-CZ2 4.35Å; W1687-W1774 HydrophobicContact CB-CZ3 3.96Å; W1687-W1774 AromaticContact CD1-CH2 3.96Å; W1687-W1774 AromaticContact CD1-CZ3 3.53Å; W1687-W1774 VanDerWaalsContact CD1-CZ3 3.47Å; W1687-W1774 AromaticContact CG-CH2 3.91Å; W1687-W1774 HydrophobicContact CG-CH2 4.13Å; W1687-W1774 AromaticContact CG-CZ3 3.87Å; W1687-W1774 HydrophobicContact CG-CZ3 3.87Å; W1687-P1875 HydrophobicContact CH2-CB 3.74Å; W1687-P1875 HydrophobicContact CH2-CG 3.73Å; W1687-P1875 WeakPolarHBondContact CH2-O 3.35Å; W1687-P1875 HydrophobicContact CZ2-CB 3.93Å; W1687-P1875 HydrophobicContact CZ2-CG 3.81Å; W1687-F1877 HydrophobicContact CB-CD2 4.39Å; W1687-F1877 HydrophobicContact CB-CE2 4.41Å; W1687-F1877 AromaticContact CD2-CD2 3.89Å; W1687-F1877 HydrophobicContact CD2-CD2 3.95Å; W1687-F1877 HydrophobicContact CE3-CB 3.95Å; W1687-F1877 AromaticContact CE3-CD2 3.61Å; W1687-F1877 HydrophobicContact CE3-CD2 3.61Å; W1687-F1877 HydrophobicContact CE3-CG 4.26Å; W1687-F1877 HydrophobicContact CG-CD2 4.3Å; W1687-F1877 HydrophobicContact CH2-CB 4.38Å; W1687-F1877 VanDerWaalsContact CZ3-CA 3.48Å; W1687-F1877 HydrophobicContact CZ3-CB 3.67Å; W1687-F1877 HydrophobicContact CZ3-CD2 4.14Å; W1687-F1877 HydrophobicContact CZ3-CG 4.38Å; W1687-L1880 HydrophobicContact CD2-CD1 3.65Å; W1687-L1880 HydrophobicContact CD2-CD2 4.33Å; W1687-L1880 HydrophobicContact CE3-CD1 4.19Å; W1687-L1880 HydrophobicContact CG-CD1 4.07Å; W1687-L1880 HydrophobicContact CG-CD2 4.34Å; W1687-L1880 HydrophobicContact CH2-CD1 4.09Å; W1687-L1880 HydrophobicContact CH2-CG 4.43Å; W1687-L1880 HydrophobicContact CZ2-CD1 4.14Å; W1687-L1880 HydrophobicContact CZ2-CD2 4.26Å; W1687-L1880 HydrophobicContact CZ2-CG 4.01Å; W1687-L1880 HydrophobicContact CZ3-CD1 4.38Å
1688	D	91.9	Very high	89	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-66.2	-33.2	177.3	-69.9	-37.9	0	0	0	111.2	L1684 G1685 I1690 R1691 L1692 F1808 R1809 A1810	L1684-D1688 HydrophobicContact CD1-CB 3.5Å; L1684-D1688 VanDerWaalsContact CD1-CB 3.48Å; L1684-D1688 HydrophobicContact CD2-CB 4.19Å; L1684-D1688 HydrophobicContact CG-CB 3.66Å; G1685-D1688 PolarHBondContact O-N 3.17Å; D1688-I1690 VanDerWaalsContact C-N 3.3Å; D1688-I1690 PolarHBondContact O-N 2.79Å; D1688-R1691 PolarHBondContact O-N 3.23Å; D1688-R1691 IonicContact OD1-CZ 3.07Å; D1688-R1691 IonicContact OD1-NH1 3.52Å; D1688-R1691 PolarHBondContact OD1-NH1 2.83Å; D1688-R1691 VanDerWaalsContact OD1-NH1 3.1Å; D1688-R1691 IonicContact OD1-NH2 3.15Å; D1688-R1691 PolarHBondContact OD1-NH2 2.86Å; D1688-L1692 VanDerWaalsContact O-CB 3.22Å; D1688-L1692 WeakPolarHBondContact O-CB 3.37Å; D1688-L1692 PolarHBondContact O-N 3.19Å; D1688-F1808 HydrophobicContact CB-CE1 4.4Å; D1688-R1809 VanDerWaalsContact OD2-CG 3.28Å; D1688-R1809 WeakPolarHBondContact OD2-CG 3.29Å; D1688-A1810 WeakPolarHBondContact OD1-CB 3.4Å; D1688-A1810 PolarHBondContact OD1-N 3.13Å; D1688-A1810 VanDerWaalsContact OD1-N 3.12Å; D1688-A1810 PolarHBondContact OD2-N 3.09Å
1689	K	91.3	Very high	89.9	Confident	70.6 Å²	70.6	43.2 Å²	43.2	31%	0.307	20%	0.199	S	C	.	.	H	α-helix	trans	-63.7	-41.9	172	-75.2	176.8	-178.9	-173.6	0	112	L1684 G1685 W1686 W1687 L1692 L1693	L1684-K1689 HydrophobicContact CB-CG 4.25Å; L1684-K1689 HydrophobicContact CD2-CB 4.49Å; L1684-K1689 HydrophobicContact CD2-CG 3.7Å; L1684-K1689 HydrophobicContact CG-CG 4.05Å; L1684-K1689 VanDerWaalsContact O-CE 3.31Å; L1684-K1689 WeakPolarHBondContact O-CE 3.34Å; G1685-K1689 WeakPolarHBondContact O-CG 3.41Å; G1685-K1689 PolarHBondContact O-N 3.14Å; G1685-K1689 VanDerWaalsContact O-N 3.1Å; W1686-K1689 WeakPolarHBondContact O-CB 3.34Å; W1686-K1689 PolarHBondContact O-N 3.01Å; W1687-K1689 VanDerWaalsContact C-N 3.28Å; W1687-K1689 PolarHBondContact O-N 2.98Å; K1689-L1692 PolarHBondContact O-N 3.19Å; K1689-L1693 WeakPolarHBondContact O-CB 3.32Å; K1689-L1693 VanDerWaalsContact O-CD1 3.32Å; K1689-L1693 WeakPolarHBondContact O-CD1 3.42Å; K1689-L1693 VanDerWaalsContact O-CG 3.23Å; K1689-L1693 WeakPolarHBondContact O-CG 3.36Å; K1689-L1693 PolarHBondContact O-N 3.04Å; K1689-L1693 VanDerWaalsContact O-N 3.11Å
1690	I	91.5	Very high	90.6	Very high	53.8 Å²	53.8	38 Å²	38	28%	0.276	18%	0.176	S	C	.	.	H	α-helix	trans	-63.6	-52.3	177.2	-70.9	173	0	0	0	109.3	W1686 W1687 D1688 L1692 L1693 Y1694 W1733	W1686-I1690 HydrophobicContact CE3-CD1 3.57Å; W1686-I1690 HydrophobicContact CE3-CG1 4.45Å; W1686-I1690 HydrophobicContact CZ3-CD1 3.71Å; W1686-I1690 WeakPolarHBondContact O-CD1 3.26Å; W1686-I1690 VanDerWaalsContact O-CG1 3.28Å; W1686-I1690 WeakPolarHBondContact O-CG1 3.18Å; W1686-I1690 PolarHBondContact O-N 2.98Å; W1687-I1690 WeakPolarHBondContact O-CB 3.45Å; W1687-I1690 PolarHBondContact O-N 3.06Å; W1687-I1690 VanDerWaalsContact O-N 3.14Å; D1688-I1690 VanDerWaalsContact C-N 3.3Å; D1688-I1690 PolarHBondContact O-N 2.79Å; I1690-L1692 PolarHBondContact O-N 3.12Å; I1690-L1692 VanDerWaalsContact O-N 3.13Å; I1690-L1693 PolarHBondContact O-N 3.05Å; I1690-L1693 VanDerWaalsContact O-N 3.11Å; I1690-Y1694 HydrophobicContact CB-CD2 4.41Å; I1690-Y1694 HydrophobicContact CG1-CD2 4.27Å; I1690-Y1694 HydrophobicContact CG2-CD2 4.17Å; I1690-Y1694 WeakPolarHBondContact O-CB 3.19Å; I1690-Y1694 WeakPolarHBondContact O-CD2 3.19Å; I1690-Y1694 PolarHBondContact O-N 3.15Å; I1690-W1733 HydrophobicContact CG2-CH2 4.17Å; I1690-W1733 HydrophobicContact CG2-CZ2 4.01Å
1691	R	92.3	Very high	91.2	Very high	20.8 Å²	20.8	39 Å²	39	8%	0.078	19%	0.186	C	C	.	.	H	α-helix	trans	-59.1	-24.3	176.9	-84.7	172.9	59.7	-149.9	-9.9	114.2	W1687 D1688 H1695 W1774 S1776 P1780 F1808	W1687-R1691 VanDerWaalsContact O-CG 3.25Å; W1687-R1691 WeakPolarHBondContact O-CG 3.37Å; W1687-R1691 PolarHBondContact O-N 3.14Å; D1688-R1691 PolarHBondContact O-N 3.23Å; D1688-R1691 IonicContact OD1-CZ 3.07Å; D1688-R1691 IonicContact OD1-NH1 3.52Å; D1688-R1691 PolarHBondContact OD1-NH1 2.83Å; D1688-R1691 VanDerWaalsContact OD1-NH1 3.1Å; D1688-R1691 IonicContact OD1-NH2 3.15Å; D1688-R1691 PolarHBondContact OD1-NH2 2.86Å; R1691-H1695 PolarHBondContact O-CE1 3.2Å; R1691-W1774 VanDerWaalsContact CD-CE2 3.44Å; R1691-W1774 HydrophobicContact CG-CZ2 4.43Å; R1691-W1774 VanDerWaalsContact CZ-CG 3.45Å; R1691-W1774 VanDerWaalsContact NE-CD1 3.33Å; R1691-W1774 VanDerWaalsContact NE-CG 3.33Å; R1691-W1774 VanDerWaalsContact NH1-CE3 3.34Å; R1691-W1774 VanDerWaalsContact NH1-CG 3.34Å; R1691-S1776 PolarHBondContact NH1-OG 3.05Å; R1691-P1780 VanDerWaalsContact NH1-C 3.3Å; R1691-P1780 PolarHBondContact NH1-O 3.27Å; R1691-P1780 VanDerWaalsContact NH2-CB 3.29Å; R1691-P1780 PolarHBondContact NH2-O 3.04Å; R1691-F1808 HydrophobicContact CB-CZ 4.11Å; R1691-F1808 HydrophobicContact CG-CE2 4.2Å; R1691-F1808 HydrophobicContact CG-CZ 3.89Å; R1691-F1808 PolarHBondContact NH1-O 2.84Å; R1691-F1808 PolarHBondContact NH2-O 3.22Å
1692	L	92.7	Very high	92	Very high	2.2 Å²	2.2	33.5 Å²	33.5	1%	0.012	17%	0.165	C	C	.	.	H	α-helix	trans	-82.1	-34.4	177.2	180	60	0	0	0	112.4	L1684 D1688 K1689 I1690 H1695 H1783 V1786 Y1788 F1805 F1808	L1684-L1692 HydrophobicContact CD2-CD2 4.11Å; D1688-L1692 VanDerWaalsContact O-CB 3.22Å; D1688-L1692 WeakPolarHBondContact O-CB 3.37Å; D1688-L1692 PolarHBondContact O-N 3.19Å; K1689-L1692 PolarHBondContact O-N 3.19Å; I1690-L1692 PolarHBondContact O-N 3.12Å; I1690-L1692 VanDerWaalsContact O-N 3.13Å; L1692-H1695 VanDerWaalsContact C-NE2 3.35Å; L1692-H1695 PolarHBondContact O-NE2 3.03Å; L1692-H1783 HydrophobicContact CD1-CB 4.05Å; L1692-H1783 PolarHBondContact O-ND1 2.8Å; L1692-V1786 HydrophobicContact CD1-CB 4.28Å; L1692-V1786 HydrophobicContact CD1-CG1 4.34Å; L1692-V1786 HydrophobicContact CD1-CG2 4.25Å; L1692-V1786 HydrophobicContact CD2-CG1 4.27Å; L1692-Y1788 HydrophobicContact CD2-CE2 4.22Å; L1692-Y1788 VanDerWaalsContact CD2-OH 3.24Å; L1692-Y1788 WeakPolarHBondContact CD2-OH 3.37Å; L1692-F1805 HydrophobicContact CD2-CD1 4.32Å; L1692-F1805 HydrophobicContact CD2-CE1 3.69Å; L1692-F1808 HydrophobicContact CB-CE1 3.91Å; L1692-F1808 HydrophobicContact CB-CZ 4.03Å; L1692-F1808 HydrophobicContact CD1-CE1 4.31Å; L1692-F1808 HydrophobicContact CD1-CZ 4.39Å
1693	L	93.3	Very high	92.7	Very high	35.8 Å²	35.8	36.7 Å²	36.7	19%	0.187	18%	0.18	C	C	.	.	H	α-helix	trans	-102.2	-27.9	-167.2	-63.3	177	0	0	0	114.1	P1636 K1638 F1639 K1689 I1690	P1636-L1693 HydrophobicContact CB-CD2 3.53Å; P1636-L1693 HydrophobicContact CG-CD2 4.14Å; K1638-L1693 WeakPolarHBondContact CA-O 3.4Å; F1639-L1693 PolarHBondContact N-O 3.12Å; K1689-L1693 WeakPolarHBondContact O-CB 3.32Å; K1689-L1693 VanDerWaalsContact O-CD1 3.32Å; K1689-L1693 WeakPolarHBondContact O-CD1 3.42Å; K1689-L1693 VanDerWaalsContact O-CG 3.23Å; K1689-L1693 WeakPolarHBondContact O-CG 3.36Å; K1689-L1693 PolarHBondContact O-N 3.04Å; K1689-L1693 VanDerWaalsContact O-N 3.11Å; I1690-L1693 PolarHBondContact O-N 3.05Å; I1690-L1693 VanDerWaalsContact O-N 3.11Å
1694	Y	93.5	Very high	93.3	Very high	87.6 Å²	87.6	37.7 Å²	37.7	34%	0.344	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	120.2	-169.1	-62.5	-65.7	0	0	0	110	F1639 Y1641 I1690	F1639-Y1694 HydrophobicContact CB-CD1 3.93Å; F1639-Y1694 HydrophobicContact CB-CE1 4.2Å; F1639-Y1694 HydrophobicContact CD2-CD1 4.14Å; F1639-Y1694 AromaticContact CD2-CE1 3.67Å; F1639-Y1694 HydrophobicContact CD2-CE1 3.67Å; F1639-Y1694 HydrophobicContact CE2-CE1 4.28Å; F1639-Y1694 HydrophobicContact CG-CD1 4.26Å; F1639-Y1694 AromaticContact CG-CE1 3.99Å; F1639-Y1694 HydrophobicContact CG-CE1 4.03Å; Y1641-Y1694 HydrophobicContact CE1-CD1 4.4Å; I1690-Y1694 HydrophobicContact CB-CD2 4.41Å; I1690-Y1694 HydrophobicContact CG1-CD2 4.27Å; I1690-Y1694 HydrophobicContact CG2-CD2 4.17Å; I1690-Y1694 WeakPolarHBondContact O-CB 3.19Å; I1690-Y1694 WeakPolarHBondContact O-CD2 3.19Å; I1690-Y1694 PolarHBondContact O-N 3.15Å
1695	H	94.5	Very high	93.7	Very high	13.8 Å²	13.8	37.6 Å²	37.6	6%	0.064	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	135.5	-173.8	-53.5	-77.2	0	0	0	109.7	D1551 F1639 Y1640 Y1641 R1691 L1692 H1783	D1551-H1695 HydrophobicContact CB-CB 4.15Å; F1639-H1695 PolarHBondContact O-N 3.12Å; Y1640-H1695 CarbonylContact C-O 3.56Å; Y1640-H1695 VanDerWaalsContact CA-O 3.23Å; Y1640-H1695 WeakPolarHBondContact CA-O 3.31Å; Y1640-H1695 HydrophobicContact CD1-CB 3.68Å; Y1640-H1695 HydrophobicContact CE1-CB 4Å; Y1640-H1695 AromaticContact CE1-CD2 3.83Å; Y1640-H1695 AromaticContact CE1-CG 4Å; Y1640-H1695 HydrophobicContact CG-CB 4.36Å; Y1641-H1695 VanDerWaalsContact CD1-O 3.27Å; Y1641-H1695 WeakPolarHBondContact CD1-O 3.37Å; Y1641-H1695 WeakPolarHBondContact CE1-O 3.35Å; Y1641-H1695 PolarHBondContact N-O 3.12Å; R1691-H1695 PolarHBondContact O-CE1 3.2Å; L1692-H1695 VanDerWaalsContact C-NE2 3.35Å; L1692-H1695 PolarHBondContact O-NE2 3.03Å; H1695-H1783 AromaticContact CD2-CE1 3.7Å; H1695-H1783 AromaticContact CD2-ND1 3.99Å; H1695-H1783 AromaticContact CE1-CD2 3.84Å; H1695-H1783 AromaticContact CE1-CE1 3.36Å; H1695-H1783 PolarHBondContact CE1-CE1 3.17Å; H1695-H1783 VanDerWaalsContact CE1-CE1 3.43Å; H1695-H1783 AromaticContact CE1-CG 3.54Å; H1695-H1783 VanDerWaalsContact CE1-CG 3.48Å; H1695-H1783 AromaticContact CE1-ND1 3.18Å; H1695-H1783 PolarHBondContact CE1-ND1 3.05Å; H1695-H1783 VanDerWaalsContact CE1-ND1 3.27Å; H1695-H1783 AromaticContact CE1-NE2 3.86Å; H1695-H1783 AromaticContact CG-CE1 3.91Å; H1695-H1783 AromaticContact ND1-CE1 3.86Å; H1695-H1783 AromaticContact ND1-ND1 3.96Å; H1695-H1783 AromaticContact ND1-NE2 4Å; H1695-H1783 AromaticContact NE2-CE1 3.23Å; H1695-H1783 PolarHBondContact NE2-CE1 3.02Å; H1695-H1783 VanDerWaalsContact NE2-CE1 3.31Å; H1695-H1783 AromaticContact NE2-CG 3.95Å; H1695-H1783 AromaticContact NE2-ND1 3.12Å; H1695-H1783 PolarHBondContact NE2-ND1 3.06Å; H1695-H1783 VanDerWaalsContact NE2-ND1 3.15Å
1696	G	93.5	Very high	94.1	Very high	11.4 Å²	11.4	39 Å²	39	12%	0.118	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	122.6	-167.5	177.8	0	0	0	0	0	115.2	M1550 Y1641	M1550-G1696 WeakPolarHBondContact O-CA 3.33Å; M1550-G1696 PolarHBondContact O-N 2.9Å; Y1641-G1696 VanDerWaalsContact CE2-C 3.47Å; Y1641-G1696 VanDerWaalsContact CE2-O 3.3Å; Y1641-G1696 WeakPolarHBondContact CE2-O 3.38Å; Y1641-G1696 CarbonylContact O-C 3.5Å; Y1641-G1696 VanDerWaalsContact O-CA 3.27Å; Y1641-G1696 WeakPolarHBondContact O-CA 3.4Å; Y1641-G1696 PolarHBondContact OH-O 2.99Å
1697	H	94.6	Very high	94.4	Very high	53.2 Å²	53.2	37.3 Å²	37.3	25%	0.246	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	132.6	-168.3	-96.3	-93.7	0	0	0	110.8	Y1641 D1642 L1643 H1732 W1733 E1734	Y1641-H1697 VanDerWaalsContact CD2-O 3.29Å; Y1641-H1697 WeakPolarHBondContact CD2-O 3.25Å; Y1641-H1697 PolarHBondContact O-N 3.05Å; Y1641-H1697 VanDerWaalsContact O-N 3.12Å; D1642-H1697 WeakPolarHBondContact CA-O 3.09Å; D1642-H1697 IonicContact OD1-ND1 3.69Å; D1642-H1697 PolarHBondContact OD1-ND1 2.85Å; L1643-H1697 PolarHBondContact N-O 3.17Å; L1643-H1697 VanDerWaalsContact N-O 3.08Å; H1697-H1732 AromaticContact NE2-ND1 3.72Å; H1697-W1733 WeakPolarHBondContact CA-O 3.23Å; H1697-W1733 PolarHBondContact CD2-O 3.43Å; H1697-E1734 IonicContact CD2-OE1 2.7Å; H1697-E1734 IonicContact ND1-OE1 2.99Å
1698	L	94.9	Very high	94.6	Very high	27.4 Å²	27.4	37.1 Å²	37.1	14%	0.143	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	117.3	172.7	-167.8	81.5	0	0	0	109.4	L1598 Y1641 L1643 F1700 W1733	L1598-L1698 HydrophobicContact CD1-CD1 4.27Å; Y1641-L1698 HydrophobicContact CD2-CD2 3.41Å; Y1641-L1698 VanDerWaalsContact CD2-CD2 3.41Å; Y1641-L1698 HydrophobicContact CD2-CG 4.02Å; Y1641-L1698 HydrophobicContact CE2-CB 3.97Å; Y1641-L1698 HydrophobicContact CE2-CD1 4.11Å; Y1641-L1698 HydrophobicContact CE2-CD2 3.34Å; Y1641-L1698 HydrophobicContact CE2-CG 3.4Å; Y1641-L1698 VanDerWaalsContact CE2-CG 3.4Å; Y1641-L1698 HydrophobicContact CG-CD2 4.34Å; L1643-L1698 HydrophobicContact CB-CD1 3.76Å; L1643-L1698 HydrophobicContact CB-CD2 3.77Å; L1643-L1698 HydrophobicContact CD1-CD2 3.96Å; L1643-L1698 HydrophobicContact CG-CD2 4.26Å; L1643-L1698 WeakPolarHBondContact O-CA 3.34Å; L1698-F1700 HydrophobicContact CB-CD2 4.39Å; L1698-F1700 HydrophobicContact CB-CE2 4.12Å; L1698-F1700 HydrophobicContact CB-CZ 3.82Å; L1698-F1700 HydrophobicContact CD1-CE1 4.28Å; L1698-F1700 HydrophobicContact CD1-CE2 4.37Å; L1698-F1700 HydrophobicContact CD1-CZ 4.04Å; L1698-F1700 HydrophobicContact CD2-CD1 4.19Å; L1698-F1700 HydrophobicContact CD2-CD2 4.49Å; L1698-F1700 HydrophobicContact CD2-CE1 4.17Å; L1698-F1700 HydrophobicContact CD2-CE2 3.42Å; L1698-F1700 VanDerWaalsContact CD2-CE2 3.42Å; L1698-F1700 HydrophobicContact CD2-CZ 3.08Å; L1698-F1700 HydrophobicContact CG-CD1 4.17Å; L1698-F1700 HydrophobicContact CG-CD2 4.09Å; L1698-F1700 HydrophobicContact CG-CE1 4.05Å; L1698-F1700 HydrophobicContact CG-CE2 3.43Å; L1698-F1700 VanDerWaalsContact CG-CE2 3.43Å; L1698-F1700 HydrophobicContact CG-CZ 3.76Å; L1698-F1700 VanDerWaalsContact CG-CZ 3.45Å; L1698-W1733 HydrophobicContact CB-CB 4.21Å; L1698-W1733 HydrophobicContact CB-CE3 4.13Å; L1698-W1733 HydrophobicContact CD2-CE3 4.1Å; L1698-W1733 PolarHBondContact N-O 3.11Å; L1698-W1733 WeakPolarHBondContact O-CB 3.27Å; L1698-W1733 PolarHBondContact O-N 3.06Å
1699	L	96.9	Very high	94.7	Very high	47.2 Å²	47.2	38.6 Å²	38.6	25%	0.247	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	130.6	172.4	-176.9	98.6	0	0	0	109.1	L1643 N1644 A1645 V1730 V1731 H1732	L1643-L1699 PolarHBondContact O-N 3.23Å; N1644-L1699 CarbonylContact C-O 3.53Å; N1644-L1699 VanDerWaalsContact CA-O 3.25Å; N1644-L1699 WeakPolarHBondContact CA-O 3.35Å; N1644-L1699 HydrophobicContact CB-CB 4.45Å; N1644-L1699 VanDerWaalsContact OD1-CB 3.29Å; N1644-L1699 WeakPolarHBondContact OD1-CB 3.41Å; N1644-L1699 VanDerWaalsContact OD1-CD2 3.28Å; N1644-L1699 WeakPolarHBondContact OD1-CD2 3.39Å; A1645-L1699 PolarHBondContact N-O 3.1Å; L1699-V1730 HydrophobicContact CD1-CG1 3.57Å; L1699-V1730 HydrophobicContact CD2-CG1 4.37Å; L1699-V1730 HydrophobicContact CG-CG1 4.44Å; L1699-V1731 CarbonylContact C-O 3.52Å; L1699-V1731 WeakPolarHBondContact CA-O 3.38Å; L1699-H1732 WeakPolarHBondContact CD1-CE1 3.38Å; L1699-H1732 VanDerWaalsContact CD1-ND1 3.34Å; L1699-H1732 WeakPolarHBondContact CD1-ND1 3.32Å
1700	F	94.8	Very high	94.7	Very high	34.2 Å²	34.2	35.3 Å²	35.3	15%	0.15	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	132.5	170.2	-12.2	-90.8	0	0	0	111.4	A1645 L1647 L1698 V1702 M1705 V1730 V1731 W1733	A1645-F1700 HydrophobicContact CB-CB 3.91Å; A1645-F1700 HydrophobicContact CB-CD1 3.81Å; A1645-F1700 HydrophobicContact CB-CE1 4.35Å; A1645-F1700 CarbonylContact O-C 3.56Å; A1645-F1700 VanDerWaalsContact O-CA 3.29Å; A1645-F1700 WeakPolarHBondContact O-CA 3.42Å; A1645-F1700 WeakPolarHBondContact O-CB 3.39Å; L1647-F1700 HydrophobicContact CD1-CB 3.97Å; L1647-F1700 HydrophobicContact CD1-CD1 3.88Å; L1647-F1700 HydrophobicContact CD1-CD2 4.05Å; L1647-F1700 HydrophobicContact CD1-CG 4.39Å; L1698-F1700 HydrophobicContact CB-CD2 4.39Å; L1698-F1700 HydrophobicContact CB-CE2 4.12Å; L1698-F1700 HydrophobicContact CB-CZ 3.82Å; L1698-F1700 HydrophobicContact CD1-CE1 4.28Å; L1698-F1700 HydrophobicContact CD1-CE2 4.37Å; L1698-F1700 HydrophobicContact CD1-CZ 4.04Å; L1698-F1700 HydrophobicContact CD2-CD1 4.19Å; L1698-F1700 HydrophobicContact CD2-CD2 4.49Å; L1698-F1700 HydrophobicContact CD2-CE1 4.17Å; L1698-F1700 HydrophobicContact CD2-CE2 3.42Å; L1698-F1700 VanDerWaalsContact CD2-CE2 3.42Å; L1698-F1700 HydrophobicContact CD2-CZ 3.08Å; L1698-F1700 HydrophobicContact CG-CD1 4.17Å; L1698-F1700 HydrophobicContact CG-CD2 4.09Å; L1698-F1700 HydrophobicContact CG-CE1 4.05Å; L1698-F1700 HydrophobicContact CG-CE2 3.43Å; L1698-F1700 VanDerWaalsContact CG-CE2 3.43Å; L1698-F1700 HydrophobicContact CG-CZ 3.76Å; L1698-F1700 VanDerWaalsContact CG-CZ 3.45Å; F1700-V1702 HydrophobicContact CB-CG2 4.05Å; F1700-V1702 HydrophobicContact CD2-CG2 3.51Å; F1700-V1702 VanDerWaalsContact CD2-CG2 3.48Å; F1700-V1702 HydrophobicContact CE2-CG2 3.84Å; F1700-M1705 HydrophobicContact CE2-SD 4.45Å; F1700-V1730 CarbonylContact O-C 3.56Å; F1700-V1730 VanDerWaalsContact O-CA 3.25Å; F1700-V1730 WeakPolarHBondContact O-CA 3.32Å; F1700-V1731 HydrophobicContact CB-CB 4.14Å; F1700-V1731 HydrophobicContact CD1-CB 3.98Å; F1700-V1731 HydrophobicContact CD1-CG1 4.29Å; F1700-V1731 HydrophobicContact CD2-CB 4.02Å; F1700-V1731 HydrophobicContact CD2-CG1 4.15Å; F1700-V1731 HydrophobicContact CD2-CG2 4.23Å; F1700-V1731 HydrophobicContact CE1-CB 3.58Å; F1700-V1731 HydrophobicContact CE1-CG1 3.52Å; F1700-V1731 HydrophobicContact CE1-CG2 4.32Å; F1700-V1731 HydrophobicContact CE2-CB 3.67Å; F1700-V1731 HydrophobicContact CE2-CG1 4.3Å; F1700-V1731 HydrophobicContact CE2-CG2 3.57Å; F1700-V1731 VanDerWaalsContact CE2-CG2 3.49Å; F1700-V1731 HydrophobicContact CG-CB 4.22Å; F1700-V1731 HydrophobicContact CZ-CB 3.42Å; F1700-V1731 VanDerWaalsContact CZ-CB 3.48Å; F1700-V1731 HydrophobicContact CZ-CG1 3.53Å; F1700-V1731 VanDerWaalsContact CZ-CG1 3.48Å; F1700-V1731 HydrophobicContact CZ-CG2 3.64Å; F1700-V1731 PolarHBondContact N-O 3.1Å; F1700-V1731 PolarHBondContact O-N 2.94Å; F1700-W1733 HydrophobicContact CE2-CB 4.5Å; F1700-W1733 HydrophobicContact CE2-CE3 4.43Å
1701	A	97.4	Very high	94.7	Very high	33.4 Å²	33.4	32.9 Å²	32.9	28%	0.276	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	127.3	167.6	0	0	0	0	0	109	A1645 D1646 L1647 T1729 V1730	A1645-A1701 PolarHBondContact O-N 3.15Å; D1646-A1701 CarbonylContact C-O 3.49Å; D1646-A1701 WeakPolarHBondContact CA-O 3.32Å; L1647-A1701 PolarHBondContact N-O 3.18Å; A1701-T1729 CarbonylContact C-O 3.52Å; A1701-T1729 WeakPolarHBondContact CA-O 3.27Å; A1701-V1730 HydrophobicContact CB-CG2 4.37Å
1702	V	96.7	Very high	94.5	Very high	5 Å²	5	32.7 Å²	32.7	3%	0.03	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	128.7	-173.8	-164.4	0	0	0	0	110.9	L1647 F1650 F1700 T1704 M1705 T1729	L1647-V1702 HydrophobicContact CB-CB 4.49Å; L1647-V1702 HydrophobicContact CB-CG1 4.19Å; L1647-V1702 HydrophobicContact CB-CG2 4.26Å; L1647-V1702 HydrophobicContact CD1-CG2 3.96Å; L1647-V1702 VanDerWaalsContact O-CA 3.28Å; L1647-V1702 WeakPolarHBondContact O-CA 3.3Å; F1650-V1702 HydrophobicContact CB-CG1 3.94Å; F1700-V1702 HydrophobicContact CB-CG2 4.05Å; F1700-V1702 HydrophobicContact CD2-CG2 3.51Å; F1700-V1702 VanDerWaalsContact CD2-CG2 3.48Å; F1700-V1702 HydrophobicContact CE2-CG2 3.84Å; V1702-T1704 VanDerWaalsContact C-N 3.34Å; V1702-T1704 VanDerWaalsContact CG1-O 3.25Å; V1702-T1704 WeakPolarHBondContact CG1-O 3.3Å; V1702-T1704 PolarHBondContact O-N 3.2Å; V1702-M1705 HydrophobicContact CB-CB 4.44Å; V1702-M1705 HydrophobicContact CG1-CB 4.22Å; V1702-T1729 PolarHBondContact N-O 2.9Å; V1702-T1729 PolarHBondContact O-N 2.93Å
1703	D	97.5	Very high	94.2	Very high	98.4 Å²	98.4	37.9 Å²	37.9	53%	0.526	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	-44.5	175.3	-57.7	-34.6	0	0	0	111.4	L1647 K1648 N1727 R1728	L1647-D1703 PolarHBondContact O-N 3.15Å; L1647-D1703 VanDerWaalsContact O-N 3.12Å; K1648-D1703 WeakPolarHBondContact O-CB 3.44Å; D1703-N1727 CarbonylContact O-C 3.52Å; D1703-N1727 WeakPolarHBondContact O-CA 3.34Å; D1703-R1728 PolarHBondContact O-N 3.1Å
1704	T	97	Very high	94	Very high	43.8 Å²	43.8	38.7 Å²	38.7	27%	0.269	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	125.5	178.9	56.6	0	0	0	0	112.4	K1648 S1649 F1650 V1702 W1726	K1648-T1704 PolarHBondContact O-N 3.03Å; K1648-T1704 VanDerWaalsContact O-N 3.14Å; K1648-T1704 PolarHBondContact O-OG1 2.93Å; K1648-T1704 VanDerWaalsContact O-OG1 3.08Å; S1649-T1704 CarbonylContact C-O 3.58Å; S1649-T1704 VanDerWaalsContact CA-O 3.28Å; S1649-T1704 WeakPolarHBondContact CA-O 3.3Å; S1649-T1704 WeakPolarHBondContact CB-OG1 3.22Å; F1650-T1704 PolarHBondContact N-O 2.94Å; V1702-T1704 VanDerWaalsContact C-N 3.34Å; V1702-T1704 VanDerWaalsContact CG1-O 3.25Å; V1702-T1704 WeakPolarHBondContact CG1-O 3.3Å; V1702-T1704 PolarHBondContact O-N 3.2Å; T1704-W1726 CarbonylContact C-O 3.52Å; T1704-W1726 WeakPolarHBondContact CA-O 3.44Å
1705	M	96.7	Very high	93.7	Very high	15 Å²	15	35.8 Å²	35.8	7%	0.074	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	119.2	178.1	174.8	176.4	112.2	0	0	110.8	F1650 F1700 V1702 W1707 Q1725 W1726 T1729 V1731 I1740	F1650-M1705 HydrophobicContact CB-CB 4.32Å; F1650-M1705 HydrophobicContact CB-CG 4.24Å; F1650-M1705 HydrophobicContact CD1-CE 4.21Å; F1650-M1705 HydrophobicContact CD1-CG 3.94Å; F1650-M1705 HydrophobicContact CD1-SD 4.28Å; F1650-M1705 HydrophobicContact CE1-CE 4.19Å; F1650-M1705 HydrophobicContact CG-CG 4.37Å; F1650-M1705 CarbonylContact O-C 3.55Å; F1650-M1705 VanDerWaalsContact O-CA 3.25Å; F1650-M1705 WeakPolarHBondContact O-CA 3.38Å; F1700-M1705 HydrophobicContact CE2-SD 4.45Å; V1702-M1705 HydrophobicContact CB-CB 4.44Å; V1702-M1705 HydrophobicContact CG1-CB 4.22Å; M1705-W1707 HydrophobicContact CE-CH2 4.36Å; M1705-W1707 HydrophobicContact CE-CZ2 3.61Å; M1705-W1707 VanDerWaalsContact CG-NE1 3.34Å; M1705-W1707 HydrophobicContact SD-CZ2 4.01Å; M1705-W1707 PolarHBondContact SD-NE1 3.12Å; M1705-W1707 VanDerWaalsContact SD-NE1 3.41Å; M1705-Q1725 CarbonylContact O-C 3.47Å; M1705-Q1725 WeakPolarHBondContact O-CA 3.39Å; M1705-W1726 HydrophobicContact CB-CB 4.13Å; M1705-W1726 HydrophobicContact CE-CB 4.05Å; M1705-W1726 VanDerWaalsContact CE-CD1 3.45Å; M1705-W1726 HydrophobicContact CE-CD2 4.47Å; M1705-W1726 HydrophobicContact CE-CG 3.79Å; M1705-W1726 HydrophobicContact CG-CB 4.45Å; M1705-W1726 PolarHBondContact N-O 3.13Å; M1705-W1726 WeakPolarHBondContact O-CB 3.14Å; M1705-W1726 PolarHBondContact O-N 2.9Å; M1705-T1729 HydrophobicContact CE-CG2 4.22Å; M1705-V1731 HydrophobicContact CE-CG2 4.37Å; M1705-V1731 HydrophobicContact SD-CG2 4.39Å; M1705-I1740 HydrophobicContact CE-CG2 4.38Å
1706	H	95.7	Very high	93.4	Very high	31.8 Å²	31.8	39.3 Å²	39.3	15%	0.147	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	128	-178.7	-61.4	-148.3	0	0	0	111	F1650 H1651 I1652 T1723 W1724 Q1725	F1650-H1706 PolarHBondContact O-N 3.03Å; H1651-H1706 WeakPolarHBondContact CA-O 3.35Å; H1651-H1706 AromaticContact CE1-CD2 3.59Å; H1651-H1706 PolarHBondContact CE1-CD2 3.2Å; H1651-H1706 AromaticContact CE1-CE1 3.79Å; H1651-H1706 AromaticContact CE1-CG 3.6Å; H1651-H1706 AromaticContact CE1-ND1 3.65Å; H1651-H1706 PolarHBondContact CE1-ND1 3.16Å; H1651-H1706 AromaticContact CE1-NE2 3.82Å; H1651-H1706 VanDerWaalsContact ND1-CB 3.34Å; H1651-H1706 WeakPolarHBondContact ND1-CB 3.37Å; H1651-H1706 AromaticContact ND1-CD2 3.75Å; H1651-H1706 PolarHBondContact ND1-CD2 3.39Å; H1651-H1706 VanDerWaalsContact ND1-CD2 3.34Å; H1651-H1706 AromaticContact ND1-CG 3.35Å; H1651-H1706 AromaticContact ND1-ND1 3.59Å; H1651-H1706 PolarHBondContact ND1-ND1 2.95Å; I1652-H1706 PolarHBondContact N-O 3.1Å; H1706-T1723 HydrophobicContact CB-CG2 4.14Å; H1706-W1724 CarbonylContact C-O 3.48Å; H1706-W1724 WeakPolarHBondContact CA-O 3.44Å; H1706-Q1725 PolarHBondContact CE1-OE1 3.35Å
1707	W	94.9	Very high	93.1	Very high	89.4 Å²	89.4	40.3 Å²	40.3	34%	0.339	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	105.8	167.9	-97.3	2.7	0	0	0	109.4	M1705 T1723 W1724 I1740	M1705-W1707 HydrophobicContact CE-CH2 4.36Å; M1705-W1707 HydrophobicContact CE-CZ2 3.61Å; M1705-W1707 VanDerWaalsContact CG-NE1 3.34Å; M1705-W1707 HydrophobicContact SD-CZ2 4.01Å; M1705-W1707 PolarHBondContact SD-NE1 3.12Å; M1705-W1707 VanDerWaalsContact SD-NE1 3.41Å; W1707-T1723 CarbonylContact O-C 3.54Å; W1707-T1723 VanDerWaalsContact O-CA 3.31Å; W1707-T1723 WeakPolarHBondContact O-CA 3.34Å; W1707-W1724 HydrophobicContact CB-CB 4.37Å; W1707-W1724 HydrophobicContact CE3-CD2 4.34Å; W1707-W1724 HydrophobicContact CE3-CG 4.36Å; W1707-W1724 PolarHBondContact N-O 3.18Å; W1707-W1724 PolarHBondContact O-N 3.03Å; W1707-I1740 HydrophobicContact CH2-CD1 3.66Å; W1707-I1740 HydrophobicContact CZ2-CD1 4.18Å; W1707-I1740 HydrophobicContact CZ3-CD1 4.45Å
1708	S	94.8	Very high	92.6	Very high	4 Å²	4	39.4 Å²	39.4	3%	0.028	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	115	-174	-63.7	0	0	0	0	111.4	I1652 Y1653 Y1654 T1723	I1652-S1708 PolarHBondContact O-N 3.36Å; Y1653-S1708 WeakPolarHBondContact CA-O 3.33Å; Y1653-S1708 VanDerWaalsContact CD1-CB 3.47Å; Y1654-S1708 PolarHBondContact N-O 3.07Å; Y1654-S1708 VanDerWaalsContact N-O 3.1Å; S1708-T1723 WeakPolarHBondContact CB-OG1 3.28Å; S1708-T1723 VanDerWaalsContact OG-CG2 3.27Å; S1708-T1723 WeakPolarHBondContact OG-CG2 3.41Å; S1708-T1723 PolarHBondContact OG-OG1 3.1Å
1709	Y	94	Very high	92	Very high	32.6 Å²	32.6	41.1 Å²	41.1	13%	0.128	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	124.7	172.3	-171.2	-94.3	0	0	0	111.2	Y1654 A1656 T1711 F1721 F1722 L1850 C1853 L1854	Y1654-Y1709 HydrophobicContact CD1-CD2 4.42Å; Y1654-Y1709 HydrophobicContact CD1-CE2 4.37Å; Y1654-Y1709 CarbonylContact O-C 3.52Å; Y1654-Y1709 VanDerWaalsContact O-CA 3.24Å; Y1654-Y1709 WeakPolarHBondContact O-CA 3.3Å; A1656-Y1709 PolarHBondContact N-OH 2.98Å; Y1709-T1711 HydrophobicContact CD1-CG2 4.43Å; Y1709-T1711 PolarHBondContact O-N 3.14Å; Y1709-F1721 CarbonylContact O-C 3.59Å; Y1709-F1721 WeakPolarHBondContact O-CA 3.25Å; Y1709-F1722 PolarHBondContact N-O 3.06Å; Y1709-F1722 PolarHBondContact O-N 3.15Å; Y1709-L1850 HydrophobicContact CD1-CD1 3.55Å; Y1709-L1850 HydrophobicContact CE1-CD1 3.83Å; Y1709-L1850 HydrophobicContact CG-CD1 4.44Å; Y1709-C1853 HydrophobicContact CE1-CB 4.06Å; Y1709-L1854 HydrophobicContact CE1-CD2 3.98Å; Y1709-L1854 HydrophobicContact CE1-CG 4.23Å; Y1709-L1854 HydrophobicContact CE2-CD2 3.87Å; Y1709-L1854 VanDerWaalsContact CZ-CD2 3.5Å
1710	S	92.3	Very high	91.6	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.007	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	124.1	176.8	-174.2	0	0	0	0	110.9	Y1654 N1657 S1712	Y1654-S1710 PolarHBondContact O-N 3.15Å; N1657-S1710 WeakPolarHBondContact ND2-CB 3.06Å; N1657-S1710 PolarHBondContact ND2-OG 3.19Å; S1710-S1712 VanDerWaalsContact C-N 3.32Å; S1710-S1712 PolarHBondContact OG-N 3.1Å; S1710-S1712 PolarHBondContact OG-O 3.16Å
1711	T	89.9	Confident	91.4	Very high	3 Å²	3	38.7 Å²	38.7	2%	0.018	21%	0.21	C	C	.	.			trans	-97.6	17.2	176.8	60	0	0	0	0	112.5	Y1709 E1720 F1722 Y1748 F1846 K1849 L1850 C1853	Y1709-T1711 HydrophobicContact CD1-CG2 4.43Å; Y1709-T1711 PolarHBondContact O-N 3.14Å; T1711-E1720 WeakPolarHBondContact CB-O 3.35Å; T1711-E1720 PolarHBondContact N-O 3.08Å; T1711-E1720 VanDerWaalsContact N-O 3.09Å; T1711-E1720 VanDerWaalsContact OG1-C 3.26Å; T1711-E1720 WeakPolarHBondContact OG1-CB 3.42Å; T1711-E1720 PolarHBondContact OG1-O 3.1Å; T1711-E1720 VanDerWaalsContact OG1-O 3.14Å; T1711-F1722 HydrophobicContact CG2-CB 3.89Å; T1711-Y1748 WeakPolarHBondContact CB-OH 3.49Å; T1711-Y1748 HydrophobicContact CG2-CD2 4.32Å; T1711-Y1748 HydrophobicContact CG2-CE2 4Å; T1711-Y1748 PolarHBondContact OG1-OH 3.1Å; T1711-F1846 HydrophobicContact CG2-CD2 4.39Å; T1711-F1846 HydrophobicContact CG2-CE2 3.76Å; T1711-K1849 WeakPolarHBondContact O-CE 3.33Å; T1711-K1849 WeakPolarHBondContact O-CG 3.33Å; T1711-L1850 HydrophobicContact CG2-CB 4.23Å; T1711-L1850 HydrophobicContact CG2-CD1 3.89Å; T1711-L1850 HydrophobicContact CG2-CG 4.46Å; T1711-C1853 VanDerWaalsContact C-SG 3.54Å; T1711-C1853 PolarHBondContact O-SG 2.99Å; T1711-C1853 VanDerWaalsContact O-SG 3.36Å
1712	S	88.9	Confident	91.2	Very high	16.4 Å²	16.4	39.1 Å²	39.1	12%	0.115	21%	0.206	C	C	.	.	S	Bend	trans	-118.3	147.8	178.9	-165.4	0	0	0	0	111.3	N1657 S1710 S1714 N1717 E1720	N1657-S1712 WeakPolarHBondContact CB-O 3.26Å; N1657-S1712 PolarHBondContact ND2-O 3.08Å; N1657-S1712 VanDerWaalsContact ND2-O 3.11Å; S1710-S1712 VanDerWaalsContact C-N 3.32Å; S1710-S1712 PolarHBondContact OG-N 3.1Å; S1710-S1712 PolarHBondContact OG-O 3.16Å; S1712-S1714 VanDerWaalsContact C-N 3.32Å; S1712-S1714 PolarHBondContact OG-N 3.09Å; S1712-S1714 VanDerWaalsContact OG-N 3.13Å; S1712-S1714 PolarHBondContact OG-O 3.1Å; S1712-S1714 VanDerWaalsContact OG-O 3.11Å; S1712-N1717 VanDerWaalsContact CB-ND2 3.26Å; S1712-N1717 WeakPolarHBondContact CB-ND2 3.41Å; S1712-N1717 WeakPolarHBondContact OG-CB 3.4Å; S1712-N1717 PolarHBondContact OG-ND2 2.97Å; S1712-E1720 VanDerWaalsContact CB-OE2 3.25Å; S1712-E1720 WeakPolarHBondContact CB-OE2 3.45Å; S1712-E1720 PolarHBondContact OG-OE2 3.17Å
1713	L	86.1	Confident	91.1	Very high	110.6 Å²	110.6	39.1 Å²	39.1	58%	0.579	21%	0.206	S	C	*	.	S	Bend	trans	-79.7	-18.7	174.5	-62.3	179.4	0	0	0	112.9	N1657	N1657-L1713 VanDerWaalsContact CB-O 3.27Å; N1657-L1713 WeakPolarHBondContact CB-O 3.44Å
1714	S	88.7	Confident	91	Very high	54.4 Å²	54.4	37.3 Å²	37.3	38%	0.38	19%	0.192	S	C	.	.	S	Bend	trans	-85.2	128.3	174.1	178.5	0	0	0	0	110.3	N1657 S1712 Y1716 N1717	N1657-S1714 PolarHBondContact ND2-O 3.22Å; N1657-S1714 VanDerWaalsContact ND2-O 3.07Å; S1712-S1714 VanDerWaalsContact C-N 3.32Å; S1712-S1714 PolarHBondContact OG-N 3.09Å; S1712-S1714 VanDerWaalsContact OG-N 3.13Å; S1712-S1714 PolarHBondContact OG-O 3.1Å; S1712-S1714 VanDerWaalsContact OG-O 3.11Å; S1714-Y1716 VanDerWaalsContact C-N 3.28Å; S1714-Y1716 PolarHBondContact O-N 3.2Å; S1714-Y1716 PolarHBondContact OG-N 3.3Å; S1714-N1717 PolarHBondContact O-N 3.43Å
1715	P	88.2	Confident	91	Very high	25 Å²	25	37.7 Å²	37.7	16%	0.162	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-21.6	176.1	29.3	-35.2	0	0	0	113.2	Y1586 N1657 W1658 N1717	Y1586-P1715 HydrophobicContact CD1-CB 4.07Å; Y1586-P1715 HydrophobicContact CD1-CG 4.44Å; Y1586-P1715 HydrophobicContact CD2-CB 4.2Å; Y1586-P1715 HydrophobicContact CE1-CB 3.65Å; Y1586-P1715 HydrophobicContact CE1-CG 3.79Å; Y1586-P1715 HydrophobicContact CE2-CB 3.8Å; Y1586-P1715 HydrophobicContact CG-CB 4.27Å; Y1586-P1715 VanDerWaalsContact CZ-CB 3.46Å; N1657-P1715 HydrophobicContact CB-CB 4.44Å; N1657-P1715 WeakPolarHBondContact ND2-CA 3.38Å; W1658-P1715 PolarHBondContact NE1-O 3.15Å; P1715-N1717 VanDerWaalsContact C-N 3.33Å; P1715-N1717 PolarHBondContact O-N 3.26Å
1716	Y	88.5	Confident	91	Very high	87.4 Å²	87.4	37.1 Å²	37.1	34%	0.343	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-0.5	179.8	-64	-78.7	0	0	0	113.7	D1585 Y1586 S1714 A1718	D1585-Y1716 VanDerWaalsContact OD1-CE1 3.31Å; D1585-Y1716 WeakPolarHBondContact OD1-CE1 3.37Å; D1585-Y1716 PolarHBondContact OD1-OH 3.04Å; D1585-Y1716 WeakPolarHBondContact OD2-CE1 3.17Å; D1585-Y1716 PolarHBondContact OD2-OH 2.95Å; Y1586-Y1716 HydrophobicContact CD1-CD1 4.27Å; Y1586-Y1716 AromaticContact CD1-CE1 3.81Å; Y1586-Y1716 HydrophobicContact CD1-CE1 3.81Å; Y1586-Y1716 HydrophobicContact CD1-CE2 4.41Å; Y1586-Y1716 AromaticContact CD1-CZ 3.91Å; Y1586-Y1716 AromaticContact CE1-CE1 3.91Å; Y1586-Y1716 HydrophobicContact CE1-CE1 4.21Å; Y1586-Y1716 HydrophobicContact CE1-CE2 4.19Å; Y1586-Y1716 AromaticContact CE1-CZ 3.86Å; S1714-Y1716 VanDerWaalsContact C-N 3.28Å; S1714-Y1716 PolarHBondContact O-N 3.2Å; S1714-Y1716 PolarHBondContact OG-N 3.3Å; Y1716-A1718 PolarHBondContact O-N 3.14Å
1717	N	86.4	Confident	90.9	Very high	33.8 Å²	33.8	37 Å²	37	18%	0.181	19%	0.188	C	C	.	.			trans	-77.7	111	176	-171.5	-17	0	0	0	110.5	S1712 S1714 P1715 T1719 E1720	S1712-N1717 VanDerWaalsContact CB-ND2 3.26Å; S1712-N1717 WeakPolarHBondContact CB-ND2 3.41Å; S1712-N1717 WeakPolarHBondContact OG-CB 3.4Å; S1712-N1717 PolarHBondContact OG-ND2 2.97Å; S1714-N1717 PolarHBondContact O-N 3.43Å; P1715-N1717 VanDerWaalsContact C-N 3.33Å; P1715-N1717 PolarHBondContact O-N 3.26Å; N1717-T1719 VanDerWaalsContact C-N 3.34Å; N1717-T1719 PolarHBondContact OD1-N 3.15Å; N1717-T1719 PolarHBondContact OD1-OG1 3.03Å; N1717-E1720 VanDerWaalsContact ND2-CD 3.29Å; N1717-E1720 WeakPolarHBondContact ND2-CG 3.28Å; N1717-E1720 PolarHBondContact ND2-OE2 3.11Å; N1717-E1720 PolarHBondContact OD1-N 2.98Å
1718	A	83.8	Confident	90.9	Very high	34.4 Å²	34.4	40.8 Å²	40.8	28%	0.284	20%	0.202	S	C	.	.			trans	-93.4	2.7	179.7	0	0	0	0	0	114.4	P1587 K1588 Y1716 F1721	P1587-A1718 HydrophobicContact CB-CB 4.04Å; P1587-A1718 HydrophobicContact CG-CB 3.93Å; K1588-A1718 HydrophobicContact CG-CB 4.4Å; Y1716-A1718 PolarHBondContact O-N 3.14Å; A1718-F1721 VanDerWaalsContact C-CE2 3.5Å; A1718-F1721 WeakPolarHBondContact O-CE2 3.29Å
1719	T	83	Confident	90.9	Very high	61.8 Å²	61.8	40.6 Å²	40.6	38%	0.379	20%	0.201	S	C	.	.	S	Bend	trans	-113.9	-17.9	-168.1	64.2	0	0	0	0	115	N1717 Q1749 T1750 A1751	N1717-T1719 VanDerWaalsContact C-N 3.34Å; N1717-T1719 PolarHBondContact OD1-N 3.15Å; N1717-T1719 PolarHBondContact OD1-OG1 3.03Å; T1719-Q1749 CarbonylContact O-C 3.52Å; T1719-Q1749 VanDerWaalsContact O-C 3.25Å; T1719-Q1749 WeakPolarHBondContact O-CG 3.39Å; T1719-T1750 WeakPolarHBondContact O-CA 3.33Å; T1719-T1750 PolarHBondContact O-N 3.12Å; T1719-A1751 HydrophobicContact CG2-CB 4.37Å
1720	E	87.8	Confident	91	Very high	29.2 Å²	29.2	41.4 Å²	41.4	14%	0.136	21%	0.209	C	C	.	.			trans	-112	90	-173	-65.8	-163.1	144.9	0	0	112.4	T1711 S1712 N1717 Y1748 Q1749 K1849	T1711-E1720 WeakPolarHBondContact CB-O 3.35Å; T1711-E1720 PolarHBondContact N-O 3.08Å; T1711-E1720 VanDerWaalsContact N-O 3.09Å; T1711-E1720 VanDerWaalsContact OG1-C 3.26Å; T1711-E1720 WeakPolarHBondContact OG1-CB 3.42Å; T1711-E1720 PolarHBondContact OG1-O 3.1Å; T1711-E1720 VanDerWaalsContact OG1-O 3.14Å; S1712-E1720 VanDerWaalsContact CB-OE2 3.25Å; S1712-E1720 WeakPolarHBondContact CB-OE2 3.45Å; S1712-E1720 PolarHBondContact OG-OE2 3.17Å; N1717-E1720 VanDerWaalsContact ND2-CD 3.29Å; N1717-E1720 WeakPolarHBondContact ND2-CG 3.28Å; N1717-E1720 PolarHBondContact ND2-OE2 3.11Å; N1717-E1720 PolarHBondContact OD1-N 2.98Å; E1720-Y1748 PolarHBondContact OE2-OH 2.91Å; E1720-Q1749 WeakPolarHBondContact CA-O 3.35Å; E1720-K1849 IonicContact OE1-NZ 3.47Å; E1720-K1849 PolarHBondContact OE1-NZ 3.21Å; E1720-K1849 VanDerWaalsContact OE2-CE 3.31Å; E1720-K1849 WeakPolarHBondContact OE2-CE 3.2Å; E1720-K1849 IonicContact OE2-NZ 3.16Å; E1720-K1849 PolarHBondContact OE2-NZ 3.03Å
1721	F	91.3	Very high	91.2	Very high	3 Å²	3	41.8 Å²	41.8	1%	0.013	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	138.7	-178.2	-69.3	-82	0	0	0	112.8	K1588 Y1653 Y1709 A1718 Y1748 Q1749	K1588-F1721 HydrophobicContact CG-CE2 4.15Å; K1588-F1721 HydrophobicContact CG-CZ 3.96Å; Y1653-F1721 HydrophobicContact CD1-CD1 4.28Å; Y1653-F1721 AromaticContact CD1-CE1 3.83Å; Y1653-F1721 HydrophobicContact CD1-CE1 3.98Å; Y1653-F1721 HydrophobicContact CD1-CZ 4.25Å; Y1709-F1721 CarbonylContact O-C 3.59Å; Y1709-F1721 WeakPolarHBondContact O-CA 3.25Å; A1718-F1721 VanDerWaalsContact C-CE2 3.5Å; A1718-F1721 WeakPolarHBondContact O-CE2 3.29Å; F1721-Y1748 WeakPolarHBondContact O-CD2 3.25Å; F1721-Q1749 HydrophobicContact CB-CB 4.4Å; F1721-Q1749 PolarHBondContact N-O 3.17Å; F1721-Q1749 VanDerWaalsContact N-O 3.1Å; F1721-Q1749 PolarHBondContact O-N 3.12Å
1722	F	93.5	Very high	91.5	Very high	41.2 Å²	41.2	43.7 Å²	43.7	18%	0.181	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	114.1	164.4	176.7	-117.4	0	0	0	108.4	Y1709 T1711 W1724 I1746 Y1748 L1760 F1846 L1850	Y1709-F1722 PolarHBondContact N-O 3.06Å; Y1709-F1722 PolarHBondContact O-N 3.15Å; T1711-F1722 HydrophobicContact CG2-CB 3.89Å; F1722-W1724 AromaticContact CE1-CD1 3.88Å; F1722-W1724 AromaticContact CE1-NE1 3.27Å; F1722-W1724 VanDerWaalsContact CE1-NE1 3.3Å; F1722-W1724 AromaticContact CZ-NE1 3.56Å; F1722-I1746 HydrophobicContact CD2-CG2 4.43Å; F1722-I1746 HydrophobicContact CE2-CG2 3.44Å; F1722-I1746 VanDerWaalsContact CE2-CG2 3.45Å; F1722-I1746 HydrophobicContact CZ-CG2 3.71Å; F1722-Y1748 HydrophobicContact CB-CD2 4.22Å; F1722-Y1748 HydrophobicContact CB-CE2 4.35Å; F1722-Y1748 HydrophobicContact CD2-CD2 4.19Å; F1722-L1760 HydrophobicContact CE2-CD1 4.3Å; F1722-F1846 HydrophobicContact CB-CE2 4.02Å; F1722-F1846 HydrophobicContact CB-CZ 3.9Å; F1722-F1846 HydrophobicContact CD2-CE1 4.11Å; F1722-F1846 HydrophobicContact CD2-CE2 4.35Å; F1722-F1846 AromaticContact CD2-CZ 3.43Å; F1722-F1846 HydrophobicContact CD2-CZ 3.43Å; F1722-F1846 VanDerWaalsContact CD2-CZ 3.43Å; F1722-F1846 HydrophobicContact CE2-CE1 4.37Å; F1722-F1846 HydrophobicContact CE2-CZ 4.05Å; F1722-F1846 HydrophobicContact CG-CE2 4.37Å; F1722-F1846 AromaticContact CG-CZ 3.76Å; F1722-F1846 HydrophobicContact CG-CZ 3.76Å; F1722-L1850 HydrophobicContact CB-CD1 4.46Å; F1722-L1850 HydrophobicContact CD1-CD1 4.37Å; F1722-L1850 HydrophobicContact CD1-CD2 4.2Å; F1722-L1850 HydrophobicContact CE1-CD2 4.4Å; F1722-L1850 HydrophobicContact CG-CD2 4.37Å
1723	T	94	Very high	91.8	Very high	5.2 Å²	5.2	47.1 Å²	47.1	3%	0.032	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	132	-167	-57.7	0	0	0	0	111.3	H1706 W1707 S1708 Q1725 V1747	H1706-T1723 HydrophobicContact CB-CG2 4.14Å; W1707-T1723 CarbonylContact O-C 3.54Å; W1707-T1723 VanDerWaalsContact O-CA 3.31Å; W1707-T1723 WeakPolarHBondContact O-CA 3.34Å; S1708-T1723 WeakPolarHBondContact CB-OG1 3.28Å; S1708-T1723 VanDerWaalsContact OG-CG2 3.27Å; S1708-T1723 WeakPolarHBondContact OG-CG2 3.41Å; S1708-T1723 PolarHBondContact OG-OG1 3.1Å; T1723-Q1725 HydrophobicContact CG2-CB 4.47Å; T1723-V1747 PolarHBondContact N-O 3.1Å; T1723-V1747 PolarHBondContact O-N 3.02Å
1724	W	96	Very high	92	Very high	61 Å²	61	45.9 Å²	45.9	23%	0.231	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	111.9	165	-67.5	39	0	0	0	106.4	H1706 W1707 F1722 L1744 I1746 M1768 F1819	H1706-W1724 CarbonylContact C-O 3.48Å; H1706-W1724 WeakPolarHBondContact CA-O 3.44Å; W1707-W1724 HydrophobicContact CB-CB 4.37Å; W1707-W1724 HydrophobicContact CE3-CD2 4.34Å; W1707-W1724 HydrophobicContact CE3-CG 4.36Å; W1707-W1724 PolarHBondContact N-O 3.18Å; W1707-W1724 PolarHBondContact O-N 3.03Å; F1722-W1724 AromaticContact CE1-CD1 3.88Å; F1722-W1724 AromaticContact CE1-NE1 3.27Å; F1722-W1724 VanDerWaalsContact CE1-NE1 3.3Å; F1722-W1724 AromaticContact CZ-NE1 3.56Å; W1724-L1744 HydrophobicContact CB-CD1 4.23Å; W1724-L1744 HydrophobicContact CE3-CD1 4.28Å; W1724-L1744 HydrophobicContact CE3-CD2 4.34Å; W1724-L1744 HydrophobicContact CZ3-CD2 4.13Å; W1724-I1746 HydrophobicContact CD2-CD1 4.29Å; W1724-I1746 HydrophobicContact CD2-CG1 4.31Å; W1724-I1746 HydrophobicContact CG-CG1 4.36Å; W1724-I1746 HydrophobicContact CZ2-CD1 4.2Å; W1724-M1768 HydrophobicContact CZ3-CE 4.49Å; W1724-M1768 HydrophobicContact CZ3-SD 4.36Å; W1724-F1819 HydrophobicContact CH2-CZ 4.48Å
1725	Q	95.9	Very high	92	Very high	50.8 Å²	50.8	45.7 Å²	45.7	24%	0.237	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	118.8	179	169.1	175.5	-12.4	0	0	108.3	M1705 H1706 T1723 N1727 L1744 D1745	M1705-Q1725 CarbonylContact O-C 3.47Å; M1705-Q1725 WeakPolarHBondContact O-CA 3.39Å; H1706-Q1725 PolarHBondContact CE1-OE1 3.35Å; T1723-Q1725 HydrophobicContact CG2-CB 4.47Å; Q1725-N1727 PolarHBondContact NE2-OD1 3.14Å; Q1725-N1727 VanDerWaalsContact NE2-OD1 3.16Å; Q1725-L1744 WeakPolarHBondContact O-CA 3.34Å; Q1725-D1745 HydrophobicContact CB-CB 4.2Å; Q1725-D1745 HydrophobicContact CG-CB 4.48Å; Q1725-D1745 PolarHBondContact N-O 3.03Å; Q1725-D1745 PolarHBondContact O-N 3.11Å
1726	W	96.5	Very high	92.1	Very high	3.2 Å²	3.2	45.3 Å²	45.3	1%	0.012	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	131.8	175.3	-71	93	0	0	0	108.9	T1704 M1705 T1729 I1740 D1743 L1744 L1766 M1768	T1704-W1726 CarbonylContact C-O 3.52Å; T1704-W1726 WeakPolarHBondContact CA-O 3.44Å; M1705-W1726 HydrophobicContact CB-CB 4.13Å; M1705-W1726 HydrophobicContact CE-CB 4.05Å; M1705-W1726 VanDerWaalsContact CE-CD1 3.45Å; M1705-W1726 HydrophobicContact CE-CD2 4.47Å; M1705-W1726 HydrophobicContact CE-CG 3.79Å; M1705-W1726 HydrophobicContact CG-CB 4.45Å; M1705-W1726 PolarHBondContact N-O 3.13Å; M1705-W1726 WeakPolarHBondContact O-CB 3.14Å; M1705-W1726 PolarHBondContact O-N 2.9Å; W1726-T1729 HydrophobicContact CB-CG2 4.12Å; W1726-T1729 VanDerWaalsContact CB-OG1 3.29Å; W1726-T1729 WeakPolarHBondContact CB-OG1 3.24Å; W1726-T1729 HydrophobicContact CD2-CG2 4.41Å; W1726-T1729 HydrophobicContact CE3-CG2 4.23Å; W1726-T1729 HydrophobicContact CG-CG2 4.43Å; W1726-I1740 HydrophobicContact CD2-CG2 3.93Å; W1726-I1740 HydrophobicContact CE3-CG2 3.85Å; W1726-I1740 HydrophobicContact CH2-CB 4.42Å; W1726-I1740 HydrophobicContact CH2-CG2 3.86Å; W1726-I1740 HydrophobicContact CZ2-CB 4.45Å; W1726-I1740 HydrophobicContact CZ2-CD1 4.48Å; W1726-I1740 HydrophobicContact CZ2-CG2 3.94Å; W1726-I1740 HydrophobicContact CZ3-CB 4.48Å; W1726-I1740 HydrophobicContact CZ3-CG2 3.81Å; W1726-D1743 CarbonylContact C-O 3.49Å; W1726-D1743 VanDerWaalsContact CA-O 3.27Å; W1726-D1743 WeakPolarHBondContact CA-O 3.35Å; W1726-L1744 HydrophobicContact CD2-CB 4.16Å; W1726-L1744 HydrophobicContact CD2-CD1 3.97Å; W1726-L1744 HydrophobicContact CE3-CB 3.92Å; W1726-L1744 HydrophobicContact CG-CD1 4.22Å; W1726-L1744 HydrophobicContact CH2-CB 4.03Å; W1726-L1744 HydrophobicContact CH2-CD2 4.13Å; W1726-L1744 HydrophobicContact CH2-CG 4.48Å; W1726-L1744 HydrophobicContact CZ2-CB 4.25Å; W1726-L1744 HydrophobicContact CZ2-CD1 4.08Å; W1726-L1744 HydrophobicContact CZ2-CD2 3.87Å; W1726-L1744 HydrophobicContact CZ2-CG 4.28Å; W1726-L1744 HydrophobicContact CZ3-CB 3.87Å; W1726-L1766 HydrophobicContact CH2-CB 4.42Å; W1726-L1766 HydrophobicContact CH2-CD2 3.65Å; W1726-L1766 HydrophobicContact CH2-CG 4.05Å; W1726-L1766 HydrophobicContact CZ2-CD2 4.43Å; W1726-L1766 HydrophobicContact CZ3-CB 4.22Å; W1726-L1766 HydrophobicContact CZ3-CD2 4.12Å; W1726-L1766 HydrophobicContact CZ3-CG 4.3Å; W1726-M1768 HydrophobicContact CH2-CB 3.87Å; W1726-M1768 HydrophobicContact CH2-SD 4.21Å; W1726-M1768 HydrophobicContact CZ2-CB 4.3Å; W1726-M1768 HydrophobicContact CZ2-SD 3.89Å
1727	N	94.8	Very high	92.4	Very high	29 Å²	29	43.2 Å²	43.2	16%	0.155	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	147.1	176.7	-52.6	-56.1	0	0	0	109.9	D1703 Q1725 T1729 D1743 D1745	D1703-N1727 CarbonylContact O-C 3.52Å; D1703-N1727 WeakPolarHBondContact O-CA 3.34Å; Q1725-N1727 PolarHBondContact NE2-OD1 3.14Å; Q1725-N1727 VanDerWaalsContact NE2-OD1 3.16Å; N1727-T1729 VanDerWaalsContact C-N 3.33Å; N1727-T1729 VanDerWaalsContact C-OG1 3.3Å; N1727-T1729 PolarHBondContact N-OG1 2.91Å; N1727-T1729 PolarHBondContact O-N 3.08Å; N1727-T1729 PolarHBondContact O-OG1 3.05Å; N1727-T1729 VanDerWaalsContact O-OG1 3.1Å; N1727-D1743 HydrophobicContact CB-CB 4.45Å; N1727-D1743 PolarHBondContact N-O 2.97Å; N1727-D1743 PolarHBondContact O-N 3.1Å; N1727-D1743 VanDerWaalsContact O-N 3.08Å; N1727-D1745 PolarHBondContact ND2-OD2 3.15Å; N1727-D1745 VanDerWaalsContact ND2-OD2 3.11Å
1728	R	93.7	Very high	92.8	Very high	169.6 Å²	169.6	43.1 Å²	43.1	64%	0.64	21%	0.212	S	C	*	.	E	Extended strand (participates in β ladder)	trans	47.1	54.2	-179.6	-61.4	-175.7	-63.9	-85.5	4.9	112.3	D1703 D1743	D1703-R1728 PolarHBondContact O-N 3.1Å; R1728-D1743 IonicContact CZ-OD2 2.97Å; R1728-D1743 IonicContact NE-OD2 3.34Å; R1728-D1743 PolarHBondContact NE-OD2 3.17Å; R1728-D1743 IonicContact NH1-OD2 3.11Å; R1728-D1743 PolarHBondContact NH1-OD2 3.13Å; R1728-D1743 IonicContact NH2-OD1 2.74Å; R1728-D1743 IonicContact NH2-OD2 3.37Å; R1728-D1743 PolarHBondContact NH2-OD2 3.04Å
1729	T	95.5	Very high	93.5	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.006	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	133.3	-163.9	-50.4	0	0	0	0	112	A1701 V1702 M1705 W1726 N1727 V1731 I1740 D1741	A1701-T1729 CarbonylContact C-O 3.52Å; A1701-T1729 WeakPolarHBondContact CA-O 3.27Å; V1702-T1729 PolarHBondContact N-O 2.9Å; V1702-T1729 PolarHBondContact O-N 2.93Å; M1705-T1729 HydrophobicContact CE-CG2 4.22Å; W1726-T1729 HydrophobicContact CB-CG2 4.12Å; W1726-T1729 VanDerWaalsContact CB-OG1 3.29Å; W1726-T1729 WeakPolarHBondContact CB-OG1 3.24Å; W1726-T1729 HydrophobicContact CD2-CG2 4.41Å; W1726-T1729 HydrophobicContact CE3-CG2 4.23Å; W1726-T1729 HydrophobicContact CG-CG2 4.43Å; N1727-T1729 VanDerWaalsContact C-N 3.33Å; N1727-T1729 VanDerWaalsContact C-OG1 3.3Å; N1727-T1729 PolarHBondContact N-OG1 2.91Å; N1727-T1729 PolarHBondContact O-N 3.08Å; N1727-T1729 PolarHBondContact O-OG1 3.05Å; N1727-T1729 VanDerWaalsContact O-OG1 3.1Å; T1729-V1731 HydrophobicContact CG2-CG2 4.11Å; T1729-I1740 HydrophobicContact CG2-CG2 3.49Å; T1729-I1740 VanDerWaalsContact CG2-CG2 3.48Å; T1729-D1741 CarbonylContact C-O 3.48Å; T1729-D1741 VanDerWaalsContact CA-O 3.29Å; T1729-D1741 WeakPolarHBondContact CA-O 3.43Å; T1729-D1741 WeakPolarHBondContact CG2-O 3.4Å
1730	V	97	Very high	94.1	Very high	49.4 Å²	49.4	42.7 Å²	42.7	30%	0.299	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	125.3	169.7	-176.1	0	0	0	0	108.7	L1699 F1700 A1701 H1732 I1740 D1741	L1699-V1730 HydrophobicContact CD1-CG1 3.57Å; L1699-V1730 HydrophobicContact CD2-CG1 4.37Å; L1699-V1730 HydrophobicContact CG-CG1 4.44Å; F1700-V1730 CarbonylContact O-C 3.56Å; F1700-V1730 VanDerWaalsContact O-CA 3.25Å; F1700-V1730 WeakPolarHBondContact O-CA 3.32Å; A1701-V1730 HydrophobicContact CB-CG2 4.37Å; V1730-H1732 WeakPolarHBondContact CG1-NE2 3.32Å; V1730-I1740 WeakPolarHBondContact O-CA 3.35Å; V1730-D1741 PolarHBondContact N-O 3.22Å; V1730-D1741 PolarHBondContact O-N 3.03Å
1731	V	96.8	Very high	94.5	Very high	9 Å²	9	42.7 Å²	42.7	6%	0.055	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	119.9	177.6	-176.9	0	0	0	0	109.2	L1699 F1700 M1705 T1729 I1738 R1739 I1740	L1699-V1731 CarbonylContact C-O 3.52Å; L1699-V1731 WeakPolarHBondContact CA-O 3.38Å; F1700-V1731 HydrophobicContact CB-CB 4.14Å; F1700-V1731 HydrophobicContact CD1-CB 3.98Å; F1700-V1731 HydrophobicContact CD1-CG1 4.29Å; F1700-V1731 HydrophobicContact CD2-CB 4.02Å; F1700-V1731 HydrophobicContact CD2-CG1 4.15Å; F1700-V1731 HydrophobicContact CD2-CG2 4.23Å; F1700-V1731 HydrophobicContact CE1-CB 3.58Å; F1700-V1731 HydrophobicContact CE1-CG1 3.52Å; F1700-V1731 HydrophobicContact CE1-CG2 4.32Å; F1700-V1731 HydrophobicContact CE2-CB 3.67Å; F1700-V1731 HydrophobicContact CE2-CG1 4.3Å; F1700-V1731 HydrophobicContact CE2-CG2 3.57Å; F1700-V1731 VanDerWaalsContact CE2-CG2 3.49Å; F1700-V1731 HydrophobicContact CG-CB 4.22Å; F1700-V1731 HydrophobicContact CZ-CB 3.42Å; F1700-V1731 VanDerWaalsContact CZ-CB 3.48Å; F1700-V1731 HydrophobicContact CZ-CG1 3.53Å; F1700-V1731 VanDerWaalsContact CZ-CG1 3.48Å; F1700-V1731 HydrophobicContact CZ-CG2 3.64Å; F1700-V1731 PolarHBondContact N-O 3.1Å; F1700-V1731 PolarHBondContact O-N 2.94Å; M1705-V1731 HydrophobicContact CE-CG2 4.37Å; M1705-V1731 HydrophobicContact SD-CG2 4.39Å; T1729-V1731 HydrophobicContact CG2-CG2 4.11Å; V1731-I1738 HydrophobicContact CG1-CG2 4.29Å; V1731-R1739 CarbonylContact C-O 3.54Å; V1731-R1739 VanDerWaalsContact CA-O 3.31Å; V1731-R1739 WeakPolarHBondContact CA-O 3.39Å; V1731-I1740 HydrophobicContact CG1-CG1 4.17Å; V1731-I1740 HydrophobicContact CG2-CG1 4.17Å; V1731-I1740 HydrophobicContact CG2-CG2 4.24Å
1732	H	96	Very high	94.7	Very high	41.6 Å²	41.6	43 Å²	43	19%	0.193	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	121.3	169.1	-63.1	-105.8	0	0	0	108.8	H1697 L1699 V1730 I1738 R1739	H1697-H1732 AromaticContact NE2-ND1 3.72Å; L1699-H1732 WeakPolarHBondContact CD1-CE1 3.38Å; L1699-H1732 VanDerWaalsContact CD1-ND1 3.34Å; L1699-H1732 WeakPolarHBondContact CD1-ND1 3.32Å; V1730-H1732 WeakPolarHBondContact CG1-NE2 3.32Å; H1732-I1738 CarbonylContact O-C 3.45Å; H1732-I1738 WeakPolarHBondContact O-CA 3.28Å; H1732-R1739 HydrophobicContact CB-CB 4.25Å; H1732-R1739 PolarHBondContact CD2-NH2 2.96Å; H1732-R1739 VanDerWaalsContact CD2-NH2 3.31Å; H1732-R1739 PolarHBondContact CE1-NH2 2.94Å; H1732-R1739 VanDerWaalsContact CE1-NH2 3.28Å; H1732-R1739 PolarHBondContact N-O 2.95Å; H1732-R1739 PolarHBondContact ND1-NH2 2.81Å; H1732-R1739 PolarHBondContact NE2-NH2 3.1Å; H1732-R1739 VanDerWaalsContact NE2-NH2 3.17Å; H1732-R1739 PolarHBondContact O-N 3.07Å
1733	W	93.8	Very high	94.7	Very high	88.4 Å²	88.4	41.5 Å²	41.5	34%	0.335	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	116.5	171.5	-176.5	-28.6	0	0	0	109.3	Y1641 I1690 H1697 L1698 F1700 I1738	Y1641-W1733 WeakPolarHBondContact OH-CZ3 3.36Å; I1690-W1733 HydrophobicContact CG2-CH2 4.17Å; I1690-W1733 HydrophobicContact CG2-CZ2 4.01Å; H1697-W1733 WeakPolarHBondContact CA-O 3.23Å; H1697-W1733 PolarHBondContact CD2-O 3.43Å; L1698-W1733 HydrophobicContact CB-CB 4.21Å; L1698-W1733 HydrophobicContact CB-CE3 4.13Å; L1698-W1733 HydrophobicContact CD2-CE3 4.1Å; L1698-W1733 PolarHBondContact N-O 3.11Å; L1698-W1733 WeakPolarHBondContact O-CB 3.27Å; L1698-W1733 PolarHBondContact O-N 3.06Å; F1700-W1733 HydrophobicContact CE2-CB 4.5Å; F1700-W1733 HydrophobicContact CE2-CE3 4.43Å; W1733-I1738 HydrophobicContact CD2-CG1 4.43Å; W1733-I1738 HydrophobicContact CE3-CD1 4.3Å; W1733-I1738 HydrophobicContact CE3-CG1 4.45Å; W1733-I1738 HydrophobicContact CZ3-CD1 4.27Å
1734	E	90.9	Very high	94.8	Very high	85.8 Å²	85.8	41.4 Å²	41.4	40%	0.401	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	173.3	175.2	-60	177.5	174.4	0	0	109.6	H1697 G1736 V1737	H1697-E1734 IonicContact CD2-OE1 2.7Å; H1697-E1734 IonicContact ND1-OE1 2.99Å; E1734-G1736 PolarHBondContact O-N 3.16Å; E1734-G1736 VanDerWaalsContact O-N 3.14Å; E1734-V1737 CarbonylContact C-O 3.55Å; E1734-V1737 HydrophobicContact CB-CB 4.45Å; E1734-V1737 PolarHBondContact N-O 3.09Å; E1734-V1737 PolarHBondContact O-N 3.2Å; E1734-V1737 VanDerWaalsContact O-O 3.07Å
1735	N	89.2	Confident	94.7	Very high	50.6 Å²	50.6	39.4 Å²	39.4	27%	0.271	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	115.4	178.1	-177.7	30.1	0	0	0	110.6	D1553 V1737 N1781	D1553-N1735 WeakPolarHBondContact OD2-CB 3.27Å; D1553-N1735 PolarHBondContact OD2-ND2 3.09Å; N1735-V1737 VanDerWaalsContact C-N 3.29Å; N1735-V1737 PolarHBondContact O-N 3.14Å; N1735-V1737 VanDerWaalsContact O-N 3.13Å; N1735-N1781 PolarHBondContact ND2-OD1 3.12Å
1736	G	89.9	Confident	94.6	Very high	16.4 Å²	16.4	37.8 Å²	37.8	17%	0.169	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.1	-2.2	179.7	0	0	0	0	0	115.5	E1734 K1771 L1772	E1734-G1736 PolarHBondContact O-N 3.16Å; E1734-G1736 VanDerWaalsContact O-N 3.14Å; G1736-K1771 CarbonylContact O-C 3.55Å; G1736-K1771 WeakPolarHBondContact O-CA 3.26Å; G1736-L1772 WeakPolarHBondContact O-CB 3.25Å; G1736-L1772 PolarHBondContact O-N 3.26Å
1737	V	94.4	Very high	94.4	Very high	43.8 Å²	43.8	38 Å²	38	27%	0.265	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	130.7	179.5	-174.8	0	0	0	0	110.6	E1734 N1735 T1769 V1770 K1771	E1734-V1737 CarbonylContact C-O 3.55Å; E1734-V1737 HydrophobicContact CB-CB 4.45Å; E1734-V1737 PolarHBondContact N-O 3.09Å; E1734-V1737 PolarHBondContact O-N 3.2Å; E1734-V1737 VanDerWaalsContact O-O 3.07Å; N1735-V1737 VanDerWaalsContact C-N 3.29Å; N1735-V1737 PolarHBondContact O-N 3.14Å; N1735-V1737 VanDerWaalsContact O-N 3.13Å; V1737-T1769 HydrophobicContact CG1-CG2 4.02Å; V1737-V1770 CarbonylContact C-O 3.6Å; V1737-V1770 WeakPolarHBondContact CA-O 3.3Å; V1737-K1771 HydrophobicContact CG1-CG 4.45Å; V1737-K1771 HydrophobicContact CG2-CG 4.32Å
1738	I	95.9	Very high	94	Very high	30.6 Å²	30.6	37.1 Å²	37.1	16%	0.157	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	120.6	172.9	-53.5	169.7	0	0	0	107.4	V1731 H1732 W1733 I1740 T1769 V1770 L1772	V1731-I1738 HydrophobicContact CG1-CG2 4.29Å; H1732-I1738 CarbonylContact O-C 3.45Å; H1732-I1738 WeakPolarHBondContact O-CA 3.28Å; W1733-I1738 HydrophobicContact CD2-CG1 4.43Å; W1733-I1738 HydrophobicContact CE3-CD1 4.3Å; W1733-I1738 HydrophobicContact CE3-CG1 4.45Å; W1733-I1738 HydrophobicContact CZ3-CD1 4.27Å; I1738-I1740 HydrophobicContact CG2-CG1 4.28Å; I1738-T1769 CarbonylContact O-C 3.54Å; I1738-T1769 WeakPolarHBondContact O-CA 3.22Å; I1738-V1770 HydrophobicContact CB-CB 4.35Å; I1738-V1770 PolarHBondContact N-O 3.08Å; I1738-V1770 PolarHBondContact O-N 3.13Å; I1738-L1772 HydrophobicContact CD1-CD1 4.45Å
1739	R	96.9	Very high	93.6	Very high	78.4 Å²	78.4	31.7 Å²	31.7	30%	0.296	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	134	175.3	-175.1	176.9	67.7	176.3	3.1	109.7	V1731 H1732 D1741 E1767 M1768	V1731-R1739 CarbonylContact C-O 3.54Å; V1731-R1739 VanDerWaalsContact CA-O 3.31Å; V1731-R1739 WeakPolarHBondContact CA-O 3.39Å; H1732-R1739 HydrophobicContact CB-CB 4.25Å; H1732-R1739 PolarHBondContact CD2-NH2 2.96Å; H1732-R1739 VanDerWaalsContact CD2-NH2 3.31Å; H1732-R1739 PolarHBondContact CE1-NH2 2.94Å; H1732-R1739 VanDerWaalsContact CE1-NH2 3.28Å; H1732-R1739 PolarHBondContact N-O 2.95Å; H1732-R1739 PolarHBondContact ND1-NH2 2.81Å; H1732-R1739 PolarHBondContact NE2-NH2 3.1Å; H1732-R1739 VanDerWaalsContact NE2-NH2 3.17Å; H1732-R1739 PolarHBondContact O-N 3.07Å; R1739-D1741 WeakPolarHBondContact CD-OD2 3.34Å; R1739-D1741 WeakPolarHBondContact CG-OD2 3.4Å; R1739-D1741 IonicContact CZ-OD2 3.21Å; R1739-D1741 IonicContact NE-OD2 3.27Å; R1739-D1741 PolarHBondContact NE-OD2 3.05Å; R1739-D1741 VanDerWaalsContact NE-OD2 3.16Å; R1739-D1741 IonicContact NH1-OD1 3.94Å; R1739-D1741 IonicContact NH1-OD2 2.87Å; R1739-D1741 PolarHBondContact NH1-OD2 2.79Å; R1739-D1741 IonicContact NH2-OD2 3.27Å; R1739-D1741 PolarHBondContact NH2-OD2 3.33Å; R1739-E1767 VanDerWaalsContact CD-OE1 3.29Å; R1739-E1767 WeakPolarHBondContact CD-OE1 3.32Å; R1739-E1767 HydrophobicContact CG-CG 4.2Å; R1739-E1767 IonicContact CZ-OE1 2.93Å; R1739-E1767 IonicContact NE-OE1 3.13Å; R1739-E1767 IonicContact NH1-OE1 3.26Å; R1739-E1767 PolarHBondContact NH1-OE1 2.85Å; R1739-M1768 CarbonylContact C-O 3.52Å; R1739-M1768 WeakPolarHBondContact CA-O 3.32Å
1740	I	96.8	Very high	92.8	Very high	10.2 Å²	10.2	32.4 Å²	32.4	5%	0.052	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	117.5	178.8	-55.6	175.3	0	0	0	106.4	M1705 W1707 W1726 T1729 V1730 V1731 I1738 E1767 M1768	M1705-I1740 HydrophobicContact CE-CG2 4.38Å; W1707-I1740 HydrophobicContact CH2-CD1 3.66Å; W1707-I1740 HydrophobicContact CZ2-CD1 4.18Å; W1707-I1740 HydrophobicContact CZ3-CD1 4.45Å; W1726-I1740 HydrophobicContact CD2-CG2 3.93Å; W1726-I1740 HydrophobicContact CE3-CG2 3.85Å; W1726-I1740 HydrophobicContact CH2-CB 4.42Å; W1726-I1740 HydrophobicContact CH2-CG2 3.86Å; W1726-I1740 HydrophobicContact CZ2-CB 4.45Å; W1726-I1740 HydrophobicContact CZ2-CD1 4.48Å; W1726-I1740 HydrophobicContact CZ2-CG2 3.94Å; W1726-I1740 HydrophobicContact CZ3-CB 4.48Å; W1726-I1740 HydrophobicContact CZ3-CG2 3.81Å; T1729-I1740 HydrophobicContact CG2-CG2 3.49Å; T1729-I1740 VanDerWaalsContact CG2-CG2 3.48Å; V1730-I1740 WeakPolarHBondContact O-CA 3.35Å; V1731-I1740 HydrophobicContact CG1-CG1 4.17Å; V1731-I1740 HydrophobicContact CG2-CG1 4.17Å; V1731-I1740 HydrophobicContact CG2-CG2 4.24Å; I1738-I1740 HydrophobicContact CG2-CG1 4.28Å; I1740-E1767 CarbonylContact O-C 3.55Å; I1740-E1767 WeakPolarHBondContact O-CA 3.32Å; I1740-M1768 HydrophobicContact CB-CB 4.3Å; I1740-M1768 HydrophobicContact CD1-SD 4.29Å; I1740-M1768 PolarHBondContact N-O 3.25Å; I1740-M1768 PolarHBondContact O-N 3.1Å
1741	D	96	Very high	91.6	Very high	29.2 Å²	29.2	33.6 Å²	33.6	16%	0.156	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	125.6	177.1	-87	-75.9	0	0	0	108.7	T1729 V1730 R1739 L1766 E1767 K1822	T1729-D1741 CarbonylContact C-O 3.48Å; T1729-D1741 VanDerWaalsContact CA-O 3.29Å; T1729-D1741 WeakPolarHBondContact CA-O 3.43Å; T1729-D1741 WeakPolarHBondContact CG2-O 3.4Å; V1730-D1741 PolarHBondContact N-O 3.22Å; V1730-D1741 PolarHBondContact O-N 3.03Å; R1739-D1741 WeakPolarHBondContact CD-OD2 3.34Å; R1739-D1741 WeakPolarHBondContact CG-OD2 3.4Å; R1739-D1741 IonicContact CZ-OD2 3.21Å; R1739-D1741 IonicContact NE-OD2 3.27Å; R1739-D1741 PolarHBondContact NE-OD2 3.05Å; R1739-D1741 VanDerWaalsContact NE-OD2 3.16Å; R1739-D1741 IonicContact NH1-OD1 3.94Å; R1739-D1741 IonicContact NH1-OD2 2.87Å; R1739-D1741 PolarHBondContact NH1-OD2 2.79Å; R1739-D1741 IonicContact NH2-OD2 3.27Å; R1739-D1741 PolarHBondContact NH2-OD2 3.33Å; D1741-L1766 WeakPolarHBondContact CA-O 3.24Å; D1741-E1767 VanDerWaalsContact OD1-CB 3.3Å; D1741-E1767 WeakPolarHBondContact OD1-CB 3.29Å; D1741-E1767 VanDerWaalsContact OD1-CG 3.24Å; D1741-E1767 WeakPolarHBondContact OD1-CG 3.3Å; D1741-K1822 IonicContact OD1-NZ 3.3Å; D1741-K1822 PolarHBondContact OD1-NZ 3.15Å
1742	G	94.5	Very high	90.1	Very high	7.6 Å²	7.6	35.5 Å²	35.5	8%	0.078	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	167.3	-170	177.1	0	0	0	0	0	113.1	L1766	G1742-L1766 PolarHBondContact N-O 3.15Å; G1742-L1766 VanDerWaalsContact N-O 3.08Å; G1742-L1766 PolarHBondContact O-N 3.23Å
1743	D	94.1	Very high	88.3	Confident	10.4 Å²	10.4	42.9 Å²	42.9	6%	0.056	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	125.7	175.6	-54.2	-36.7	0	0	0	109.8	W1726 N1727 R1728 P1764 H1765	W1726-D1743 CarbonylContact C-O 3.49Å; W1726-D1743 VanDerWaalsContact CA-O 3.27Å; W1726-D1743 WeakPolarHBondContact CA-O 3.35Å; N1727-D1743 HydrophobicContact CB-CB 4.45Å; N1727-D1743 PolarHBondContact N-O 2.97Å; N1727-D1743 PolarHBondContact O-N 3.1Å; N1727-D1743 VanDerWaalsContact O-N 3.08Å; R1728-D1743 IonicContact CZ-OD2 2.97Å; R1728-D1743 IonicContact NE-OD2 3.34Å; R1728-D1743 PolarHBondContact NE-OD2 3.17Å; R1728-D1743 IonicContact NH1-OD2 3.11Å; R1728-D1743 PolarHBondContact NH1-OD2 3.13Å; R1728-D1743 IonicContact NH2-OD1 2.74Å; R1728-D1743 IonicContact NH2-OD2 3.37Å; R1728-D1743 PolarHBondContact NH2-OD2 3.04Å; D1743-P1764 VanDerWaalsContact OD1-CA 3.28Å; D1743-P1764 WeakPolarHBondContact OD1-CA 3.27Å; D1743-H1765 IonicContact OD1-CE1 2.79Å; D1743-H1765 IonicContact OD1-CG 2.65Å; D1743-H1765 PolarHBondContact OD1-N 3Å; D1743-H1765 IonicContact OD1-ND1 3.46Å; D1743-H1765 PolarHBondContact OD1-ND1 2.84Å
1744	L	95.7	Very high	86.5	Confident	3 Å²	3	42.7 Å²	42.7	2%	0.016	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	120.1	-178.2	173.8	60.6	0	0	0	111.8	W1724 Q1725 W1726 I1746 I1763 L1766	W1724-L1744 HydrophobicContact CB-CD1 4.23Å; W1724-L1744 HydrophobicContact CE3-CD1 4.28Å; W1724-L1744 HydrophobicContact CE3-CD2 4.34Å; W1724-L1744 HydrophobicContact CZ3-CD2 4.13Å; Q1725-L1744 WeakPolarHBondContact O-CA 3.34Å; W1726-L1744 HydrophobicContact CD2-CB 4.16Å; W1726-L1744 HydrophobicContact CD2-CD1 3.97Å; W1726-L1744 HydrophobicContact CE3-CB 3.92Å; W1726-L1744 HydrophobicContact CG-CD1 4.22Å; W1726-L1744 HydrophobicContact CH2-CB 4.03Å; W1726-L1744 HydrophobicContact CH2-CD2 4.13Å; W1726-L1744 HydrophobicContact CH2-CG 4.48Å; W1726-L1744 HydrophobicContact CZ2-CB 4.25Å; W1726-L1744 HydrophobicContact CZ2-CD1 4.08Å; W1726-L1744 HydrophobicContact CZ2-CD2 3.87Å; W1726-L1744 HydrophobicContact CZ2-CG 4.28Å; W1726-L1744 HydrophobicContact CZ3-CB 3.87Å; L1744-I1746 HydrophobicContact CD1-CG1 4.16Å; L1744-I1746 HydrophobicContact CD2-CD1 4.33Å; L1744-I1746 HydrophobicContact CD2-CG1 4.31Å; L1744-I1746 HydrophobicContact CG-CG1 4.14Å; L1744-I1763 HydrophobicContact CB-CB 4.46Å; L1744-I1763 PolarHBondContact N-O 3.09Å; L1744-I1763 PolarHBondContact O-N 2.98Å; L1744-L1766 HydrophobicContact CB-CD2 3.73Å; L1744-L1766 HydrophobicContact CD2-CD2 3.48Å; L1744-L1766 VanDerWaalsContact CD2-CD2 3.46Å; L1744-L1766 HydrophobicContact CG-CD2 4.24Å
1745	D	94.3	Very high	84.7	Confident	18.4 Å²	18.4	44.5 Å²	44.5	10%	0.098	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	126	166.7	-62.7	-49.5	0	0	0	110.2	Q1725 N1727 V1747 F1761 H1762	Q1725-D1745 HydrophobicContact CB-CB 4.2Å; Q1725-D1745 HydrophobicContact CG-CB 4.48Å; Q1725-D1745 PolarHBondContact N-O 3.03Å; Q1725-D1745 PolarHBondContact O-N 3.11Å; N1727-D1745 PolarHBondContact ND2-OD2 3.15Å; N1727-D1745 VanDerWaalsContact ND2-OD2 3.11Å; D1745-V1747 HydrophobicContact CB-CG2 4.21Å; D1745-F1761 CarbonylContact C-O 3.57Å; D1745-F1761 VanDerWaalsContact CA-O 3.32Å; D1745-F1761 WeakPolarHBondContact CA-O 3.4Å; D1745-H1762 IonicContact OD1-CE1 3.56Å; D1745-H1762 IonicContact OD1-CG 3.05Å; D1745-H1762 IonicContact OD1-ND1 3.19Å; D1745-H1762 PolarHBondContact OD1-ND1 3.32Å
1746	I	94.4	Very high	83.7	Confident	17.4 Å²	17.4	43.7 Å²	43.7	9%	0.089	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	121.5	171.8	-59.6	178.2	0	0	0	108.4	F1722 W1724 L1744 L1760 F1761	F1722-I1746 HydrophobicContact CD2-CG2 4.43Å; F1722-I1746 HydrophobicContact CE2-CG2 3.44Å; F1722-I1746 VanDerWaalsContact CE2-CG2 3.45Å; F1722-I1746 HydrophobicContact CZ-CG2 3.71Å; W1724-I1746 HydrophobicContact CD2-CD1 4.29Å; W1724-I1746 HydrophobicContact CD2-CG1 4.31Å; W1724-I1746 HydrophobicContact CG-CG1 4.36Å; W1724-I1746 HydrophobicContact CZ2-CD1 4.2Å; L1744-I1746 HydrophobicContact CD1-CG1 4.16Å; L1744-I1746 HydrophobicContact CD2-CD1 4.33Å; L1744-I1746 HydrophobicContact CD2-CG1 4.31Å; L1744-I1746 HydrophobicContact CG-CG1 4.14Å; I1746-L1760 HydrophobicContact CG2-CB 4.43Å; I1746-L1760 HydrophobicContact CG2-CD1 4.44Å; I1746-L1760 WeakPolarHBondContact O-CA 3.33Å; I1746-L1760 WeakPolarHBondContact O-CB 3.44Å; I1746-L1760 PolarHBondContact O-N 3.18Å; I1746-F1761 HydrophobicContact CB-CB 4.06Å; I1746-F1761 HydrophobicContact CB-CD2 3.94Å; I1746-F1761 HydrophobicContact CB-CG 4.44Å; I1746-F1761 HydrophobicContact CD1-CB 4.38Å; I1746-F1761 HydrophobicContact CD1-CD2 4.05Å; I1746-F1761 HydrophobicContact CD1-CG 4.36Å; I1746-F1761 HydrophobicContact CG1-CB 4.33Å; I1746-F1761 HydrophobicContact CG1-CD2 4.46Å; I1746-F1761 HydrophobicContact CG2-CD2 4.22Å; I1746-F1761 PolarHBondContact N-O 3.07Å; I1746-F1761 PolarHBondContact O-N 3Å
1747	V	91	Very high	83	Confident	7.4 Å²	7.4	47.7 Å²	47.7	5%	0.045	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	137.8	-167.7	-178.1	0	0	0	0	110.8	T1723 D1745 Q1749 I1757 C1758 Q1759	T1723-V1747 PolarHBondContact N-O 3.1Å; T1723-V1747 PolarHBondContact O-N 3.02Å; D1745-V1747 HydrophobicContact CB-CG2 4.21Å; V1747-Q1749 HydrophobicContact CG1-CG 4.43Å; V1747-I1757 HydrophobicContact CG1-CB 4.38Å; V1747-I1757 HydrophobicContact CG1-CG2 3.31Å; V1747-C1758 WeakPolarHBondContact CA-O 3.25Å; V1747-Q1759 HydrophobicContact CG2-CG 4.17Å
1748	Y	88	Confident	82.4	Confident	10.2 Å²	10.2	46.4 Å²	46.4	4%	0.04	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	114.1	169.9	-173.2	-102.9	0	0	0	110.6	T1711 E1720 F1721 F1722 T1750 C1758 F1846	T1711-Y1748 WeakPolarHBondContact CB-OH 3.49Å; T1711-Y1748 HydrophobicContact CG2-CD2 4.32Å; T1711-Y1748 HydrophobicContact CG2-CE2 4Å; T1711-Y1748 PolarHBondContact OG1-OH 3.1Å; E1720-Y1748 PolarHBondContact OE2-OH 2.91Å; F1721-Y1748 WeakPolarHBondContact O-CD2 3.25Å; F1722-Y1748 HydrophobicContact CB-CD2 4.22Å; F1722-Y1748 HydrophobicContact CB-CE2 4.35Å; F1722-Y1748 HydrophobicContact CD2-CD2 4.19Å; Y1748-T1750 HydrophobicContact CD1-CG2 4.09Å; Y1748-T1750 HydrophobicContact CE1-CG2 3.86Å; Y1748-T1750 PolarHBondContact OH-OG1 2.94Å; Y1748-C1758 PolarHBondContact N-O 3.06Å; Y1748-C1758 PolarHBondContact O-N 3.05Å; Y1748-F1846 HydrophobicContact CD1-CB 4.05Å; Y1748-F1846 AromaticContact CD1-CD1 3.86Å; Y1748-F1846 HydrophobicContact CD1-CD1 4.1Å; Y1748-F1846 AromaticContact CD1-CD2 3.58Å; Y1748-F1846 HydrophobicContact CD1-CD2 3.7Å; Y1748-F1846 VanDerWaalsContact CD1-CD2 3.42Å; Y1748-F1846 HydrophobicContact CD1-CE1 4.23Å; Y1748-F1846 AromaticContact CD1-CE2 3.7Å; Y1748-F1846 HydrophobicContact CD1-CE2 3.7Å; Y1748-F1846 AromaticContact CD1-CG 3.67Å; Y1748-F1846 HydrophobicContact CD1-CG 3.67Å; Y1748-F1846 AromaticContact CD1-CZ 3.99Å; Y1748-F1846 HydrophobicContact CD1-CZ 4.11Å; Y1748-F1846 HydrophobicContact CD2-CB 4.12Å; Y1748-F1846 HydrophobicContact CD2-CD1 4.44Å; Y1748-F1846 AromaticContact CD2-CD2 3.34Å; Y1748-F1846 HydrophobicContact CD2-CD2 3.34Å; Y1748-F1846 VanDerWaalsContact CD2-CD2 3.41Å; Y1748-F1846 HydrophobicContact CD2-CE1 4.43Å; Y1748-F1846 AromaticContact CD2-CE2 3.32Å; Y1748-F1846 HydrophobicContact CD2-CE2 3.32Å; Y1748-F1846 VanDerWaalsContact CD2-CE2 3.47Å; Y1748-F1846 AromaticContact CD2-CG 3.93Å; Y1748-F1846 HydrophobicContact CD2-CG 4.09Å; Y1748-F1846 AromaticContact CD2-CZ 3.81Å; Y1748-F1846 HydrophobicContact CD2-CZ 3.91Å; Y1748-F1846 HydrophobicContact CE1-CB 3.68Å; Y1748-F1846 AromaticContact CE1-CD1 3.22Å; Y1748-F1846 HydrophobicContact CE1-CD1 3.22Å; Y1748-F1846 AromaticContact CE1-CD2 3.68Å; Y1748-F1846 HydrophobicContact CE1-CD2 3.68Å; Y1748-F1846 AromaticContact CE1-CE1 3.57Å; Y1748-F1846 HydrophobicContact CE1-CE1 3.57Å; Y1748-F1846 AromaticContact CE1-CE2 3.73Å; Y1748-F1846 HydrophobicContact CE1-CE2 3.9Å; Y1748-F1846 AromaticContact CE1-CG 3.47Å; Y1748-F1846 HydrophobicContact CE1-CG 3.47Å; Y1748-F1846 AromaticContact CE1-CZ 3.9Å; Y1748-F1846 HydrophobicContact CE1-CZ 3.9Å; Y1748-F1846 HydrophobicContact CE2-CB 4.01Å; Y1748-F1846 AromaticContact CE2-CD2 3.14Å; Y1748-F1846 HydrophobicContact CE2-CD2 3.14Å; Y1748-F1846 AromaticContact CE2-CE2 3.48Å; Y1748-F1846 HydrophobicContact CE2-CE2 3.48Å; Y1748-F1846 AromaticContact CE2-CG 3.93Å; Y1748-F1846 HydrophobicContact CE2-CG 4.06Å; Y1748-F1846 HydrophobicContact CE2-CZ 4.32Å; Y1748-F1846 HydrophobicContact CG-CB 4.28Å; Y1748-F1846 HydrophobicContact CG-CD1 4.12Å; Y1748-F1846 AromaticContact CG-CD2 3.81Å; Y1748-F1846 HydrophobicContact CG-CD2 3.89Å; Y1748-F1846 HydrophobicContact CG-CE1 4.28Å; Y1748-F1846 AromaticContact CG-CE2 3.87Å; Y1748-F1846 HydrophobicContact CG-CE2 4.12Å; Y1748-F1846 AromaticContact CG-CG 3.85Å; Y1748-F1846 HydrophobicContact CG-CG 4.02Å; Y1748-F1846 HydrophobicContact CG-CZ 4.2Å; Y1748-F1846 VanDerWaalsContact CZ-CB 3.49Å; Y1748-F1846 AromaticContact CZ-CD1 3.6Å; Y1748-F1846 VanDerWaalsContact CZ-CD1 3.48Å; Y1748-F1846 AromaticContact CZ-CD2 3.37Å; Y1748-F1846 AromaticContact CZ-CE2 3.98Å; Y1748-F1846 AromaticContact CZ-CG 3.69Å; Y1748-F1846 VanDerWaalsContact CZ-CG 3.45Å; Y1748-F1846 WeakPolarHBondContact OH-CD1 3.31Å
1749	Q	84.4	Confident	81.9	Confident	56.8 Å²	56.8	49 Å²	49	27%	0.265	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	130.3	175.1	-100.2	-179.7	-1.1	0	0	109.8	T1719 E1720 F1721 V1747 G1756 I1757	T1719-Q1749 CarbonylContact O-C 3.52Å; T1719-Q1749 VanDerWaalsContact O-C 3.25Å; T1719-Q1749 WeakPolarHBondContact O-CG 3.39Å; E1720-Q1749 WeakPolarHBondContact CA-O 3.35Å; F1721-Q1749 HydrophobicContact CB-CB 4.4Å; F1721-Q1749 PolarHBondContact N-O 3.17Å; F1721-Q1749 VanDerWaalsContact N-O 3.1Å; F1721-Q1749 PolarHBondContact O-N 3.12Å; V1747-Q1749 HydrophobicContact CG1-CG 4.43Å; Q1749-G1756 CarbonylContact C-O 3.5Å; Q1749-G1756 WeakPolarHBondContact CA-O 3.41Å; Q1749-G1756 VanDerWaalsContact CG-O 3.22Å; Q1749-G1756 WeakPolarHBondContact CG-O 3.49Å; Q1749-I1757 HydrophobicContact CG-CG1 4.39Å; Q1749-I1757 HydrophobicContact CG-CG2 4.5Å
1750	T	79.7	Confident	81.5	Confident	15 Å²	15	45.7 Å²	45.7	9%	0.092	25%	0.249	C	C	.	.			trans	-152.7	142.3	-179.6	-178.3	0	0	0	0	111.8	T1719 Y1748 S1752 Y1754 G1756 F1846	T1719-T1750 WeakPolarHBondContact O-CA 3.33Å; T1719-T1750 PolarHBondContact O-N 3.12Å; Y1748-T1750 HydrophobicContact CD1-CG2 4.09Å; Y1748-T1750 HydrophobicContact CE1-CG2 3.86Å; Y1748-T1750 PolarHBondContact OH-OG1 2.94Å; T1750-S1752 WeakPolarHBondContact CG2-OG 3.28Å; T1750-S1752 PolarHBondContact O-N 3.14Å; T1750-S1752 VanDerWaalsContact O-N 3.13Å; T1750-S1752 WeakPolarHBondContact OG1-CB 3.16Å; T1750-S1752 PolarHBondContact OG1-N 3.17Å; T1750-S1752 PolarHBondContact OG1-OG 3.17Å; T1750-S1752 VanDerWaalsContact OG1-OG 3.05Å; T1750-Y1754 HydrophobicContact CG2-CD2 4.19Å; T1750-G1756 PolarHBondContact N-O 3.04Å; T1750-G1756 CarbonylContact O-C 3.54Å; T1750-G1756 VanDerWaalsContact O-CA 3.27Å; T1750-G1756 WeakPolarHBondContact O-CA 3.35Å; T1750-F1846 HydrophobicContact CG2-CE1 4.29Å; T1750-F1846 HydrophobicContact CG2-CE2 4.33Å; T1750-F1846 HydrophobicContact CG2-CZ 3.8Å
1751	A	70.3	Confident	81.3	Confident	75.4 Å²	75.4	48.2 Å²	48.2	62%	0.623	26%	0.26	S	S	*	.			trans	-77.6	25.4	174.6	0	0	0	0	0	113.8	T1719	T1719-A1751 HydrophobicContact CG2-CB 4.37Å
1752	S	66.8	Low	81.2	Confident	49.4 Å²	49.4	48.3 Å²	48.3	35%	0.345	26%	0.259	S	S	.	.	S	Bend	trans	-78.3	-179.6	-178.8	79.5	0	0	0	0	112	T1750 Y1754	T1750-S1752 WeakPolarHBondContact CG2-OG 3.28Å; T1750-S1752 PolarHBondContact O-N 3.14Å; T1750-S1752 VanDerWaalsContact O-N 3.13Å; T1750-S1752 WeakPolarHBondContact OG1-CB 3.16Å; T1750-S1752 PolarHBondContact OG1-N 3.17Å; T1750-S1752 PolarHBondContact OG1-OG 3.17Å; T1750-S1752 VanDerWaalsContact OG1-OG 3.05Å; S1752-Y1754 CarbonylContact O-C 3.6Å; S1752-Y1754 PolarHBondContact O-N 3.01Å; S1752-Y1754 VanDerWaalsContact O-N 3.14Å; S1752-Y1754 VanDerWaalsContact O-O 3.11Å; S1752-Y1754 WeakPolarHBondContact OG-CD2 3.41Å; S1752-Y1754 PolarHBondContact OG-N 3.19Å; S1752-Y1754 VanDerWaalsContact OG-N 3.09Å; S1752-Y1754 PolarHBondContact OG-O 3.16Å; S1752-Y1754 VanDerWaalsContact OG-O 3.08Å
1753	K	57.5	Low	81.1	Confident	196.8 Å²	196.8	48.9 Å²	48.9	86%	0.856	26%	0.26	S	S	*	.	S	Bend	trans	-61.6	-11	-178	-154.6	178.1	177.8	-176.2	0	114.6
1754	Y	55.1	Low	81	Confident	83 Å²	83	48.6 Å²	48.6	33%	0.325	26%	0.259	S	S	.	.	S	Bend	trans	-97.1	111.6	177.5	-48.7	-74.6	0	0	0	108.5	T1750 S1752 G1756 I1757 C1758 Y1840 S1842 F1846 Y1901	T1750-Y1754 HydrophobicContact CG2-CD2 4.19Å; S1752-Y1754 CarbonylContact O-C 3.6Å; S1752-Y1754 PolarHBondContact O-N 3.01Å; S1752-Y1754 VanDerWaalsContact O-N 3.14Å; S1752-Y1754 VanDerWaalsContact O-O 3.11Å; S1752-Y1754 WeakPolarHBondContact OG-CD2 3.41Å; S1752-Y1754 PolarHBondContact OG-N 3.19Å; S1752-Y1754 VanDerWaalsContact OG-N 3.09Å; S1752-Y1754 PolarHBondContact OG-O 3.16Å; S1752-Y1754 VanDerWaalsContact OG-O 3.08Å; Y1754-G1756 PolarHBondContact O-N 3.14Å; Y1754-I1757 CarbonylContact O-C 3.58Å; Y1754-I1757 PolarHBondContact O-N 2.88Å; Y1754-I1757 VanDerWaalsContact O-O 3.13Å; Y1754-C1758 HydrophobicContact CD1-CB 4.37Å; Y1754-C1758 HydrophobicContact CD2-CB 4.28Å; Y1754-C1758 HydrophobicContact CG-CB 3.98Å; Y1754-Y1840 HydrophobicContact CD1-CD2 4.34Å; Y1754-Y1840 HydrophobicContact CD1-CE2 4.29Å; Y1754-Y1840 AromaticContact CE1-CD1 3.95Å; Y1754-Y1840 HydrophobicContact CE1-CD1 3.95Å; Y1754-Y1840 AromaticContact CE1-CD2 3.58Å; Y1754-Y1840 HydrophobicContact CE1-CD2 3.58Å; Y1754-Y1840 HydrophobicContact CE1-CE1 4.22Å; Y1754-Y1840 AromaticContact CE1-CE2 3.88Å; Y1754-Y1840 HydrophobicContact CE1-CE2 3.88Å; Y1754-Y1840 AromaticContact CE1-CG 3.63Å; Y1754-Y1840 HydrophobicContact CE1-CG 3.63Å; Y1754-Y1840 AromaticContact CZ-CG 3.96Å; Y1754-Y1840 WeakPolarHBondContact OH-CB 3.46Å; Y1754-S1842 WeakPolarHBondContact CE2-OG 3.48Å; Y1754-S1842 WeakPolarHBondContact OH-CB 3.41Å; Y1754-S1842 PolarHBondContact OH-OG 2.78Å; Y1754-F1846 HydrophobicContact CD2-CE2 4.11Å; Y1754-F1846 AromaticContact CD2-CZ 3.92Å; Y1754-F1846 HydrophobicContact CD2-CZ 3.92Å; Y1754-F1846 AromaticContact CE2-CE2 3.83Å; Y1754-F1846 HydrophobicContact CE2-CE2 3.83Å; Y1754-F1846 AromaticContact CE2-CZ 3.71Å; Y1754-F1846 HydrophobicContact CE2-CZ 3.71Å; Y1754-Y1901 AromaticContact CD1-CD1 3.75Å; Y1754-Y1901 HydrophobicContact CD1-CD1 3.75Å; Y1754-Y1901 AromaticContact CD1-CD2 3.93Å; Y1754-Y1901 HydrophobicContact CD1-CD2 3.93Å; Y1754-Y1901 HydrophobicContact CD1-CE1 4.48Å; Y1754-Y1901 HydrophobicContact CD1-CE2 4.37Å; Y1754-Y1901 AromaticContact CD1-CG 3.83Å; Y1754-Y1901 HydrophobicContact CD1-CG 4.04Å; Y1754-Y1901 HydrophobicContact CE1-CD1 4.14Å; Y1754-Y1901 AromaticContact CE1-CD2 3.9Å; Y1754-Y1901 HydrophobicContact CE1-CD2 3.9Å; Y1754-Y1901 HydrophobicContact CE1-CG 4.18Å; Y1754-Y1901 HydrophobicContact CG-CD1 4.21Å; Y1754-Y1901 HydrophobicContact CG-CG 4.32Å
1755	D	54.6	Low	80.8	Confident	123.8 Å²	123.8	51.1 Å²	51.1	66%	0.662	27%	0.27	S	S	*	.			trans	-32.3	97.7	-175.3	-83.8	-29.9	0	0	0	112.6	I1757 Y1901 L2030	D1755-I1757 VanDerWaalsContact C-N 3.33Å; D1755-I1757 PolarHBondContact O-N 2.95Å; D1755-Y1901 PolarHBondContact OD2-OH 2.91Å; D1755-L2030 HydrophobicContact CB-CD2 4.19Å; D1755-L2030 WeakPolarHBondContact OD2-CD2 3.1Å
1756	G	66.7	Low	80.9	Confident	34.4 Å²	34.4	50.3 Å²	50.3	36%	0.355	27%	0.266	S	S	.	.	S	Bend	trans	39	9.1	-170.3	0	0	0	0	0	116.9	Q1749 T1750 Y1754	Q1749-G1756 CarbonylContact C-O 3.5Å; Q1749-G1756 WeakPolarHBondContact CA-O 3.41Å; Q1749-G1756 VanDerWaalsContact CG-O 3.22Å; Q1749-G1756 WeakPolarHBondContact CG-O 3.49Å; T1750-G1756 PolarHBondContact N-O 3.04Å; T1750-G1756 CarbonylContact O-C 3.54Å; T1750-G1756 VanDerWaalsContact O-CA 3.27Å; T1750-G1756 WeakPolarHBondContact O-CA 3.35Å; Y1754-G1756 PolarHBondContact O-N 3.14Å
1757	I	75.9	Confident	81	Confident	101.2 Å²	101.2	51.6 Å²	51.6	52%	0.519	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	108.8	-178.6	-55.2	-176.8	0	0	0	111.2	V1747 Q1749 Y1754 D1755 Q1759	V1747-I1757 HydrophobicContact CG1-CB 4.38Å; V1747-I1757 HydrophobicContact CG1-CG2 3.31Å; Q1749-I1757 HydrophobicContact CG-CG1 4.39Å; Q1749-I1757 HydrophobicContact CG-CG2 4.5Å; Y1754-I1757 CarbonylContact O-C 3.58Å; Y1754-I1757 PolarHBondContact O-N 2.88Å; Y1754-I1757 VanDerWaalsContact O-O 3.13Å; D1755-I1757 VanDerWaalsContact C-N 3.33Å; D1755-I1757 PolarHBondContact O-N 2.95Å; I1757-Q1759 HydrophobicContact CG2-CG 4.39Å
1758	C	81.6	Confident	81.2	Confident	15.6 Å²	15.6	52 Å²	52	11%	0.105	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	106.5	171.4	-161.4	0	0	0	0	109.5	V1747 Y1748 Y1754 L1760	V1747-C1758 WeakPolarHBondContact CA-O 3.25Å; Y1748-C1758 PolarHBondContact N-O 3.06Å; Y1748-C1758 PolarHBondContact O-N 3.05Å; Y1754-C1758 HydrophobicContact CD1-CB 4.37Å; Y1754-C1758 HydrophobicContact CD2-CB 4.28Å; Y1754-C1758 HydrophobicContact CG-CB 3.98Å; C1758-L1760 HydrophobicContact CB-CD2 4.47Å; C1758-L1760 PolarHBondContact O-N 3.47Å
1759	Q	84.7	Confident	81.7	Confident	86.2 Å²	86.2	52.4 Å²	52.4	40%	0.403	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	124.1	171.1	-67.7	175.8	-24	0	0	109.3	V1747 I1757 W1836 H2057	V1747-Q1759 HydrophobicContact CG2-CG 4.17Å; I1757-Q1759 HydrophobicContact CG2-CG 4.39Å; Q1759-W1836 HydrophobicContact CB-CH2 3.74Å; Q1759-W1836 HydrophobicContact CB-CZ3 4.4Å; Q1759-H2057 PolarHBondContact OE1-CD2 2.89Å
1760	L	89.4	Confident	82.3	Confident	8.2 Å²	8.2	50.5 Å²	50.5	4%	0.043	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	-43.7	-176.8	-62	178.3	0	0	0	111.5	F1722 I1746 C1758 C1837 S1838 F1839 V1843 F1846	F1722-L1760 HydrophobicContact CE2-CD1 4.3Å; I1746-L1760 HydrophobicContact CG2-CB 4.43Å; I1746-L1760 HydrophobicContact CG2-CD1 4.44Å; I1746-L1760 WeakPolarHBondContact O-CA 3.33Å; I1746-L1760 WeakPolarHBondContact O-CB 3.44Å; I1746-L1760 PolarHBondContact O-N 3.18Å; C1758-L1760 HydrophobicContact CB-CD2 4.47Å; C1758-L1760 PolarHBondContact O-N 3.47Å; L1760-C1837 CarbonylContact O-C 3.53Å; L1760-C1837 WeakPolarHBondContact O-CA 3.37Å; L1760-C1837 WeakPolarHBondContact O-CB 3.28Å; L1760-S1838 PolarHBondContact O-N 2.96Å; L1760-F1839 HydrophobicContact CD2-CD1 4.4Å; L1760-V1843 HydrophobicContact CD1-CG1 4.42Å; L1760-V1843 HydrophobicContact CD2-CB 4.48Å; L1760-V1843 HydrophobicContact CD2-CG1 3.97Å; L1760-V1843 HydrophobicContact CD2-CG2 3.62Å; L1760-F1846 HydrophobicContact CD1-CE1 4.13Å
1761	F	92.1	Very high	83.1	Confident	63.6 Å²	63.6	55.5 Å²	55.5	28%	0.279	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	141.9	179.5	-60.7	-100	0	0	0	109.6	D1745 I1746 I1763 W1836 C1837 F1839	D1745-F1761 CarbonylContact C-O 3.57Å; D1745-F1761 VanDerWaalsContact CA-O 3.32Å; D1745-F1761 WeakPolarHBondContact CA-O 3.4Å; I1746-F1761 HydrophobicContact CB-CB 4.06Å; I1746-F1761 HydrophobicContact CB-CD2 3.94Å; I1746-F1761 HydrophobicContact CB-CG 4.44Å; I1746-F1761 HydrophobicContact CD1-CB 4.38Å; I1746-F1761 HydrophobicContact CD1-CD2 4.05Å; I1746-F1761 HydrophobicContact CD1-CG 4.36Å; I1746-F1761 HydrophobicContact CG1-CB 4.33Å; I1746-F1761 HydrophobicContact CG1-CD2 4.46Å; I1746-F1761 HydrophobicContact CG2-CD2 4.22Å; I1746-F1761 PolarHBondContact N-O 3.07Å; I1746-F1761 PolarHBondContact O-N 3Å; F1761-I1763 HydrophobicContact CB-CD1 4.45Å; F1761-I1763 HydrophobicContact CB-CG1 4.36Å; F1761-I1763 HydrophobicContact CD1-CD1 4.46Å; F1761-W1836 CarbonylContact C-O 3.59Å; F1761-W1836 WeakPolarHBondContact CA-O 3.47Å; F1761-C1837 HydrophobicContact CB-CB 4.48Å; F1761-C1837 HydrophobicContact CD1-CB 3.46Å; F1761-C1837 VanDerWaalsContact CD1-CB 3.43Å; F1761-C1837 HydrophobicContact CE1-CB 3.84Å; F1761-C1837 HydrophobicContact CG-CB 4.01Å; F1761-F1839 HydrophobicContact CD1-CZ 4.5Å; F1761-F1839 HydrophobicContact CE1-CE1 4.38Å; F1761-F1839 AromaticContact CE1-CZ 3.83Å; F1761-F1839 HydrophobicContact CE1-CZ 3.95Å; F1761-F1839 AromaticContact CE2-CE1 3.95Å; F1761-F1839 HydrophobicContact CE2-CE1 3.95Å; F1761-F1839 AromaticContact CE2-CZ 3.75Å; F1761-F1839 HydrophobicContact CE2-CZ 3.84Å; F1761-F1839 AromaticContact CZ-CE1 3.88Å; F1761-F1839 HydrophobicContact CZ-CE1 4Å; F1761-F1839 HydrophobicContact CZ-CE2 4.41Å; F1761-F1839 AromaticContact CZ-CZ 3.44Å; F1761-F1839 HydrophobicContact CZ-CZ 3.44Å; F1761-F1839 VanDerWaalsContact CZ-CZ 3.41Å
1762	H	93.7	Very high	84.2	Confident	30.2 Å²	30.2	53.2 Å²	53.2	14%	0.14	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	118.9	165.2	177.1	66.1	0	0	0	107.5	D1745 D1832 P1835 W1836	D1745-H1762 IonicContact OD1-CE1 3.56Å; D1745-H1762 IonicContact OD1-CG 3.05Å; D1745-H1762 IonicContact OD1-ND1 3.19Å; D1745-H1762 PolarHBondContact OD1-ND1 3.32Å; H1762-D1832 PolarHBondContact NE2-O 3.12Å; H1762-P1835 CarbonylContact O-C 3.52Å; H1762-P1835 WeakPolarHBondContact O-CA 3.36Å; H1762-W1836 HydrophobicContact CB-CD2 3.84Å; H1762-W1836 VanDerWaalsContact CB-CE2 3.42Å; H1762-W1836 HydrophobicContact CB-CE3 4.5Å; H1762-W1836 HydrophobicContact CB-CG 4.13Å; H1762-W1836 HydrophobicContact CB-CH2 4.41Å; H1762-W1836 HydrophobicContact CB-CZ2 3.68Å; H1762-W1836 VanDerWaalsContact CB-NE1 3.34Å; H1762-W1836 AromaticContact CD2-CD1 3.77Å; H1762-W1836 AromaticContact CD2-NE1 3.48Å; H1762-W1836 PolarHBondContact CD2-NE1 2.96Å; H1762-W1836 AromaticContact CG-CE2 3.97Å; H1762-W1836 AromaticContact CG-NE1 3.6Å; H1762-W1836 PolarHBondContact N-O 3.06Å; H1762-W1836 PolarHBondContact O-N 2.9Å
1763	I	93.8	Very high	85.5	Confident	21.2 Å²	21.2	54.2 Å²	54.2	11%	0.109	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	91.6	-176.2	-49.6	178.6	0	0	0	108.4	L1744 F1761 L1766 V1821 P1835	L1744-I1763 HydrophobicContact CB-CB 4.46Å; L1744-I1763 PolarHBondContact N-O 3.09Å; L1744-I1763 PolarHBondContact O-N 2.98Å; F1761-I1763 HydrophobicContact CB-CD1 4.45Å; F1761-I1763 HydrophobicContact CB-CG1 4.36Å; F1761-I1763 HydrophobicContact CD1-CD1 4.46Å; I1763-L1766 HydrophobicContact CB-CD2 4.4Å; I1763-L1766 HydrophobicContact CG2-CB 4.05Å; I1763-L1766 HydrophobicContact CG2-CD1 4.18Å; I1763-L1766 HydrophobicContact CG2-CD2 4.14Å; I1763-L1766 HydrophobicContact CG2-CG 4.36Å; I1763-V1821 HydrophobicContact CG2-CG2 3.42Å; I1763-V1821 VanDerWaalsContact CG2-CG2 3.44Å; I1763-P1835 HydrophobicContact CG2-CB 4.38Å
1764	P	92.1	Very high	87.1	Confident	4.4 Å²	4.4	45.8 Å²	45.8	3%	0.029	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	155.2	178.5	29.3	-32.5	0	0	0	111.4	D1743 L1766 V1821 Q1833	D1743-P1764 VanDerWaalsContact OD1-CA 3.28Å; D1743-P1764 WeakPolarHBondContact OD1-CA 3.27Å; P1764-L1766 VanDerWaalsContact C-N 3.27Å; P1764-L1766 PolarHBondContact O-N 3.18Å; P1764-L1766 VanDerWaalsContact O-N 3.12Å; P1764-V1821 WeakPolarHBondContact O-CG1 3.29Å; P1764-Q1833 VanDerWaalsContact CG-O 3.23Å; P1764-Q1833 WeakPolarHBondContact CG-O 3.34Å
1765	H	91.4	Very high	88.9	Confident	53.6 Å²	53.6	42.6 Å²	42.6	25%	0.248	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	51.1	40.4	174.7	-52.7	-48	0	0	0	114.3	D1743 K1822 P1825 Q1833	D1743-H1765 IonicContact OD1-CE1 2.79Å; D1743-H1765 IonicContact OD1-CG 2.65Å; D1743-H1765 PolarHBondContact OD1-N 3Å; D1743-H1765 IonicContact OD1-ND1 3.46Å; D1743-H1765 PolarHBondContact OD1-ND1 2.84Å; H1765-K1822 HydrophobicContact CB-CB 4.21Å; H1765-K1822 PolarHBondContact O-N 3.11Å; H1765-P1825 WeakPolarHBondContact NE2-CD 3.49Å; H1765-Q1833 PolarHBondContact NE2-OE1 2.91Å; H1765-Q1833 VanDerWaalsContact NE2-OE1 3.12Å
1766	L	95.2	Very high	90.6	Very high	2.6 Å²	2.6	37 Å²	37	1%	0.014	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	124.9	-179.4	179.6	60.7	0	0	0	110.9	W1726 D1741 G1742 L1744 I1763 P1764 F1819 V1821	W1726-L1766 HydrophobicContact CH2-CB 4.42Å; W1726-L1766 HydrophobicContact CH2-CD2 3.65Å; W1726-L1766 HydrophobicContact CH2-CG 4.05Å; W1726-L1766 HydrophobicContact CZ2-CD2 4.43Å; W1726-L1766 HydrophobicContact CZ3-CB 4.22Å; W1726-L1766 HydrophobicContact CZ3-CD2 4.12Å; W1726-L1766 HydrophobicContact CZ3-CG 4.3Å; D1741-L1766 WeakPolarHBondContact CA-O 3.24Å; G1742-L1766 PolarHBondContact N-O 3.15Å; G1742-L1766 VanDerWaalsContact N-O 3.08Å; G1742-L1766 PolarHBondContact O-N 3.23Å; L1744-L1766 HydrophobicContact CB-CD2 3.73Å; L1744-L1766 HydrophobicContact CD2-CD2 3.48Å; L1744-L1766 VanDerWaalsContact CD2-CD2 3.46Å; L1744-L1766 HydrophobicContact CG-CD2 4.24Å; I1763-L1766 HydrophobicContact CB-CD2 4.4Å; I1763-L1766 HydrophobicContact CG2-CB 4.05Å; I1763-L1766 HydrophobicContact CG2-CD1 4.18Å; I1763-L1766 HydrophobicContact CG2-CD2 4.14Å; I1763-L1766 HydrophobicContact CG2-CG 4.36Å; P1764-L1766 VanDerWaalsContact C-N 3.27Å; P1764-L1766 PolarHBondContact O-N 3.18Å; P1764-L1766 VanDerWaalsContact O-N 3.12Å; L1766-F1819 HydrophobicContact CD1-CB 4.05Å; L1766-F1819 HydrophobicContact CD1-CD1 4.14Å; L1766-F1819 HydrophobicContact CD2-CD1 4.05Å; L1766-F1819 HydrophobicContact CG-CD1 4.42Å; L1766-V1821 HydrophobicContact CD1-CG2 3.94Å
1767	E	96.1	Very high	91.5	Very high	43.8 Å²	43.8	36.9 Å²	36.9	21%	0.205	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	109.4	164.4	-179	169.9	-178.6	0	0	109.2	R1739 I1740 D1741 F1819 T1820 K1822	R1739-E1767 VanDerWaalsContact CD-OE1 3.29Å; R1739-E1767 WeakPolarHBondContact CD-OE1 3.32Å; R1739-E1767 HydrophobicContact CG-CG 4.2Å; R1739-E1767 IonicContact CZ-OE1 2.93Å; R1739-E1767 IonicContact NE-OE1 3.13Å; R1739-E1767 IonicContact NH1-OE1 3.26Å; R1739-E1767 PolarHBondContact NH1-OE1 2.85Å; I1740-E1767 CarbonylContact O-C 3.55Å; I1740-E1767 WeakPolarHBondContact O-CA 3.32Å; D1741-E1767 VanDerWaalsContact OD1-CB 3.3Å; D1741-E1767 WeakPolarHBondContact OD1-CB 3.29Å; D1741-E1767 VanDerWaalsContact OD1-CG 3.24Å; D1741-E1767 WeakPolarHBondContact OD1-CG 3.3Å; E1767-F1819 WeakPolarHBondContact O-CA 2.76Å; E1767-T1820 PolarHBondContact N-O 3.19Å; E1767-T1820 PolarHBondContact O-N 3.19Å; E1767-T1820 PolarHBondContact O-OG1 3.16Å; E1767-K1822 WeakPolarHBondContact OE2-CE 3.28Å; E1767-K1822 IonicContact OE2-NZ 3.69Å; E1767-K1822 PolarHBondContact OE2-NZ 3.15Å; E1767-K1822 VanDerWaalsContact OE2-NZ 3.11Å
1768	M	97.1	Very high	92.1	Very high	17.6 Å²	17.6	37.8 Å²	37.8	9%	0.087	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	119.5	172.3	174.3	-178	178.6	0	0	109.6	W1724 W1726 R1739 I1740 V1770 I1817 N1818 F1819	W1724-M1768 HydrophobicContact CZ3-CE 4.49Å; W1724-M1768 HydrophobicContact CZ3-SD 4.36Å; W1726-M1768 HydrophobicContact CH2-CB 3.87Å; W1726-M1768 HydrophobicContact CH2-SD 4.21Å; W1726-M1768 HydrophobicContact CZ2-CB 4.3Å; W1726-M1768 HydrophobicContact CZ2-SD 3.89Å; R1739-M1768 CarbonylContact C-O 3.52Å; R1739-M1768 WeakPolarHBondContact CA-O 3.32Å; I1740-M1768 HydrophobicContact CB-CB 4.3Å; I1740-M1768 HydrophobicContact CD1-SD 4.29Å; I1740-M1768 PolarHBondContact N-O 3.25Å; I1740-M1768 PolarHBondContact O-N 3.1Å; M1768-V1770 HydrophobicContact CE-CG2 3.59Å; M1768-V1770 VanDerWaalsContact CE-CG2 3.5Å; M1768-V1770 HydrophobicContact CG-CG2 4.48Å; M1768-I1817 HydrophobicContact CE-CG2 4.15Å; M1768-N1818 CarbonylContact C-O 3.57Å; M1768-N1818 VanDerWaalsContact CA-O 3.31Å; M1768-N1818 WeakPolarHBondContact CA-O 3.31Å; M1768-F1819 HydrophobicContact CB-CD1 3.96Å; M1768-F1819 HydrophobicContact CB-CE1 3.99Å; M1768-F1819 HydrophobicContact CE-CE1 4.11Å; M1768-F1819 HydrophobicContact CE-CZ 3.94Å; M1768-F1819 HydrophobicContact CG-CD1 3.95Å; M1768-F1819 HydrophobicContact CG-CE1 3.57Å; M1768-F1819 HydrophobicContact CG-CZ 4.17Å; M1768-F1819 HydrophobicContact SD-CD1 4.43Å; M1768-F1819 HydrophobicContact SD-CE1 3.52Å; M1768-F1819 VanDerWaalsContact SD-CE1 3.54Å; M1768-F1819 WeakPolarHBondContact SD-CE1 3.33Å; M1768-F1819 HydrophobicContact SD-CZ 3.98Å
1769	T	97.5	Very high	92.4	Very high	18.2 Å²	18.2	40.1 Å²	40.1	11%	0.112	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	122.9	175.4	-58.6	0	0	0	0	110.6	V1737 I1738 K1771 I1817 N1818	V1737-T1769 HydrophobicContact CG1-CG2 4.02Å; I1738-T1769 CarbonylContact O-C 3.54Å; I1738-T1769 WeakPolarHBondContact O-CA 3.22Å; T1769-K1771 HydrophobicContact CG2-CG 4.1Å; T1769-I1817 CarbonylContact O-C 3.5Å; T1769-I1817 WeakPolarHBondContact O-CA 3.35Å; T1769-N1818 PolarHBondContact N-O 3.27Å; T1769-N1818 PolarHBondContact O-N 3.12Å
1770	V	97	Very high	92.6	Very high	15.4 Å²	15.4	36.9 Å²	36.9	9%	0.093	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	118.8	172.8	-177	0	0	0	0	109.1	V1737 I1738 M1768 L1772 M1815 G1816 I1817	V1737-V1770 CarbonylContact C-O 3.6Å; V1737-V1770 WeakPolarHBondContact CA-O 3.3Å; I1738-V1770 HydrophobicContact CB-CB 4.35Å; I1738-V1770 PolarHBondContact N-O 3.08Å; I1738-V1770 PolarHBondContact O-N 3.13Å; M1768-V1770 HydrophobicContact CE-CG2 3.59Å; M1768-V1770 VanDerWaalsContact CE-CG2 3.5Å; M1768-V1770 HydrophobicContact CG-CG2 4.48Å; V1770-L1772 HydrophobicContact CG1-CD2 3.93Å; V1770-L1772 HydrophobicContact CG1-CG 4.32Å; V1770-M1815 HydrophobicContact CG1-CE 3.62Å; V1770-M1815 HydrophobicContact CG1-CG 4.36Å; V1770-G1816 CarbonylContact C-O 3.57Å; V1770-G1816 WeakPolarHBondContact CA-O 3.41Å; V1770-I1817 HydrophobicContact CG2-CG1 4.49Å; V1770-I1817 HydrophobicContact CG2-CG2 4.41Å
1771	K	96.2	Very high	92.7	Very high	120.8 Å²	120.8	38.3 Å²	38.3	53%	0.525	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	135.1	174.5	-60.6	-172.9	178.7	-177.6	0	110.1	G1736 V1737 T1769 M1815 G1816	G1736-K1771 CarbonylContact O-C 3.55Å; G1736-K1771 WeakPolarHBondContact O-CA 3.26Å; V1737-K1771 HydrophobicContact CG1-CG 4.45Å; V1737-K1771 HydrophobicContact CG2-CG 4.32Å; T1769-K1771 HydrophobicContact CG2-CG 4.1Å; K1771-M1815 WeakPolarHBondContact O-CA 3.36Å; K1771-G1816 PolarHBondContact N-O 2.89Å; K1771-G1816 PolarHBondContact O-N 3.19Å
1772	L	94.4	Very high	92.6	Very high	26.6 Å²	26.6	36.8 Å²	36.8	14%	0.139	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	96.9	-174.4	-57.9	177.1	0	0	0	109.8	G1736 I1738 V1770 W1774 L1813 M1815	G1736-L1772 WeakPolarHBondContact O-CB 3.25Å; G1736-L1772 PolarHBondContact O-N 3.26Å; I1738-L1772 HydrophobicContact CD1-CD1 4.45Å; V1770-L1772 HydrophobicContact CG1-CD2 3.93Å; V1770-L1772 HydrophobicContact CG1-CG 4.32Å; L1772-W1774 HydrophobicContact CB-CZ2 4.24Å; L1772-W1774 HydrophobicContact CD1-CZ2 4Å; L1772-W1774 VanDerWaalsContact O-CD1 3.31Å; L1772-W1774 PolarHBondContact O-N 3.11Å; L1772-W1774 PolarHBondContact O-NE1 2.94Å; L1772-L1813 HydrophobicContact CB-CD1 3.99Å; L1772-L1813 HydrophobicContact CD2-CD1 4.33Å; L1772-L1813 HydrophobicContact CD2-CD2 4.29Å; L1772-M1815 HydrophobicContact CD2-CE 3.75Å; L1772-M1815 HydrophobicContact CD2-CG 4.06Å; L1772-M1815 HydrophobicContact CD2-SD 4.32Å
1773	D	93.1	Very high	92.5	Very high	70.2 Å²	70.2	35.4 Å²	35.4	38%	0.375	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	102.5	175.9	-140.1	-0.7	0	0	0	110.6	L1775 L1813 A1814 H1975	D1773-L1775 PolarHBondContact O-N 3.11Å; D1773-L1813 WeakPolarHBondContact O-CA 3.45Å; D1773-L1813 WeakPolarHBondContact O-CD1 3.23Å; D1773-A1814 HydrophobicContact CB-CB 4.2Å; D1773-A1814 PolarHBondContact N-O 3.09Å; D1773-A1814 PolarHBondContact O-N 2.85Å; D1773-H1975 IonicContact OD2-CD2 3.31Å; D1773-H1975 PolarHBondContact OD2-CD2 3.22Å; D1773-H1975 VanDerWaalsContact OD2-CD2 3.25Å
1774	W	92.4	Very high	92.3	Very high	20.4 Å²	20.4	34.7 Å²	34.7	8%	0.077	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	115.8	-177.8	-56	97.4	0	0	0	111.2	W1687 R1691 L1772 S1776 P1780 A1810 L1813 F1877 L1880 R1932	W1687-W1774 HydrophobicContact CB-CH2 3.69Å; W1687-W1774 VanDerWaalsContact CB-CH2 3.48Å; W1687-W1774 HydrophobicContact CB-CZ2 4.35Å; W1687-W1774 HydrophobicContact CB-CZ3 3.96Å; W1687-W1774 AromaticContact CD1-CH2 3.96Å; W1687-W1774 AromaticContact CD1-CZ3 3.53Å; W1687-W1774 VanDerWaalsContact CD1-CZ3 3.47Å; W1687-W1774 AromaticContact CG-CH2 3.91Å; W1687-W1774 HydrophobicContact CG-CH2 4.13Å; W1687-W1774 AromaticContact CG-CZ3 3.87Å; W1687-W1774 HydrophobicContact CG-CZ3 3.87Å; R1691-W1774 VanDerWaalsContact CD-CE2 3.44Å; R1691-W1774 HydrophobicContact CG-CZ2 4.43Å; R1691-W1774 VanDerWaalsContact CZ-CG 3.45Å; R1691-W1774 VanDerWaalsContact NE-CD1 3.33Å; R1691-W1774 VanDerWaalsContact NE-CG 3.33Å; R1691-W1774 VanDerWaalsContact NH1-CE3 3.34Å; R1691-W1774 VanDerWaalsContact NH1-CG 3.34Å; L1772-W1774 HydrophobicContact CB-CZ2 4.24Å; L1772-W1774 HydrophobicContact CD1-CZ2 4Å; L1772-W1774 VanDerWaalsContact O-CD1 3.31Å; L1772-W1774 PolarHBondContact O-N 3.11Å; L1772-W1774 PolarHBondContact O-NE1 2.94Å; W1774-S1776 PolarHBondContact O-N 3.04Å; W1774-S1776 VanDerWaalsContact O-N 3.1Å; W1774-P1780 HydrophobicContact CB-CB 3.82Å; W1774-P1780 HydrophobicContact CB-CG 4.47Å; W1774-P1780 WeakPolarHBondContact O-CB 3.18Å; W1774-P1780 WeakPolarHBondContact O-CG 3.24Å; W1774-A1810 HydrophobicContact CB-CB 4.29Å; W1774-A1810 HydrophobicContact CD2-CB 4.37Å; W1774-A1810 HydrophobicContact CE3-CB 3.67Å; W1774-A1810 HydrophobicContact CZ3-CB 4.45Å; W1774-L1813 HydrophobicContact CD2-CD1 4.04Å; W1774-L1813 HydrophobicContact CE3-CD1 3.94Å; W1774-L1813 HydrophobicContact CG-CD1 4.49Å; W1774-L1813 HydrophobicContact CH2-CD1 4.46Å; W1774-L1813 HydrophobicContact CH2-CD2 4.43Å; W1774-L1813 HydrophobicContact CZ3-CD1 4.23Å; W1774-L1813 HydrophobicContact CZ3-CD2 4.2Å; W1774-F1877 AromaticContact CH2-CE2 3.91Å; W1774-F1877 HydrophobicContact CH2-CE2 4.07Å; W1774-F1877 HydrophobicContact CZ3-CE2 4.26Å; W1774-L1880 HydrophobicContact CE3-CD2 3.87Å; W1774-L1880 HydrophobicContact CZ3-CD1 4.02Å; W1774-L1880 HydrophobicContact CZ3-CD2 3.43Å; W1774-L1880 VanDerWaalsContact CZ3-CD2 3.43Å; W1774-R1932 PolarHBondContact O-NH2 3.13Å
1775	L	91.3	Very high	92.2	Very high	17.4 Å²	17.4	37 Å²	37	9%	0.091	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	84.7	-178.1	-52.9	-179.5	0	0	0	110.1	D1773 N1811 R1812 A1814 Q1882 H1975 V1978	D1773-L1775 PolarHBondContact O-N 3.11Å; L1775-N1811 PolarHBondContact O-N 3.23Å; L1775-R1812 WeakPolarHBondContact CA-O 3.39Å; L1775-R1812 HydrophobicContact CB-CB 3.93Å; L1775-R1812 WeakPolarHBondContact CB-O 3.48Å; L1775-R1812 HydrophobicContact CD1-CB 3.87Å; L1775-R1812 HydrophobicContact CG-CB 4.33Å; L1775-R1812 PolarHBondContact N-O 3.01Å; L1775-R1812 PolarHBondContact O-N 3.02Å; L1775-A1814 HydrophobicContact CD1-CB 4.46Å; L1775-Q1882 HydrophobicContact CD1-CB 4.35Å; L1775-H1975 HydrophobicContact CD2-CB 3.7Å; L1775-V1978 HydrophobicContact CB-CB 4.31Å; L1775-V1978 HydrophobicContact CB-CG2 3.81Å
1776	S	90.2	Very high	92.1	Very high	4.8 Å²	4.8	35.1 Å²	35.1	3%	0.034	18%	0.176	C	C	.	.			trans	-93.7	168.3	172.5	-43.5	0	0	0	0	111.6	R1691 W1774 R1778 P1780 F1808 R1809 A1810 R1932 V1978	R1691-S1776 PolarHBondContact NH1-OG 3.05Å; W1774-S1776 PolarHBondContact O-N 3.04Å; W1774-S1776 VanDerWaalsContact O-N 3.1Å; S1776-R1778 VanDerWaalsContact C-N 3.33Å; S1776-R1778 CarbonylContact C-O 3.51Å; S1776-R1778 VanDerWaalsContact CB-O 3.29Å; S1776-R1778 WeakPolarHBondContact CB-O 3.4Å; S1776-R1778 PolarHBondContact OG-O 3.31Å; S1776-P1780 WeakPolarHBondContact OG-CA 3.42Å; S1776-P1780 VanDerWaalsContact OG-CB 3.31Å; S1776-P1780 WeakPolarHBondContact OG-CB 3.35Å; S1776-P1780 WeakPolarHBondContact OG-CD 3.45Å; S1776-P1780 VanDerWaalsContact OG-N 3.15Å; S1776-F1808 PolarHBondContact OG-O 3.07Å; S1776-R1809 WeakPolarHBondContact CB-O 3.33Å; S1776-R1809 PolarHBondContact OG-O 3.16Å; S1776-A1810 PolarHBondContact OG-N 3.09Å; S1776-R1932 WeakPolarHBondContact O-CG 3.4Å; S1776-R1932 PolarHBondContact O-NE 2.97Å; S1776-R1932 VanDerWaalsContact O-NE 3.09Å; S1776-V1978 WeakPolarHBondContact O-CG2 3.26Å
1777	L	87.4	Confident	91.7	Very high	32 Å²	32	39.7 Å²	39.7	17%	0.168	20%	0.196	C	C	.	.	S	Bend	trans	-71.8	-30.8	178.7	-70.4	-179.6	0	0	0	113.1	K1806 Y1807 L1930 L1933 V1978 I1980	L1777-K1806 HydrophobicContact CD1-CG 4.23Å; L1777-K1806 WeakPolarHBondContact CD1-O 3.26Å; L1777-Y1807 HydrophobicContact CB-CD1 4.24Å; L1777-Y1807 HydrophobicContact CD1-CD1 4.39Å; L1777-Y1807 PolarHBondContact N-O 3.5Å; L1777-L1930 HydrophobicContact CD2-CD2 3.38Å; L1777-L1930 VanDerWaalsContact CD2-CD2 3.45Å; L1777-L1933 PolarHBondContact O-N 3.38Å; L1777-V1978 HydrophobicContact CD2-CG1 4.22Å; L1777-I1980 HydrophobicContact CD2-CD1 4.21Å
1778	R	87	Confident	91.3	Very high	122 Å²	122	39.7 Å²	39.7	46%	0.46	19%	0.194	S	C	.	.	S	Bend	trans	-119.3	-164.6	170.1	-74.5	-170.1	173.6	-177.4	-3.3	109	S1776 P1780 Y1807 L1933	S1776-R1778 VanDerWaalsContact C-N 3.33Å; S1776-R1778 CarbonylContact C-O 3.51Å; S1776-R1778 VanDerWaalsContact CB-O 3.29Å; S1776-R1778 WeakPolarHBondContact CB-O 3.4Å; S1776-R1778 PolarHBondContact OG-O 3.31Å; R1778-P1780 WeakPolarHBondContact O-CD 3.33Å; R1778-P1780 VanDerWaalsContact O-N 3.16Å; R1778-Y1807 HydrophobicContact CG-CD1 3.99Å; R1778-Y1807 HydrophobicContact CG-CG 4.35Å; R1778-Y1807 PolarHBondContact N-O 3.06Å; R1778-L1933 HydrophobicContact CG-CB 4.31Å
1779	D	87.6	Confident	90.6	Very high	62.2 Å²	62.2	39.2 Å²	39.2	33%	0.333	19%	0.193	S	C	.	.			trans	-51.1	120.1	171	-172.4	-11.2	0	0	0	111	N1781 D1782	D1779-N1781 PolarHBondContact O-N 3.18Å; D1779-N1781 WeakPolarHBondContact OD1-CB 3.41Å; D1779-N1781 PolarHBondContact OD1-N 2.99Å; D1779-D1782 HydrophobicContact CB-CB 4.06Å; D1779-D1782 PolarHBondContact O-N 2.96Å
1780	P	89.4	Confident	89.8	Confident	18.8 Å²	18.8	39.7 Å²	39.7	12%	0.122	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-22.4	175.6	26.2	-34.6	0	0	0	113.8	R1691 W1774 S1776 R1778 F1808	R1691-P1780 VanDerWaalsContact NH1-C 3.3Å; R1691-P1780 PolarHBondContact NH1-O 3.27Å; R1691-P1780 VanDerWaalsContact NH2-CB 3.29Å; R1691-P1780 PolarHBondContact NH2-O 3.04Å; W1774-P1780 HydrophobicContact CB-CB 3.82Å; W1774-P1780 HydrophobicContact CB-CG 4.47Å; W1774-P1780 WeakPolarHBondContact O-CB 3.18Å; W1774-P1780 WeakPolarHBondContact O-CG 3.24Å; S1776-P1780 WeakPolarHBondContact OG-CA 3.42Å; S1776-P1780 VanDerWaalsContact OG-CB 3.31Å; S1776-P1780 WeakPolarHBondContact OG-CB 3.35Å; S1776-P1780 WeakPolarHBondContact OG-CD 3.45Å; S1776-P1780 VanDerWaalsContact OG-N 3.15Å; R1778-P1780 WeakPolarHBondContact O-CD 3.33Å; R1778-P1780 VanDerWaalsContact O-N 3.16Å; P1780-F1808 WeakPolarHBondContact O-CD2 3.37Å; P1780-F1808 VanDerWaalsContact O-CE2 3.25Å; P1780-F1808 WeakPolarHBondContact O-CE2 3.39Å
1781	N	91	Very high	88.7	Confident	38.4 Å²	38.4	40.5 Å²	40.5	21%	0.205	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-9.1	-178.2	-62.9	-23.5	0	0	0	112.7	D1553 S1554 N1735 D1779 H1783	D1553-N1781 WeakPolarHBondContact CB-ND2 3.39Å; D1553-N1781 WeakPolarHBondContact O-CB 3Å; D1553-N1781 PolarHBondContact O-ND2 3.47Å; S1554-N1781 VanDerWaalsContact CB-O 3.24Å; S1554-N1781 WeakPolarHBondContact CB-O 3.21Å; S1554-N1781 PolarHBondContact OG-O 3.31Å; S1554-N1781 VanDerWaalsContact OG-O 3.06Å; N1735-N1781 PolarHBondContact ND2-OD1 3.12Å; D1779-N1781 PolarHBondContact O-N 3.18Å; D1779-N1781 WeakPolarHBondContact OD1-CB 3.41Å; D1779-N1781 PolarHBondContact OD1-N 2.99Å; N1781-H1783 PolarHBondContact O-CD2 2.79Å; N1781-H1783 VanDerWaalsContact O-CD2 3.29Å; N1781-H1783 PolarHBondContact O-N 3Å
1782	D	90.9	Very high	87.7	Confident	32.2 Å²	32.2	40.5 Å²	40.5	17%	0.172	20%	0.201	C	C	.	.			trans	-75.4	68.6	176.3	-175.7	7.2	0	0	0	112.3	P1555 D1779 H1784 S1785 F1808	P1555-D1782 HydrophobicContact CG-CB 3.64Å; D1779-D1782 HydrophobicContact CB-CB 4.06Å; D1779-D1782 PolarHBondContact O-N 2.96Å; D1782-H1784 VanDerWaalsContact C-N 3.31Å; D1782-H1784 PolarHBondContact OD1-N 3.09Å; D1782-S1785 VanDerWaalsContact CG-CB 3.5Å; D1782-S1785 VanDerWaalsContact CG-OG 3.28Å; D1782-S1785 PolarHBondContact O-OG 3.24Å; D1782-S1785 VanDerWaalsContact OD1-CB 3.28Å; D1782-S1785 WeakPolarHBondContact OD1-CB 3.39Å; D1782-S1785 PolarHBondContact OD1-N 3.16Å; D1782-S1785 PolarHBondContact OD1-OG 2.91Å; D1782-S1785 VanDerWaalsContact OD2-CB 3.25Å; D1782-S1785 WeakPolarHBondContact OD2-CB 3.42Å; D1782-S1785 PolarHBondContact OD2-OG 3.17Å; D1782-F1808 WeakPolarHBondContact O-CD2 3.47Å
1783	H	91.8	Very high	86.9	Confident	1.4 Å²	1.4	44.6 Å²	44.6	1%	0.006	22%	0.216	C	C	.	.			trans	-81.4	-10.2	176.9	80.1	115.7	0	0	0	112.8	D1551 K1638 Y1640 L1692 H1695 N1781 F1808	D1551-H1783 IonicContact OD2-CD2 2.98Å; D1551-H1783 IonicContact OD2-CE1 3Å; D1551-H1783 IonicContact OD2-NE2 3.36Å; D1551-H1783 PolarHBondContact OD2-NE2 3.05Å; D1551-H1783 VanDerWaalsContact OD2-NE2 3.15Å; K1638-H1783 VanDerWaalsContact CE-ND1 3.27Å; K1638-H1783 WeakPolarHBondContact CE-ND1 3.29Å; K1638-H1783 PolarHBondContact NZ-CE1 3.11Å; K1638-H1783 PolarHBondContact NZ-ND1 3.02Å; K1638-H1783 VanDerWaalsContact NZ-ND1 3.14Å; K1638-H1783 PolarHBondContact NZ-O 3.29Å; Y1640-H1783 AromaticContact CZ-CE1 3.93Å; Y1640-H1783 PolarHBondContact OH-CE1 3.19Å; Y1640-H1783 VanDerWaalsContact OH-CE1 3.3Å; Y1640-H1783 PolarHBondContact OH-NE2 2.83Å; L1692-H1783 HydrophobicContact CD1-CB 4.05Å; L1692-H1783 PolarHBondContact O-ND1 2.8Å; H1695-H1783 AromaticContact CD2-CE1 3.7Å; H1695-H1783 AromaticContact CD2-ND1 3.99Å; H1695-H1783 AromaticContact CE1-CD2 3.84Å; H1695-H1783 AromaticContact CE1-CE1 3.36Å; H1695-H1783 PolarHBondContact CE1-CE1 3.17Å; H1695-H1783 VanDerWaalsContact CE1-CE1 3.43Å; H1695-H1783 AromaticContact CE1-CG 3.54Å; H1695-H1783 VanDerWaalsContact CE1-CG 3.48Å; H1695-H1783 AromaticContact CE1-ND1 3.18Å; H1695-H1783 PolarHBondContact CE1-ND1 3.05Å; H1695-H1783 VanDerWaalsContact CE1-ND1 3.27Å; H1695-H1783 AromaticContact CE1-NE2 3.86Å; H1695-H1783 AromaticContact CG-CE1 3.91Å; H1695-H1783 AromaticContact ND1-CE1 3.86Å; H1695-H1783 AromaticContact ND1-ND1 3.96Å; H1695-H1783 AromaticContact ND1-NE2 4Å; H1695-H1783 AromaticContact NE2-CE1 3.23Å; H1695-H1783 PolarHBondContact NE2-CE1 3.02Å; H1695-H1783 VanDerWaalsContact NE2-CE1 3.31Å; H1695-H1783 AromaticContact NE2-CG 3.95Å; H1695-H1783 AromaticContact NE2-ND1 3.12Å; H1695-H1783 PolarHBondContact NE2-ND1 3.06Å; H1695-H1783 VanDerWaalsContact NE2-ND1 3.15Å; N1781-H1783 PolarHBondContact O-CD2 2.79Å; N1781-H1783 VanDerWaalsContact O-CD2 3.29Å; N1781-H1783 PolarHBondContact O-N 3Å; H1783-F1808 HydrophobicContact CB-CD2 4.17Å; H1783-F1808 HydrophobicContact CB-CE2 3.61Å; H1783-F1808 HydrophobicContact CB-CZ 4.2Å
1784	H	89.9	Confident	86.2	Confident	5 Å²	5	41.9 Å²	41.9	2%	0.023	20%	0.201	C	C	.	.	S	Bend	trans	-80.3	-28.5	176.3	-72.7	-73.3	0	0	0	112.6	W1556 P1557 L1559 K1638 Y1640 D1782 V1786	W1556-H1784 AromaticContact CE3-NE2 3.73Å; W1556-H1784 AromaticContact CZ3-CE1 3.7Å; W1556-H1784 AromaticContact CZ3-NE2 3.64Å; P1557-H1784 HydrophobicContact CG-CB 3.61Å; L1559-H1784 WeakPolarHBondContact CD1-ND1 3.37Å; K1638-H1784 PolarHBondContact NZ-ND1 2.85Å; Y1640-H1784 PolarHBondContact OH-CE1 3.17Å; Y1640-H1784 VanDerWaalsContact OH-CE1 3.25Å; Y1640-H1784 PolarHBondContact OH-NE2 2.92Å; D1782-H1784 VanDerWaalsContact C-N 3.31Å; D1782-H1784 PolarHBondContact OD1-N 3.09Å; H1784-V1786 PolarHBondContact O-N 3.14Å
1785	S	88.7	Confident	85.7	Confident	52.8 Å²	52.8	43.4 Å²	43.4	37%	0.369	22%	0.215	S	C	.	.	S	Bend	trans	-68.9	-13.4	174.1	70.3	0	0	0	0	114.5	D1782 K1787	D1782-S1785 VanDerWaalsContact CG-CB 3.5Å; D1782-S1785 VanDerWaalsContact CG-OG 3.28Å; D1782-S1785 PolarHBondContact O-OG 3.24Å; D1782-S1785 VanDerWaalsContact OD1-CB 3.28Å; D1782-S1785 WeakPolarHBondContact OD1-CB 3.39Å; D1782-S1785 PolarHBondContact OD1-N 3.16Å; D1782-S1785 PolarHBondContact OD1-OG 2.91Å; D1782-S1785 VanDerWaalsContact OD2-CB 3.25Å; D1782-S1785 WeakPolarHBondContact OD2-CB 3.42Å; D1782-S1785 PolarHBondContact OD2-OG 3.17Å; S1785-K1787 WeakPolarHBondContact O-CG 3.41Å; S1785-K1787 PolarHBondContact O-N 3.07Å; S1785-K1787 VanDerWaalsContact O-N 3.17Å
1786	V	89.6	Confident	85	Confident	13.6 Å²	13.6	47.5 Å²	47.5	8%	0.082	24%	0.243	C	C	.	.			trans	-72	106.7	-178.4	180	0	0	0	0	110.6	L1692 H1784 Y1788 F1805 F1808	L1692-V1786 HydrophobicContact CD1-CB 4.28Å; L1692-V1786 HydrophobicContact CD1-CG1 4.34Å; L1692-V1786 HydrophobicContact CD1-CG2 4.25Å; L1692-V1786 HydrophobicContact CD2-CG1 4.27Å; H1784-V1786 PolarHBondContact O-N 3.14Å; V1786-Y1788 HydrophobicContact CG1-CD2 4.35Å; V1786-Y1788 HydrophobicContact CG1-CE2 4.05Å; V1786-F1805 HydrophobicContact CG1-CD1 3.5Å; V1786-F1805 VanDerWaalsContact CG1-CD1 3.48Å; V1786-F1805 HydrophobicContact CG1-CE1 3.48Å; V1786-F1805 VanDerWaalsContact CG1-CE1 3.45Å; V1786-F1805 HydrophobicContact CG1-CZ 4.5Å; V1786-F1808 HydrophobicContact CG2-CB 3.53Å; V1786-F1808 VanDerWaalsContact CG2-CB 3.49Å; V1786-F1808 HydrophobicContact CG2-CD1 4.1Å; V1786-F1808 HydrophobicContact CG2-CD2 4.22Å; V1786-F1808 HydrophobicContact CG2-CG 3.69Å
1787	K	87.6	Confident	84.5	Confident	100.8 Å²	100.8	57.7 Å²	57.7	44%	0.438	28%	0.28	S	S	.	.			trans	-105.8	116.1	178.4	-61.4	-97.2	-177.5	177.8	0	110.9	D1610 S1785 S1804	D1610-K1787 WeakPolarHBondContact OD1-CD 3.22Å; D1610-K1787 WeakPolarHBondContact OD1-CE 3.45Å; D1610-K1787 IonicContact OD1-NZ 3.39Å; D1610-K1787 PolarHBondContact OD1-NZ 2.95Å; D1610-K1787 VanDerWaalsContact OD2-CD 3.29Å; D1610-K1787 WeakPolarHBondContact OD2-CD 3.3Å; D1610-K1787 WeakPolarHBondContact OD2-CE 3.43Å; D1610-K1787 IonicContact OD2-NZ 3.2Å; D1610-K1787 PolarHBondContact OD2-NZ 3Å; S1785-K1787 WeakPolarHBondContact O-CG 3.41Å; S1785-K1787 PolarHBondContact O-N 3.07Å; S1785-K1787 VanDerWaalsContact O-N 3.17Å; K1787-S1804 VanDerWaalsContact O-CB 3.31Å; K1787-S1804 WeakPolarHBondContact O-CB 3.26Å; K1787-S1804 PolarHBondContact O-OG 2.91Å
1788	Y	86.7	Confident	84	Confident	43 Å²	43	60.7 Å²	60.7	17%	0.169	29%	0.294	C	S	.	.			trans	-72.9	142.3	178.6	-78.8	-111.9	0	0	0	111.3	G1613 S1634 P1636 D1678 L1692 V1786 F1805	G1613-Y1788 WeakPolarHBondContact CA-O 3.23Å; G1613-Y1788 PolarHBondContact N-O 3.4Å; S1634-Y1788 VanDerWaalsContact OG-CB 3.28Å; S1634-Y1788 WeakPolarHBondContact OG-CB 3.28Å; P1636-Y1788 VanDerWaalsContact CD-CZ 3.4Å; P1636-Y1788 HydrophobicContact CG-CD2 4.38Å; P1636-Y1788 HydrophobicContact CG-CE2 3.64Å; P1636-Y1788 WeakPolarHBondContact CG-OH 3.43Å; D1678-Y1788 HydrophobicContact CB-CD1 3.82Å; D1678-Y1788 HydrophobicContact CB-CE1 4.44Å; D1678-Y1788 WeakPolarHBondContact OD2-CA 3.19Å; L1692-Y1788 HydrophobicContact CD2-CE2 4.22Å; L1692-Y1788 VanDerWaalsContact CD2-OH 3.24Å; L1692-Y1788 WeakPolarHBondContact CD2-OH 3.37Å; V1786-Y1788 HydrophobicContact CG1-CD2 4.35Å; V1786-Y1788 HydrophobicContact CG1-CE2 4.05Å; Y1788-F1805 HydrophobicContact CD1-CZ 4.45Å; Y1788-F1805 HydrophobicContact CE1-CE1 4.43Å; Y1788-F1805 AromaticContact CE1-CZ 3.83Å; Y1788-F1805 HydrophobicContact CE1-CZ 3.83Å; Y1788-F1805 AromaticContact CE2-CE1 3.9Å; Y1788-F1805 HydrophobicContact CE2-CE1 3.97Å; Y1788-F1805 HydrophobicContact CE2-CZ 4.14Å; Y1788-F1805 AromaticContact CZ-CE1 3.81Å; Y1788-F1805 AromaticContact CZ-CZ 3.65Å
1789	C	83.5	Confident	83.4	Confident	8.2 Å²	8.2	58.3 Å²	58.3	6%	0.055	29%	0.288	C	S	.	.			trans	-126	138.3	179.7	-168.3	0	0	0	0	111.6	D1678 H1802	D1678-C1789 WeakPolarHBondContact CA-O 3.31Å; D1678-C1789 WeakPolarHBondContact CB-O 3.16Å; D1678-C1789 PolarHBondContact OD2-N 3.27Å; D1678-C1789 VanDerWaalsContact OD2-N 3.14Å; C1789-H1802 VanDerWaalsContact CB-CE1 3.44Å; C1789-H1802 WeakPolarHBondContact CB-CE1 3.44Å; C1789-H1802 VanDerWaalsContact CB-NE2 3.31Å; C1789-H1802 WeakPolarHBondContact CB-NE2 3.25Å
1790	Y	80.1	Confident	82.8	Confident	28.6 Å²	28.6	60.3 Å²	60.3	11%	0.112	30%	0.302	C	S	.	.			trans	-84.2	137.4	168.4	-111.6	-95.4	0	0	0	110.3	K1612 G1613 H1615 R1632 F1633 K1677 D1792 Y1793	K1612-Y1790 WeakPolarHBondContact O-CB 3.32Å; K1612-Y1790 PolarHBondContact O-N 3.07Å; G1613-Y1790 VanDerWaalsContact O-CE2 3.32Å; G1613-Y1790 WeakPolarHBondContact O-CE2 3.34Å; H1615-Y1790 HydrophobicContact CB-CD1 4.18Å; H1615-Y1790 HydrophobicContact CB-CD2 4.08Å; H1615-Y1790 HydrophobicContact CB-CE1 3.92Å; H1615-Y1790 HydrophobicContact CB-CE2 3.75Å; H1615-Y1790 VanDerWaalsContact CB-CE2 3.45Å; H1615-Y1790 HydrophobicContact CB-CG 4.3Å; R1632-Y1790 WeakPolarHBondContact O-CE2 3.45Å; R1632-Y1790 PolarHBondContact O-OH 2.87Å; F1633-Y1790 PolarHBondContact O-OH 2.91Å; K1677-Y1790 HydrophobicContact CB-CD1 4.21Å; K1677-Y1790 HydrophobicContact CB-CD2 3.91Å; K1677-Y1790 HydrophobicContact CB-CE1 3.87Å; K1677-Y1790 HydrophobicContact CB-CE2 3.88Å; K1677-Y1790 HydrophobicContact CD-CD2 4.28Å; K1677-Y1790 HydrophobicContact CD-CE1 3.86Å; K1677-Y1790 HydrophobicContact CD-CE2 3.92Å; K1677-Y1790 WeakPolarHBondContact CD-OH 3.42Å; K1677-Y1790 WeakPolarHBondContact CE-OH 3.25Å; K1677-Y1790 HydrophobicContact CG-CD2 4.45Å; K1677-Y1790 HydrophobicContact CG-CE1 4.03Å; K1677-Y1790 HydrophobicContact CG-CE2 4.12Å; K1677-Y1790 PolarHBondContact NZ-OH 2.98Å; K1677-Y1790 VanDerWaalsContact NZ-OH 3.11Å; Y1790-D1792 VanDerWaalsContact C-N 3.29Å; Y1790-D1792 HydrophobicContact CD1-CB 3.8Å; Y1790-D1792 HydrophobicContact CE1-CB 3.69Å; Y1790-D1792 VanDerWaalsContact CE1-CG 3.44Å; Y1790-D1792 WeakPolarHBondContact CE1-OD2 3.4Å; Y1790-D1792 PolarHBondContact O-N 3.11Å; Y1790-D1792 VanDerWaalsContact O-N 3.15Å; Y1790-Y1793 HydrophobicContact CD1-CD2 4.17Å; Y1790-Y1793 AromaticContact CD1-CE2 3.88Å; Y1790-Y1793 HydrophobicContact CD1-CE2 3.96Å; Y1790-Y1793 HydrophobicContact CG-CE2 4.43Å; Y1790-Y1793 PolarHBondContact O-N 3.17Å
1791	M	72.9	Confident	82.1	Confident	31.6 Å²	31.6	67.1 Å²	67.1	16%	0.156	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-62.6	-30.1	-175.1	-85.9	-122.7	109.5	0	0	113.7	K1679 Y1793 L1794 Q1799 H1802	K1679-M1791 HydrophobicContact CB-CE 4.26Å; K1679-M1791 HydrophobicContact CB-CG 4.18Å; K1679-M1791 HydrophobicContact CB-SD 4Å; K1679-M1791 HydrophobicContact CD-CG 4.15Å; K1679-M1791 HydrophobicContact CD-SD 3.92Å; K1679-M1791 HydrophobicContact CG-CG 4.1Å; K1679-M1791 HydrophobicContact CG-SD 4.35Å; K1679-M1791 PolarHBondContact NZ-SD 2.82Å; M1791-Y1793 VanDerWaalsContact C-N 3.25Å; M1791-Y1793 PolarHBondContact O-N 2.93Å; M1791-Y1793 VanDerWaalsContact O-N 3.14Å; M1791-L1794 HydrophobicContact CE-CD1 4.21Å; M1791-L1794 WeakPolarHBondContact O-CB 3.34Å; M1791-L1794 PolarHBondContact O-N 2.97Å; M1791-L1794 HydrophobicContact SD-CD1 3.95Å; M1791-Q1799 HydrophobicContact CB-CG 4.39Å; M1791-Q1799 VanDerWaalsContact CE-CA 3.44Å; M1791-Q1799 HydrophobicContact CE-CB 3.68Å; M1791-Q1799 VanDerWaalsContact CE-CB 3.42Å; M1791-Q1799 HydrophobicContact CE-CG 3.86Å; M1791-Q1799 VanDerWaalsContact CE-O 3.24Å; M1791-Q1799 WeakPolarHBondContact CE-O 3.44Å; M1791-Q1799 HydrophobicContact CG-CG 3.82Å; M1791-Q1799 PolarHBondContact O-NE2 2.98Å; M1791-Q1799 VanDerWaalsContact O-NE2 3.15Å; M1791-Q1799 HydrophobicContact SD-CB 4.12Å; M1791-Q1799 HydrophobicContact SD-CG 4.16Å; M1791-H1802 HydrophobicContact CE-CB 4.29Å
1792	D	75.9	Confident	81.8	Confident	120 Å²	120	67 Å²	67	64%	0.642	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-67.5	-18.5	-174.7	-55.2	-23.7	0	0	0	112.9	Y1790	Y1790-D1792 VanDerWaalsContact C-N 3.29Å; Y1790-D1792 HydrophobicContact CD1-CB 3.8Å; Y1790-D1792 HydrophobicContact CE1-CB 3.69Å; Y1790-D1792 VanDerWaalsContact CE1-CG 3.44Å; Y1790-D1792 WeakPolarHBondContact CE1-OD2 3.4Å; Y1790-D1792 PolarHBondContact O-N 3.11Å; Y1790-D1792 VanDerWaalsContact O-N 3.15Å
1793	Y	76.8	Confident	81.6	Confident	112.2 Å²	112.2	66.6 Å²	66.6	44%	0.44	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-90.7	-1.8	173.8	-59.8	-76	0	0	0	113.7	K1612 Q1614 Y1790 M1791	K1612-Y1793 WeakPolarHBondContact O-CD2 3.35Å; Q1614-Y1793 WeakPolarHBondContact O-CE2 3.23Å; Q1614-Y1793 VanDerWaalsContact O-CZ 3.27Å; Q1614-Y1793 PolarHBondContact O-OH 3.22Å; Y1790-Y1793 HydrophobicContact CD1-CD2 4.17Å; Y1790-Y1793 AromaticContact CD1-CE2 3.88Å; Y1790-Y1793 HydrophobicContact CD1-CE2 3.96Å; Y1790-Y1793 HydrophobicContact CG-CE2 4.43Å; Y1790-Y1793 PolarHBondContact O-N 3.17Å; M1791-Y1793 VanDerWaalsContact C-N 3.25Å; M1791-Y1793 PolarHBondContact O-N 2.93Å; M1791-Y1793 VanDerWaalsContact O-N 3.14Å
1794	L	79	Confident	81.4	Confident	14.4 Å²	14.4	67.5 Å²	67.5	8%	0.075	34%	0.335	C	S	.	.	S	Bend	trans	-103.1	140.9	-179.1	-62	175.6	0	0	0	110.2	M1791 E1798 Q1799 H1802	M1791-L1794 HydrophobicContact CE-CD1 4.21Å; M1791-L1794 WeakPolarHBondContact O-CB 3.34Å; M1791-L1794 PolarHBondContact O-N 2.97Å; M1791-L1794 HydrophobicContact SD-CD1 3.95Å; L1794-E1798 HydrophobicContact CB-CB 4.16Å; L1794-E1798 HydrophobicContact CD2-CB 4.38Å; L1794-Q1799 HydrophobicContact CB-CG 3.75Å; L1794-Q1799 PolarHBondContact O-NE2 3.15Å; L1794-H1802 HydrophobicContact CD1-CB 3.87Å; L1794-H1802 VanDerWaalsContact CD1-CG 3.43Å; L1794-H1802 WeakPolarHBondContact CD1-ND1 3.36Å
1795	S	81.7	Confident	81.4	Confident	51.4 Å²	51.4	67.8 Å²	67.8	36%	0.359	34%	0.336	S	S	.	.			trans	-64.6	153.8	171.6	66	0	0	0	0	111.1	R1797 E1798 Q1799	S1795-R1797 PolarHBondContact O-N 3.1Å; S1795-R1797 VanDerWaalsContact O-N 3.07Å; S1795-E1798 VanDerWaalsContact CB-OE2 3.24Å; S1795-E1798 WeakPolarHBondContact CB-OE2 3.41Å; S1795-E1798 PolarHBondContact N-OE2 3.09Å; S1795-E1798 WeakPolarHBondContact O-CB 3.12Å; S1795-E1798 PolarHBondContact O-N 3.07Å; S1795-E1798 VanDerWaalsContact OG-CD 3.24Å; S1795-E1798 VanDerWaalsContact OG-CG 3.24Å; S1795-E1798 WeakPolarHBondContact OG-CG 3.4Å; S1795-E1798 PolarHBondContact OG-N 3.14Å; S1795-E1798 PolarHBondContact OG-OE2 2.95Å; S1795-Q1799 WeakPolarHBondContact O-CG 3.41Å; S1795-Q1799 PolarHBondContact O-N 2.98Å
1796	P	77.8	Confident	81.4	Confident	103.4 Å²	103.4	69.9 Å²	69.9	67%	0.671	34%	0.339	S	S	*	.	H	α-helix	trans	-54.6	-30.6	-179.6	-28.3	35.3	0	0	0	114.5	T1800	P1796-T1800 PolarHBondContact O-OG1 2.89Å; P1796-T1800 VanDerWaalsContact O-OG1 3.08Å
1797	R	78.3	Confident	81.3	Confident	219.4 Å²	219.4	73.7 Å²	73.7	83%	0.828	35%	0.352	S	S	*	.	H	α-helix	trans	-69.5	-48.5	174.3	-70.5	-174.2	179	-176.8	0.3	111.6	S1795 Q1799 T1800	S1795-R1797 PolarHBondContact O-N 3.1Å; S1795-R1797 VanDerWaalsContact O-N 3.07Å; R1797-Q1799 VanDerWaalsContact C-N 3.3Å; R1797-Q1799 PolarHBondContact O-N 3.22Å; R1797-T1800 PolarHBondContact O-N 3.04Å; R1797-T1800 PolarHBondContact O-OG1 3.04Å
1798	E	77.9	Confident	81.4	Confident	95.6 Å²	95.6	69.1 Å²	69.1	45%	0.447	33%	0.332	S	S	.	.	H	α-helix	trans	-61.1	-40.5	177.1	-70.9	166.9	135.1	0	0	111.2	L1794 S1795 T1800 Q1801 H1802	L1794-E1798 HydrophobicContact CB-CB 4.16Å; L1794-E1798 HydrophobicContact CD2-CB 4.38Å; S1795-E1798 VanDerWaalsContact CB-OE2 3.24Å; S1795-E1798 WeakPolarHBondContact CB-OE2 3.41Å; S1795-E1798 PolarHBondContact N-OE2 3.09Å; S1795-E1798 WeakPolarHBondContact O-CB 3.12Å; S1795-E1798 PolarHBondContact O-N 3.07Å; S1795-E1798 VanDerWaalsContact OG-CD 3.24Å; S1795-E1798 VanDerWaalsContact OG-CG 3.24Å; S1795-E1798 WeakPolarHBondContact OG-CG 3.4Å; S1795-E1798 PolarHBondContact OG-N 3.14Å; S1795-E1798 PolarHBondContact OG-OE2 2.95Å; E1798-T1800 PolarHBondContact O-N 3.12Å; E1798-T1800 VanDerWaalsContact O-N 3.12Å; E1798-Q1801 CarbonylContact O-C 3.57Å; E1798-Q1801 PolarHBondContact O-N 2.95Å; E1798-H1802 WeakPolarHBondContact O-CA 3.22Å; E1798-H1802 VanDerWaalsContact O-CB 3.25Å; E1798-H1802 WeakPolarHBondContact O-CB 3.38Å; E1798-H1802 PolarHBondContact O-N 2.96Å
1799	Q	74.6	Confident	81.6	Confident	71.6 Å²	71.6	67.8 Å²	67.8	34%	0.335	33%	0.327	S	S	.	.	H	α-helix	trans	-54.4	-33	178.5	-70.7	178.8	19.8	0	0	113.1	M1791 L1794 S1795 R1797	M1791-Q1799 HydrophobicContact CB-CG 4.39Å; M1791-Q1799 VanDerWaalsContact CE-CA 3.44Å; M1791-Q1799 HydrophobicContact CE-CB 3.68Å; M1791-Q1799 VanDerWaalsContact CE-CB 3.42Å; M1791-Q1799 HydrophobicContact CE-CG 3.86Å; M1791-Q1799 VanDerWaalsContact CE-O 3.24Å; M1791-Q1799 WeakPolarHBondContact CE-O 3.44Å; M1791-Q1799 HydrophobicContact CG-CG 3.82Å; M1791-Q1799 PolarHBondContact O-NE2 2.98Å; M1791-Q1799 VanDerWaalsContact O-NE2 3.15Å; M1791-Q1799 HydrophobicContact SD-CB 4.12Å; M1791-Q1799 HydrophobicContact SD-CG 4.16Å; L1794-Q1799 HydrophobicContact CB-CG 3.75Å; L1794-Q1799 PolarHBondContact O-NE2 3.15Å; S1795-Q1799 WeakPolarHBondContact O-CG 3.41Å; S1795-Q1799 PolarHBondContact O-N 2.98Å; R1797-Q1799 VanDerWaalsContact C-N 3.3Å; R1797-Q1799 PolarHBondContact O-N 3.22Å
1800	T	74.7	Confident	81.9	Confident	104 Å²	104	67.6 Å²	67.6	64%	0.638	33%	0.326	S	S	*	.	H	α-helix	trans	-77.2	-24.6	179.7	32.2	0	0	0	0	113.9	P1796 R1797 E1798	P1796-T1800 PolarHBondContact O-OG1 2.89Å; P1796-T1800 VanDerWaalsContact O-OG1 3.08Å; R1797-T1800 PolarHBondContact O-N 3.04Å; R1797-T1800 PolarHBondContact O-OG1 3.04Å; E1798-T1800 PolarHBondContact O-N 3.12Å; E1798-T1800 VanDerWaalsContact O-N 3.12Å
1801	Q	75.7	Confident	82.4	Confident	161.4 Å²	161.4	67.6 Å²	67.6	75%	0.754	33%	0.328	S	S	*	.	H	α-helix	trans	-115.6	0.3	-176.2	-60.5	-169.7	4.9	0	0	113.6	E1798 D1803	E1798-Q1801 CarbonylContact O-C 3.57Å; E1798-Q1801 PolarHBondContact O-N 2.95Å; Q1801-D1803 PolarHBondContact O-N 3.18Å
1802	H	84.2	Confident	83.3	Confident	37.4 Å²	37.4	66.2 Å²	66.2	17%	0.173	32%	0.321	C	S	.	.			trans	-64.6	135	-173.4	-173.7	69.4	0	0	0	112.3	D1678 S1680 Y1681 C1789 M1791 L1794 E1798 S1804	D1678-H1802 IonicContact OD1-CD2 3.27Å; D1678-H1802 IonicContact OD1-NE2 3.2Å; D1678-H1802 IonicContact OD2-NE2 2.7Å; S1680-H1802 WeakPolarHBondContact CA-O 3.37Å; Y1681-H1802 PolarHBondContact N-O 2.98Å; Y1681-H1802 VanDerWaalsContact N-O 3.11Å; C1789-H1802 VanDerWaalsContact CB-CE1 3.44Å; C1789-H1802 WeakPolarHBondContact CB-CE1 3.44Å; C1789-H1802 VanDerWaalsContact CB-NE2 3.31Å; C1789-H1802 WeakPolarHBondContact CB-NE2 3.25Å; M1791-H1802 HydrophobicContact CE-CB 4.29Å; L1794-H1802 HydrophobicContact CD1-CB 3.87Å; L1794-H1802 VanDerWaalsContact CD1-CG 3.43Å; L1794-H1802 WeakPolarHBondContact CD1-ND1 3.36Å; E1798-H1802 WeakPolarHBondContact O-CA 3.22Å; E1798-H1802 VanDerWaalsContact O-CB 3.25Å; E1798-H1802 WeakPolarHBondContact O-CB 3.38Å; E1798-H1802 PolarHBondContact O-N 2.96Å; H1802-S1804 PolarHBondContact CD2-OG 3.01Å; H1802-S1804 PolarHBondContact CE1-OG 2.87Å; H1802-S1804 PolarHBondContact NE2-OG 3.17Å
1803	D	85.8	Confident	84.1	Confident	22 Å²	22	60.5 Å²	60.5	12%	0.118	29%	0.29	C	S	.	.			trans	-153.6	87.3	-178	-173.6	11.9	0	0	0	111.4	Q1801 F1805 K1806 R1809 R1983	Q1801-D1803 PolarHBondContact O-N 3.18Å; D1803-F1805 PolarHBondContact O-N 3.09Å; D1803-F1805 VanDerWaalsContact O-N 3.08Å; D1803-F1805 PolarHBondContact OD1-N 2.95Å; D1803-K1806 HydrophobicContact CB-CB 4.18Å; D1803-K1806 VanDerWaalsContact O-CB 3.32Å; D1803-K1806 WeakPolarHBondContact O-CB 3.38Å; D1803-K1806 PolarHBondContact O-N 3.12Å; D1803-K1806 VanDerWaalsContact O-N 3.14Å; D1803-K1806 PolarHBondContact OD1-N 2.96Å; D1803-K1806 VanDerWaalsContact OD2-CA 3.27Å; D1803-K1806 WeakPolarHBondContact OD2-CA 3.34Å; D1803-K1806 WeakPolarHBondContact OD2-CB 3.33Å; D1803-K1806 PolarHBondContact OD2-N 2.83Å; D1803-R1809 VanDerWaalsContact CG-NH1 3.32Å; D1803-R1809 IonicContact OD1-CZ 3.19Å; D1803-R1809 VanDerWaalsContact OD1-CZ 3.24Å; D1803-R1809 IonicContact OD1-NH1 3.24Å; D1803-R1809 PolarHBondContact OD1-NH1 3.19Å; D1803-R1809 VanDerWaalsContact OD1-NH1 3.15Å; D1803-R1809 IonicContact OD1-NH2 3.38Å; D1803-R1809 PolarHBondContact OD1-NH2 3.19Å; D1803-R1809 IonicContact OD2-CZ 3.18Å; D1803-R1809 IonicContact OD2-NH1 3.02Å; D1803-R1809 PolarHBondContact OD2-NH1 3.18Å; D1803-R1809 IonicContact OD2-NH2 3.06Å; D1803-R1809 PolarHBondContact OD2-NH2 3.49Å; D1803-R1983 IonicContact OD2-NH2 3.74Å; D1803-R1983 PolarHBondContact OD2-NH2 2.82Å
1804	S	88.2	Confident	84.9	Confident	21.4 Å²	21.4	55.6 Å²	55.6	15%	0.15	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-22.4	175.2	-56.9	0	0	0	0	113.4	D1678 S1680 K1787 H1802	D1678-S1804 VanDerWaalsContact OD2-CB 3.27Å; D1678-S1804 WeakPolarHBondContact OD2-CB 3.32Å; D1678-S1804 PolarHBondContact OD2-OG 3.15Å; S1680-S1804 WeakPolarHBondContact OG-CB 3.39Å; S1680-S1804 PolarHBondContact OG-N 2.98Å; S1680-S1804 PolarHBondContact OG-OG 2.84Å; K1787-S1804 VanDerWaalsContact O-CB 3.31Å; K1787-S1804 WeakPolarHBondContact O-CB 3.26Å; K1787-S1804 PolarHBondContact O-OG 2.91Å; H1802-S1804 PolarHBondContact CD2-OG 3.01Å; H1802-S1804 PolarHBondContact CE1-OG 2.87Å; H1802-S1804 PolarHBondContact NE2-OG 3.17Å
1805	F	90.1	Very high	85.7	Confident	10.4 Å²	10.4	56.3 Å²	56.3	5%	0.046	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	7	-176.7	-50.3	-76.1	0	0	0	112.9	L1684 L1692 V1786 Y1788 D1803 Y1807 F1808 R1809	L1684-F1805 HydrophobicContact CB-CD2 4.16Å; L1684-F1805 HydrophobicContact CB-CE2 4.28Å; L1684-F1805 HydrophobicContact CB-CG 4.5Å; L1684-F1805 HydrophobicContact CD1-CB 3.95Å; L1684-F1805 HydrophobicContact CD1-CD1 4.17Å; L1684-F1805 HydrophobicContact CD1-CD2 4.25Å; L1684-F1805 HydrophobicContact CD1-CG 3.84Å; L1684-F1805 HydrophobicContact CD2-CD1 3.98Å; L1684-F1805 HydrophobicContact CD2-CD2 4.33Å; L1684-F1805 HydrophobicContact CD2-CE1 3.92Å; L1684-F1805 HydrophobicContact CD2-CE2 4.36Å; L1684-F1805 HydrophobicContact CD2-CG 4.33Å; L1684-F1805 HydrophobicContact CD2-CZ 4.21Å; L1684-F1805 HydrophobicContact CG-CD1 4.45Å; L1684-F1805 HydrophobicContact CG-CD2 4.45Å; L1684-F1805 HydrophobicContact CG-CG 4.3Å; L1692-F1805 HydrophobicContact CD2-CD1 4.32Å; L1692-F1805 HydrophobicContact CD2-CE1 3.69Å; V1786-F1805 HydrophobicContact CG1-CD1 3.5Å; V1786-F1805 VanDerWaalsContact CG1-CD1 3.48Å; V1786-F1805 HydrophobicContact CG1-CE1 3.48Å; V1786-F1805 VanDerWaalsContact CG1-CE1 3.45Å; V1786-F1805 HydrophobicContact CG1-CZ 4.5Å; Y1788-F1805 HydrophobicContact CD1-CZ 4.45Å; Y1788-F1805 HydrophobicContact CE1-CE1 4.43Å; Y1788-F1805 AromaticContact CE1-CZ 3.83Å; Y1788-F1805 HydrophobicContact CE1-CZ 3.83Å; Y1788-F1805 AromaticContact CE2-CE1 3.9Å; Y1788-F1805 HydrophobicContact CE2-CE1 3.97Å; Y1788-F1805 HydrophobicContact CE2-CZ 4.14Å; Y1788-F1805 AromaticContact CZ-CE1 3.81Å; Y1788-F1805 AromaticContact CZ-CZ 3.65Å; D1803-F1805 PolarHBondContact O-N 3.09Å; D1803-F1805 VanDerWaalsContact O-N 3.08Å; D1803-F1805 PolarHBondContact OD1-N 2.95Å; F1805-Y1807 VanDerWaalsContact C-N 3.26Å; F1805-Y1807 PolarHBondContact O-N 3.29Å; F1805-Y1807 VanDerWaalsContact O-N 3.07Å; F1805-F1808 PolarHBondContact O-N 3.28Å; F1805-F1808 VanDerWaalsContact O-N 3.13Å; F1805-R1809 HydrophobicContact CB-CB 4.33Å; F1805-R1809 VanDerWaalsContact O-CB 3.24Å; F1805-R1809 WeakPolarHBondContact O-CB 3.39Å; F1805-R1809 PolarHBondContact O-N 3.26Å
1806	K	88.2	Confident	86.3	Confident	97.4 Å²	97.4	54.9 Å²	54.9	42%	0.423	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.2	-43.1	-171.8	-178.5	-179.6	177.6	-172.6	0	114.3	L1777 D1803	L1777-K1806 HydrophobicContact CD1-CG 4.23Å; L1777-K1806 WeakPolarHBondContact CD1-O 3.26Å; D1803-K1806 HydrophobicContact CB-CB 4.18Å; D1803-K1806 VanDerWaalsContact O-CB 3.32Å; D1803-K1806 WeakPolarHBondContact O-CB 3.38Å; D1803-K1806 PolarHBondContact O-N 3.12Å; D1803-K1806 VanDerWaalsContact O-N 3.14Å; D1803-K1806 PolarHBondContact OD1-N 2.96Å; D1803-K1806 VanDerWaalsContact OD2-CA 3.27Å; D1803-K1806 WeakPolarHBondContact OD2-CA 3.34Å; D1803-K1806 WeakPolarHBondContact OD2-CB 3.33Å; D1803-K1806 PolarHBondContact OD2-N 2.83Å
1807	Y	87.6	Confident	87.3	Confident	94 Å²	94	51.5 Å²	51.5	37%	0.369	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-28.8	-175.8	-61.7	-69	0	0	0	113.9	L1777 R1778 F1805	L1777-Y1807 HydrophobicContact CB-CD1 4.24Å; L1777-Y1807 HydrophobicContact CD1-CD1 4.39Å; L1777-Y1807 PolarHBondContact N-O 3.5Å; R1778-Y1807 HydrophobicContact CG-CD1 3.99Å; R1778-Y1807 HydrophobicContact CG-CG 4.35Å; R1778-Y1807 PolarHBondContact N-O 3.06Å; F1805-Y1807 VanDerWaalsContact C-N 3.26Å; F1805-Y1807 PolarHBondContact O-N 3.29Å; F1805-Y1807 VanDerWaalsContact O-N 3.07Å
1808	F	90.4	Very high	88.2	Confident	3.6 Å²	3.6	43.6 Å²	43.6	2%	0.016	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-35.6	-179.1	172.2	-100.1	0	0	0	113.4	D1688 R1691 L1692 S1776 P1780 D1782 H1783 V1786 F1805 A1810	D1688-F1808 HydrophobicContact CB-CE1 4.4Å; R1691-F1808 HydrophobicContact CB-CZ 4.11Å; R1691-F1808 HydrophobicContact CG-CE2 4.2Å; R1691-F1808 HydrophobicContact CG-CZ 3.89Å; R1691-F1808 PolarHBondContact NH1-O 2.84Å; R1691-F1808 PolarHBondContact NH2-O 3.22Å; L1692-F1808 HydrophobicContact CB-CE1 3.91Å; L1692-F1808 HydrophobicContact CB-CZ 4.03Å; L1692-F1808 HydrophobicContact CD1-CE1 4.31Å; L1692-F1808 HydrophobicContact CD1-CZ 4.39Å; S1776-F1808 PolarHBondContact OG-O 3.07Å; P1780-F1808 WeakPolarHBondContact O-CD2 3.37Å; P1780-F1808 VanDerWaalsContact O-CE2 3.25Å; P1780-F1808 WeakPolarHBondContact O-CE2 3.39Å; D1782-F1808 WeakPolarHBondContact O-CD2 3.47Å; H1783-F1808 HydrophobicContact CB-CD2 4.17Å; H1783-F1808 HydrophobicContact CB-CE2 3.61Å; H1783-F1808 HydrophobicContact CB-CZ 4.2Å; V1786-F1808 HydrophobicContact CG2-CB 3.53Å; V1786-F1808 VanDerWaalsContact CG2-CB 3.49Å; V1786-F1808 HydrophobicContact CG2-CD1 4.1Å; V1786-F1808 HydrophobicContact CG2-CD2 4.22Å; V1786-F1808 HydrophobicContact CG2-CG 3.69Å; F1805-F1808 PolarHBondContact O-N 3.28Å; F1805-F1808 VanDerWaalsContact O-N 3.13Å; F1808-A1810 PolarHBondContact O-N 2.87Å
1809	R	90.2	Very high	89.1	Confident	15.2 Å²	15.2	40.9 Å²	40.9	6%	0.057	21%	0.207	C	C	.	.	S	Bend	trans	-55.8	129.9	-175.5	-175.8	-170.6	-68.6	111.5	2.5	110.7	P1682 L1684 D1688 S1776 D1803 F1805 N1811	P1682-R1809 VanDerWaalsContact CD-NH1 3.34Å; P1682-R1809 PolarHBondContact O-NH2 3.1Å; L1684-R1809 HydrophobicContact CD1-CB 4.35Å; L1684-R1809 HydrophobicContact CD1-CG 4.13Å; D1688-R1809 VanDerWaalsContact OD2-CG 3.28Å; D1688-R1809 WeakPolarHBondContact OD2-CG 3.29Å; S1776-R1809 WeakPolarHBondContact CB-O 3.33Å; S1776-R1809 PolarHBondContact OG-O 3.16Å; D1803-R1809 VanDerWaalsContact CG-NH1 3.32Å; D1803-R1809 IonicContact OD1-CZ 3.19Å; D1803-R1809 VanDerWaalsContact OD1-CZ 3.24Å; D1803-R1809 IonicContact OD1-NH1 3.24Å; D1803-R1809 PolarHBondContact OD1-NH1 3.19Å; D1803-R1809 VanDerWaalsContact OD1-NH1 3.15Å; D1803-R1809 IonicContact OD1-NH2 3.38Å; D1803-R1809 PolarHBondContact OD1-NH2 3.19Å; D1803-R1809 IonicContact OD2-CZ 3.18Å; D1803-R1809 IonicContact OD2-NH1 3.02Å; D1803-R1809 PolarHBondContact OD2-NH1 3.18Å; D1803-R1809 IonicContact OD2-NH2 3.06Å; D1803-R1809 PolarHBondContact OD2-NH2 3.49Å; F1805-R1809 HydrophobicContact CB-CB 4.33Å; F1805-R1809 VanDerWaalsContact O-CB 3.24Å; F1805-R1809 WeakPolarHBondContact O-CB 3.39Å; F1805-R1809 PolarHBondContact O-N 3.26Å; R1809-N1811 PolarHBondContact O-N 3.06Å; R1809-N1811 VanDerWaalsContact O-N 3.13Å
1810	A	90.2	Very high	90.1	Very high	3.8 Å²	3.8	39.6 Å²	39.6	3%	0.031	20%	0.204	C	C	.	.			trans	-66.3	115.9	167.9	0	0	0	0	0	109.6	D1688 W1774 S1776 F1808 L1880	D1688-A1810 WeakPolarHBondContact OD1-CB 3.4Å; D1688-A1810 PolarHBondContact OD1-N 3.13Å; D1688-A1810 VanDerWaalsContact OD1-N 3.12Å; D1688-A1810 PolarHBondContact OD2-N 3.09Å; W1774-A1810 HydrophobicContact CB-CB 4.29Å; W1774-A1810 HydrophobicContact CD2-CB 4.37Å; W1774-A1810 HydrophobicContact CE3-CB 3.67Å; W1774-A1810 HydrophobicContact CZ3-CB 4.45Å; S1776-A1810 PolarHBondContact OG-N 3.09Å; F1808-A1810 PolarHBondContact O-N 2.87Å; A1810-L1880 HydrophobicContact CB-CD1 4.07Å; A1810-L1880 HydrophobicContact CB-CD2 4.27Å; A1810-L1880 HydrophobicContact CB-CG 4.46Å; A1810-L1880 WeakPolarHBondContact O-CD1 3.23Å; A1810-L1880 WeakPolarHBondContact O-CD2 3.41Å
1811	N	89.5	Confident	91	Very high	29.8 Å²	29.8	35.3 Å²	35.3	16%	0.159	18%	0.177	C	C	.	.	S	Bend	trans	-84.3	-34	173	-66.6	-63.1	0	0	0	110.7	L1775 R1809 V1978 I1980	L1775-N1811 PolarHBondContact O-N 3.23Å; R1809-N1811 PolarHBondContact O-N 3.06Å; R1809-N1811 VanDerWaalsContact O-N 3.13Å; N1811-V1978 HydrophobicContact CB-CG1 3.76Å; N1811-V1978 HydrophobicContact CB-CG2 3.92Å; N1811-I1980 HydrophobicContact CB-CD1 4.35Å; N1811-I1980 HydrophobicContact CB-CG1 4.39Å
1812	R	91.5	Very high	91.5	Very high	2.2 Å²	2.2	31.6 Å²	31.6	1%	0.008	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	174.6	174	-67.2	-70.1	-135.1	-96.9	0.5	110.7	L1775 R1879 L1880 L1881 Q1882 C1922 I1924 E1927 V1978 M1979	L1775-R1812 WeakPolarHBondContact CA-O 3.39Å; L1775-R1812 HydrophobicContact CB-CB 3.93Å; L1775-R1812 WeakPolarHBondContact CB-O 3.48Å; L1775-R1812 HydrophobicContact CD1-CB 3.87Å; L1775-R1812 HydrophobicContact CG-CB 4.33Å; L1775-R1812 PolarHBondContact N-O 3.01Å; L1775-R1812 PolarHBondContact O-N 3.02Å; R1812-R1879 PolarHBondContact NH1-O 3.32Å; R1812-L1880 CarbonylContact C-O 3.53Å; R1812-L1880 VanDerWaalsContact C-O 3.3Å; R1812-L1880 WeakPolarHBondContact CA-O 3.29Å; R1812-L1880 VanDerWaalsContact CB-O 3.27Å; R1812-L1880 WeakPolarHBondContact CB-O 3.45Å; R1812-L1880 VanDerWaalsContact CD-O 3.27Å; R1812-L1880 WeakPolarHBondContact CD-O 3.36Å; R1812-L1880 PolarHBondContact NE-O 2.96Å; R1812-L1881 PolarHBondContact NE-O 2.85Å; R1812-L1881 PolarHBondContact NH2-O 3.03Å; R1812-Q1882 HydrophobicContact CB-CB 3.89Å; R1812-Q1882 HydrophobicContact CG-CB 4.18Å; R1812-Q1882 VanDerWaalsContact CG-OE1 3.28Å; R1812-C1922 PolarHBondContact NH2-O 3.06Å; R1812-I1924 VanDerWaalsContact NH1-CD1 3.3Å; R1812-E1927 IonicContact CZ-OE1 3.28Å; R1812-E1927 IonicContact CZ-OE2 3.27Å; R1812-E1927 IonicContact NE-OE1 3.96Å; R1812-E1927 PolarHBondContact NE-OE1 3.21Å; R1812-E1927 IonicContact NH1-OE1 3.04Å; R1812-E1927 PolarHBondContact NH1-OE1 3.01Å; R1812-E1927 IonicContact NH1-OE2 3.43Å; R1812-E1927 PolarHBondContact NH1-OE2 3.39Å; R1812-E1927 IonicContact NH2-OE1 3.61Å; R1812-E1927 PolarHBondContact NH2-OE1 2.68Å; R1812-E1927 IonicContact NH2-OE2 3.36Å; R1812-E1927 PolarHBondContact NH2-OE2 3.04Å; R1812-V1978 HydrophobicContact CB-CG1 4.12Å; R1812-V1978 HydrophobicContact CB-CG2 3.96Å; R1812-V1978 HydrophobicContact CG-CG1 3.98Å; R1812-V1978 HydrophobicContact CG-CG2 3.94Å; R1812-M1979 VanDerWaalsContact CD-O 3.27Å; R1812-M1979 WeakPolarHBondContact CD-O 3.2Å; R1812-M1979 HydrophobicContact CG-CB 4.08Å; R1812-M1979 WeakPolarHBondContact CG-O 3.39Å; R1812-M1979 PolarHBondContact NE-O 2.83Å; R1812-M1979 VanDerWaalsContact NH1-CB 3.3Å; R1812-M1979 PolarHBondContact NH1-O 3.05Å; R1812-M1979 PolarHBondContact NH2-O 2.84Å
1813	L	93.1	Very high	91.2	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	130.9	179.6	171.3	65.2	0	0	0	108.6	L1772 D1773 W1774 M1815 F1877 L1880 L1881 Q1882	L1772-L1813 HydrophobicContact CB-CD1 3.99Å; L1772-L1813 HydrophobicContact CD2-CD1 4.33Å; L1772-L1813 HydrophobicContact CD2-CD2 4.29Å; D1773-L1813 WeakPolarHBondContact O-CA 3.45Å; D1773-L1813 WeakPolarHBondContact O-CD1 3.23Å; W1774-L1813 HydrophobicContact CD2-CD1 4.04Å; W1774-L1813 HydrophobicContact CE3-CD1 3.94Å; W1774-L1813 HydrophobicContact CG-CD1 4.49Å; W1774-L1813 HydrophobicContact CH2-CD1 4.46Å; W1774-L1813 HydrophobicContact CH2-CD2 4.43Å; W1774-L1813 HydrophobicContact CZ3-CD1 4.23Å; W1774-L1813 HydrophobicContact CZ3-CD2 4.2Å; L1813-M1815 HydrophobicContact CD2-CE 4.09Å; L1813-F1877 HydrophobicContact CD2-CE1 4.39Å; L1813-F1877 HydrophobicContact CD2-CE2 3.94Å; L1813-F1877 HydrophobicContact CD2-CZ 3.69Å; L1813-L1880 HydrophobicContact CB-CB 4.24Å; L1813-L1880 HydrophobicContact CB-CD2 3.75Å; L1813-L1880 HydrophobicContact CB-CG 3.68Å; L1813-L1880 HydrophobicContact CD2-CD2 4.22Å; L1813-L1880 PolarHBondContact N-O 3.1Å; L1813-L1881 HydrophobicContact CB-CD2 4.5Å; L1813-L1881 HydrophobicContact CD2-CD1 4.2Å; L1813-L1881 HydrophobicContact CD2-CD2 3.82Å; L1813-L1881 HydrophobicContact CD2-CG 4.3Å; L1813-L1881 HydrophobicContact CG-CD2 4.12Å; L1813-L1881 CarbonylContact O-C 3.59Å; L1813-L1881 WeakPolarHBondContact O-CA 3.43Å; L1813-Q1882 PolarHBondContact O-N 2.91Å
1814	A	94	Very high	90.6	Very high	9.6 Å²	9.6	36.6 Å²	36.6	8%	0.079	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	128.3	161.5	0	0	0	0	0	108.2	D1773 L1775 S1883 H1975	D1773-A1814 HydrophobicContact CB-CB 4.2Å; D1773-A1814 PolarHBondContact N-O 3.09Å; D1773-A1814 PolarHBondContact O-N 2.85Å; L1775-A1814 HydrophobicContact CD1-CB 4.46Å; A1814-S1883 WeakPolarHBondContact CA-O 3.3Å; A1814-S1883 WeakPolarHBondContact CA-OG 3.31Å; A1814-S1883 VanDerWaalsContact CB-OG 3.3Å; A1814-S1883 WeakPolarHBondContact CB-OG 3.37Å; A1814-H1975 WeakPolarHBondContact CB-NE2 3.38Å
1815	M	95.4	Very high	89.7	Confident	28.8 Å²	28.8	39.3 Å²	39.3	14%	0.142	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	129.8	-176.6	-178.6	178	-113.1	0	0	109.7	V1770 K1771 L1772 L1813 I1817 F1877 L1881 S1883 L1884 E1885	V1770-M1815 HydrophobicContact CG1-CE 3.62Å; V1770-M1815 HydrophobicContact CG1-CG 4.36Å; K1771-M1815 WeakPolarHBondContact O-CA 3.36Å; L1772-M1815 HydrophobicContact CD2-CE 3.75Å; L1772-M1815 HydrophobicContact CD2-CG 4.06Å; L1772-M1815 HydrophobicContact CD2-SD 4.32Å; L1813-M1815 HydrophobicContact CD2-CE 4.09Å; M1815-I1817 HydrophobicContact CE-CD1 3.76Å; M1815-I1817 HydrophobicContact CE-CG1 3.92Å; M1815-I1817 HydrophobicContact CG-CD1 4.48Å; M1815-I1817 HydrophobicContact CG-CG1 4.19Å; M1815-I1817 HydrophobicContact SD-CD1 4.16Å; M1815-I1817 HydrophobicContact SD-CG1 4.31Å; M1815-F1877 HydrophobicContact CE-CE1 4.49Å; M1815-F1877 HydrophobicContact CE-CZ 4.43Å; M1815-L1881 HydrophobicContact CB-CD2 3.87Å; M1815-L1881 HydrophobicContact CB-CG 4.47Å; M1815-L1881 HydrophobicContact CE-CD2 3.88Å; M1815-L1881 HydrophobicContact SD-CD1 4.17Å; M1815-L1881 HydrophobicContact SD-CD2 4.17Å; M1815-S1883 PolarHBondContact N-O 3.04Å; M1815-L1884 HydrophobicContact CB-CD1 4.02Å; M1815-L1884 HydrophobicContact CG-CD1 3.87Å; M1815-L1884 CarbonylContact O-C 3.55Å; M1815-L1884 WeakPolarHBondContact O-CA 3.38Å; M1815-L1884 HydrophobicContact SD-CD1 3.97Å; M1815-E1885 PolarHBondContact O-N 3.12Å
1816	G	95.8	Very high	88.4	Confident	21.4 Å²	21.4	46.3 Å²	46.3	22%	0.221	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	132.6	172	0	0	0	0	0	110.3	V1770 K1771 E1885	V1770-G1816 CarbonylContact C-O 3.57Å; V1770-G1816 WeakPolarHBondContact CA-O 3.41Å; K1771-G1816 PolarHBondContact N-O 2.89Å; K1771-G1816 PolarHBondContact O-N 3.19Å; G1816-E1885 CarbonylContact C-O 3.59Å; G1816-E1885 VanDerWaalsContact CA-O 3.27Å; G1816-E1885 WeakPolarHBondContact CA-O 3.44Å
1817	I	97.2	Very high	87.1	Confident	33.2 Å²	33.2	45.6 Å²	45.6	17%	0.17	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	111.5	175.7	-51.1	178.8	0	0	0	109	M1768 T1769 V1770 M1815 F1819 L1884 E1885 F1886 S1887	M1768-I1817 HydrophobicContact CE-CG2 4.15Å; T1769-I1817 CarbonylContact O-C 3.5Å; T1769-I1817 WeakPolarHBondContact O-CA 3.35Å; V1770-I1817 HydrophobicContact CG2-CG1 4.49Å; V1770-I1817 HydrophobicContact CG2-CG2 4.41Å; M1815-I1817 HydrophobicContact CE-CD1 3.76Å; M1815-I1817 HydrophobicContact CE-CG1 3.92Å; M1815-I1817 HydrophobicContact CG-CD1 4.48Å; M1815-I1817 HydrophobicContact CG-CG1 4.19Å; M1815-I1817 HydrophobicContact SD-CD1 4.16Å; M1815-I1817 HydrophobicContact SD-CG1 4.31Å; I1817-F1819 HydrophobicContact CB-CE2 4.47Å; I1817-F1819 HydrophobicContact CG2-CD2 3.99Å; I1817-F1819 HydrophobicContact CG2-CE2 3.36Å; I1817-F1819 HydrophobicContact CG2-CZ 3.78Å; I1817-L1884 HydrophobicContact CD1-CD1 3.86Å; I1817-L1884 HydrophobicContact CG1-CD1 4.06Å; I1817-E1885 PolarHBondContact N-O 2.99Å; I1817-F1886 HydrophobicContact CB-CB 4.29Å; I1817-F1886 CarbonylContact O-C 3.53Å; I1817-F1886 WeakPolarHBondContact O-CA 3.28Å; I1817-F1886 WeakPolarHBondContact O-CB 3.3Å; I1817-S1887 PolarHBondContact O-N 3.04Å
1818	N	97.4	Very high	85.5	Confident	52.8 Å²	52.8	43 Å²	43	28%	0.282	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	133.1	176.1	-159	32.5	0	0	0	110.2	M1768 T1769 T1820 S1887 N1889	M1768-N1818 CarbonylContact C-O 3.57Å; M1768-N1818 VanDerWaalsContact CA-O 3.31Å; M1768-N1818 WeakPolarHBondContact CA-O 3.31Å; T1769-N1818 PolarHBondContact N-O 3.27Å; T1769-N1818 PolarHBondContact O-N 3.12Å; N1818-T1820 WeakPolarHBondContact ND2-CG2 3.45Å; N1818-T1820 PolarHBondContact ND2-OG1 3.36Å; N1818-S1887 CarbonylContact C-O 3.53Å; N1818-S1887 WeakPolarHBondContact CA-O 3.29Å; N1818-S1887 VanDerWaalsContact OD1-CB 3.3Å; N1818-S1887 WeakPolarHBondContact OD1-CB 3.4Å; N1818-S1887 PolarHBondContact OD1-O 2.86Å; N1818-S1887 PolarHBondContact OD1-OG 2.97Å; N1818-N1889 PolarHBondContact OD1-ND2 2.92Å
1819	F	96.6	Very high	83.8	Confident	38.4 Å²	38.4	48.4 Å²	48.4	17%	0.168	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	118	170.8	-66	-84.4	0	0	0	107.8	W1724 L1766 E1767 M1768 I1817 S1887 I1888 N1889	W1724-F1819 HydrophobicContact CH2-CZ 4.48Å; L1766-F1819 HydrophobicContact CD1-CB 4.05Å; L1766-F1819 HydrophobicContact CD1-CD1 4.14Å; L1766-F1819 HydrophobicContact CD2-CD1 4.05Å; L1766-F1819 HydrophobicContact CG-CD1 4.42Å; E1767-F1819 WeakPolarHBondContact O-CA 2.76Å; M1768-F1819 HydrophobicContact CB-CD1 3.96Å; M1768-F1819 HydrophobicContact CB-CE1 3.99Å; M1768-F1819 HydrophobicContact CE-CE1 4.11Å; M1768-F1819 HydrophobicContact CE-CZ 3.94Å; M1768-F1819 HydrophobicContact CG-CD1 3.95Å; M1768-F1819 HydrophobicContact CG-CE1 3.57Å; M1768-F1819 HydrophobicContact CG-CZ 4.17Å; M1768-F1819 HydrophobicContact SD-CD1 4.43Å; M1768-F1819 HydrophobicContact SD-CE1 3.52Å; M1768-F1819 VanDerWaalsContact SD-CE1 3.54Å; M1768-F1819 WeakPolarHBondContact SD-CE1 3.33Å; M1768-F1819 HydrophobicContact SD-CZ 3.98Å; I1817-F1819 HydrophobicContact CB-CE2 4.47Å; I1817-F1819 HydrophobicContact CG2-CD2 3.99Å; I1817-F1819 HydrophobicContact CG2-CE2 3.36Å; I1817-F1819 HydrophobicContact CG2-CZ 3.78Å; F1819-S1887 PolarHBondContact N-O 3.14Å; F1819-I1888 HydrophobicContact CB-CB 4.43Å; F1819-I1888 HydrophobicContact CB-CG1 4.2Å; F1819-I1888 HydrophobicContact CB-CG2 4.38Å; F1819-I1888 HydrophobicContact CD2-CG1 3.86Å; F1819-I1888 HydrophobicContact CG-CG1 4.42Å; F1819-I1888 CarbonylContact O-C 3.55Å; F1819-I1888 WeakPolarHBondContact O-CA 3.38Å; F1819-N1889 PolarHBondContact O-N 2.98Å
1820	T	95.5	Very high	82.2	Confident	43.8 Å²	43.8	51.2 Å²	51.2	27%	0.269	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	118.3	177.5	-22.1	0	0	0	0	109	E1767 N1818 N1889	E1767-T1820 PolarHBondContact N-O 3.19Å; E1767-T1820 PolarHBondContact O-N 3.19Å; E1767-T1820 PolarHBondContact O-OG1 3.16Å; N1818-T1820 WeakPolarHBondContact ND2-CG2 3.45Å; N1818-T1820 PolarHBondContact ND2-OG1 3.36Å; T1820-N1889 HydrophobicContact CG2-CB 4.21Å
1821	V	93.4	Very high	80.5	Confident	14.2 Å²	14.2	56 Å²	56	9%	0.086	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	122.3	173.5	175.6	0	0	0	0	108.7	I1763 P1764 L1766 N1889 I1890 P1891	I1763-V1821 HydrophobicContact CG2-CG2 3.42Å; I1763-V1821 VanDerWaalsContact CG2-CG2 3.44Å; P1764-V1821 WeakPolarHBondContact O-CG1 3.29Å; L1766-V1821 HydrophobicContact CD1-CG2 3.94Å; V1821-N1889 PolarHBondContact N-O 3.13Å; V1821-N1889 VanDerWaalsContact N-O 3.09Å; V1821-I1890 HydrophobicContact CB-CG2 4.4Å; V1821-I1890 HydrophobicContact CG2-CB 4.47Å; V1821-I1890 HydrophobicContact CG2-CG1 4.02Å; V1821-I1890 HydrophobicContact CG2-CG2 4.3Å; V1821-P1891 HydrophobicContact CB-CG 4.46Å; V1821-P1891 HydrophobicContact CG1-CG 4.24Å
1822	K	86.9	Confident	79.2	Confident	83.8 Å²	83.8	59.7 Å²	59.7	36%	0.364	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-73.7	140.6	176.3	-70.5	165.2	179.4	163.5	0	109.3	D1741 H1765 E1767	D1741-K1822 IonicContact OD1-NZ 3.3Å; D1741-K1822 PolarHBondContact OD1-NZ 3.15Å; H1765-K1822 HydrophobicContact CB-CB 4.21Å; H1765-K1822 PolarHBondContact O-N 3.11Å; E1767-K1822 WeakPolarHBondContact OE2-CE 3.28Å; E1767-K1822 IonicContact OE2-NZ 3.69Å; E1767-K1822 PolarHBondContact OE2-NZ 3.15Å; E1767-K1822 VanDerWaalsContact OE2-NZ 3.11Å
1823	P	79.1	Confident	78.3	Confident	100.6 Å²	100.6	61.9 Å²	61.9	65%	0.653	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-61.5	145.8	173.9	27.3	-33.6	0	0	0	109.8
1824	P	71.9	Confident	77.7	Confident	63.2 Å²	63.2	66.7 Å²	66.7	41%	0.41	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-60.6	147.2	178.5	25	-33.3	0	0	0	110.6	T1826 Q1833	P1824-T1826 PolarHBondContact O-N 3.2Å; P1824-Q1833 HydrophobicContact CB-CB 4.33Å
1825	P	69.1	Low	77.5	Confident	78.6 Å²	78.6	66.7 Å²	66.7	51%	0.51	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-59.3	139.5	178.4	15.8	-20.6	0	0	0	110.9	H1765 G1827 S1828	H1765-P1825 WeakPolarHBondContact NE2-CD 3.49Å; P1825-G1827 PolarHBondContact O-N 3.05Å; P1825-G1827 VanDerWaalsContact O-N 3.13Å; P1825-S1828 PolarHBondContact O-N 3.11Å; P1825-S1828 PolarHBondContact O-OG 2.99Å
1826	T	62.6	Low	77.4	Confident	158 Å²	158	67.8 Å²	67.8	97%	0.969	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	108.8	-176.6	-26.2	0	0	0	0	111	P1824	P1824-T1826 PolarHBondContact O-N 3.2Å
1827	G	61.2	Low	77.1	Confident	83 Å²	83	66.8 Å²	66.8	86%	0.856	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	127.6	-13.6	176.4	0	0	0	0	0	116.1	P1825	P1825-G1827 PolarHBondContact O-N 3.05Å; P1825-G1827 VanDerWaalsContact O-N 3.13Å
1828	S	55.4	Low	76.6	Confident	39.6 Å²	39.6	65.7 Å²	65.7	28%	0.277	39%	0.387	S	S	.	.			trans	-112.3	81.7	179.2	61.2	0	0	0	0	112.9	P1825 T1830 Q1833	P1825-S1828 PolarHBondContact O-N 3.11Å; P1825-S1828 PolarHBondContact O-OG 2.99Å; S1828-T1830 VanDerWaalsContact C-N 3.3Å; S1828-T1830 PolarHBondContact O-N 3.3Å; S1828-Q1833 PolarHBondContact O-OE1 3.45Å; S1828-Q1833 VanDerWaalsContact O-OE1 3.11Å; S1828-Q1833 PolarHBondContact OG-NE2 3.25Å; S1828-Q1833 VanDerWaalsContact OG-NE2 3.15Å; S1828-Q1833 PolarHBondContact OG-OE1 3.08Å
1829	S	52.9	Low	76	Confident	115.4 Å²	115.4	65.9 Å²	65.9	81%	0.807	39%	0.386	S	S	*	.			trans	-91.3	55.4	171.6	66.1	0	0	0	0	111.9
1830	T	57.7	Low	75.3	Confident	75.4 Å²	75.4	65.2 Å²	65.2	46%	0.463	38%	0.382	S	S	.	.			trans	-81.3	144	167.4	55.5	0	0	0	0	109.5	S1828 D1832 Q1833	S1828-T1830 VanDerWaalsContact C-N 3.3Å; S1828-T1830 PolarHBondContact O-N 3.3Å; T1830-D1832 PolarHBondContact O-N 3.05Å; T1830-D1832 VanDerWaalsContact O-N 3.14Å; T1830-Q1833 WeakPolarHBondContact O-CB 3.39Å; T1830-Q1833 PolarHBondContact O-N 3.06Å; T1830-Q1833 VanDerWaalsContact O-N 3.08Å; T1830-Q1833 WeakPolarHBondContact OG1-CG 3.4Å
1831	M	54.5	Low	74.5	Confident	104.6 Å²	104.6	65.6 Å²	65.6	52%	0.515	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-56.6	-35.3	179	-69.4	-86.8	97.7	0	0	112.2	Q1833 R1834 E1894	M1831-Q1833 PolarHBondContact O-N 3.05Å; M1831-R1834 VanDerWaalsContact CE-CZ 3.46Å; M1831-R1834 PolarHBondContact O-N 3.16Å; M1831-R1834 VanDerWaalsContact O-N 3.1Å; M1831-R1834 PolarHBondContact SD-NH1 2.89Å; M1831-E1894 WeakPolarHBondContact CE-OE2 3.31Å
1832	D	62.3	Low	73.7	Confident	107.2 Å²	107.2	67.3 Å²	67.3	57%	0.573	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-61.7	-7.2	176.6	-61.5	-28.6	0	0	0	114.9	H1762 T1830 Q2061	H1762-D1832 PolarHBondContact NE2-O 3.12Å; T1830-D1832 PolarHBondContact O-N 3.05Å; T1830-D1832 VanDerWaalsContact O-N 3.14Å; D1832-Q2061 PolarHBondContact OD1-NE2 3.22Å
1833	Q	71.3	Confident	73.3	Confident	48.8 Å²	48.8	64.2 Å²	64.2	23%	0.228	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-97.8	0.7	175.6	-64.5	-123.1	-13.5	0	0	113.2	P1764 H1765 P1824 S1828 T1830 M1831	P1764-Q1833 VanDerWaalsContact CG-O 3.23Å; P1764-Q1833 WeakPolarHBondContact CG-O 3.34Å; H1765-Q1833 PolarHBondContact NE2-OE1 2.91Å; H1765-Q1833 VanDerWaalsContact NE2-OE1 3.12Å; P1824-Q1833 HydrophobicContact CB-CB 4.33Å; S1828-Q1833 PolarHBondContact O-OE1 3.45Å; S1828-Q1833 VanDerWaalsContact O-OE1 3.11Å; S1828-Q1833 PolarHBondContact OG-NE2 3.25Å; S1828-Q1833 VanDerWaalsContact OG-NE2 3.15Å; S1828-Q1833 PolarHBondContact OG-OE1 3.08Å; T1830-Q1833 WeakPolarHBondContact O-CB 3.39Å; T1830-Q1833 PolarHBondContact O-N 3.06Å; T1830-Q1833 VanDerWaalsContact O-N 3.08Å; T1830-Q1833 WeakPolarHBondContact OG1-CG 3.4Å; M1831-Q1833 PolarHBondContact O-N 3.05Å
1834	R	81.1	Confident	73.3	Confident	101.2 Å²	101.2	64.9 Å²	64.9	38%	0.382	38%	0.383	S	S	.	.	S	Bend	trans	-95	134.7	176.4	-69.9	-175.7	175.1	162.7	1	110.7	M1831 W1836	M1831-R1834 VanDerWaalsContact CE-CZ 3.46Å; M1831-R1834 PolarHBondContact O-N 3.16Å; M1831-R1834 VanDerWaalsContact O-N 3.1Å; M1831-R1834 PolarHBondContact SD-NH1 2.89Å; R1834-W1836 PolarHBondContact O-N 3.32Å
1835	P	90.8	Very high	73.6	Confident	8.2 Å²	8.2	69.3 Å²	69.3	5%	0.053	40%	0.396	C	S	.	.			trans	-68.9	136.4	173	31.6	-36	0	0	0	109.6	H1762 I1763 I1890 Q1892 L1893 E1894	H1762-P1835 CarbonylContact O-C 3.52Å; H1762-P1835 WeakPolarHBondContact O-CA 3.36Å; I1763-P1835 HydrophobicContact CG2-CB 4.38Å; P1835-I1890 HydrophobicContact CB-CG2 4.47Å; P1835-I1890 HydrophobicContact CG-CG2 3.86Å; P1835-Q1892 WeakPolarHBondContact CG-O 3.37Å; P1835-L1893 HydrophobicContact CB-CD1 4.16Å; P1835-L1893 HydrophobicContact CG-CD1 4.43Å; P1835-E1894 PolarHBondContact O-N 3.17Å; P1835-E1894 VanDerWaalsContact O-N 3.16Å
1836	W	92.2	Very high	74.1	Confident	51.6 Å²	51.6	66.3 Å²	66.3	20%	0.195	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	159.7	178.2	62.2	-99.8	0	0	0	111.1	Q1759 F1761 H1762 R1834 E1894 H2057	Q1759-W1836 HydrophobicContact CB-CH2 3.74Å; Q1759-W1836 HydrophobicContact CB-CZ3 4.4Å; F1761-W1836 CarbonylContact C-O 3.59Å; F1761-W1836 WeakPolarHBondContact CA-O 3.47Å; H1762-W1836 HydrophobicContact CB-CD2 3.84Å; H1762-W1836 VanDerWaalsContact CB-CE2 3.42Å; H1762-W1836 HydrophobicContact CB-CE3 4.5Å; H1762-W1836 HydrophobicContact CB-CG 4.13Å; H1762-W1836 HydrophobicContact CB-CH2 4.41Å; H1762-W1836 HydrophobicContact CB-CZ2 3.68Å; H1762-W1836 VanDerWaalsContact CB-NE1 3.34Å; H1762-W1836 AromaticContact CD2-CD1 3.77Å; H1762-W1836 AromaticContact CD2-NE1 3.48Å; H1762-W1836 PolarHBondContact CD2-NE1 2.96Å; H1762-W1836 AromaticContact CG-CE2 3.97Å; H1762-W1836 AromaticContact CG-NE1 3.6Å; H1762-W1836 PolarHBondContact N-O 3.06Å; H1762-W1836 PolarHBondContact O-N 2.9Å; R1834-W1836 PolarHBondContact O-N 3.32Å; W1836-E1894 CarbonylContact C-O 3.57Å; W1836-E1894 VanDerWaalsContact CA-O 3.25Å; W1836-E1894 WeakPolarHBondContact CA-O 3.28Å; W1836-E1894 HydrophobicContact CB-CB 4.02Å; W1836-E1894 HydrophobicContact CB-CG 4.5Å; W1836-H2057 AromaticContact CD2-NE2 3.94Å; W1836-H2057 AromaticContact CE2-NE2 3.6Å; W1836-H2057 AromaticContact CH2-NE2 3.7Å; W1836-H2057 AromaticContact CZ2-NE2 3.99Å; W1836-H2057 AromaticContact NE1-NE2 3.65Å
1837	C	91	Very high	75.1	Confident	1 Å²	1	61 Å²	61	1%	0.007	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	140.1	172	84.2	0	0	0	0	111.6	L1760 F1761 F1839 E1894 L1895 I1896	L1760-C1837 CarbonylContact O-C 3.53Å; L1760-C1837 WeakPolarHBondContact O-CA 3.37Å; L1760-C1837 WeakPolarHBondContact O-CB 3.28Å; F1761-C1837 HydrophobicContact CB-CB 4.48Å; F1761-C1837 HydrophobicContact CD1-CB 3.46Å; F1761-C1837 VanDerWaalsContact CD1-CB 3.43Å; F1761-C1837 HydrophobicContact CE1-CB 3.84Å; F1761-C1837 HydrophobicContact CG-CB 4.01Å; C1837-F1839 HydrophobicContact CB-CE2 4.05Å; C1837-F1839 HydrophobicContact CB-CZ 4.17Å; C1837-F1839 WeakPolarHBondContact SG-CE2 3.32Å; C1837-F1839 WeakPolarHBondContact SG-CZ 3.47Å; C1837-E1894 PolarHBondContact N-O 3.11Å; C1837-L1895 HydrophobicContact CB-CG 4.45Å; C1837-L1895 WeakPolarHBondContact O-CA 3.43Å; C1837-L1895 VanDerWaalsContact SG-CB 3.6Å; C1837-L1895 WeakPolarHBondContact SG-CD2 3.47Å; C1837-L1895 VanDerWaalsContact SG-CG 3.57Å; C1837-L1895 WeakPolarHBondContact SG-CG 3.28Å; C1837-I1896 PolarHBondContact O-N 2.99Å
1838	S	86	Confident	76.2	Confident	9.4 Å²	9.4	60.9 Å²	60.9	7%	0.066	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	120.4	-177.6	-167.4	0	0	0	0	110.8	L1760 Y1840 I1896	L1760-S1838 PolarHBondContact O-N 2.96Å; S1838-Y1840 PolarHBondContact OG-OH 2.84Å; S1838-I1896 CarbonylContact C-O 3.56Å; S1838-I1896 VanDerWaalsContact CA-O 3.31Å; S1838-I1896 WeakPolarHBondContact CA-O 3.33Å
1839	F	85.2	Confident	77.6	Confident	57.2 Å²	57.2	62.4 Å²	62.4	25%	0.251	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	141.1	-178	-64.1	-66.6	0	0	0	111.7	L1760 F1761 C1837 V1843 L1895 I1896 F1897 W1898	L1760-F1839 HydrophobicContact CD2-CD1 4.4Å; F1761-F1839 HydrophobicContact CD1-CZ 4.5Å; F1761-F1839 HydrophobicContact CE1-CE1 4.38Å; F1761-F1839 AromaticContact CE1-CZ 3.83Å; F1761-F1839 HydrophobicContact CE1-CZ 3.95Å; F1761-F1839 AromaticContact CE2-CE1 3.95Å; F1761-F1839 HydrophobicContact CE2-CE1 3.95Å; F1761-F1839 AromaticContact CE2-CZ 3.75Å; F1761-F1839 HydrophobicContact CE2-CZ 3.84Å; F1761-F1839 AromaticContact CZ-CE1 3.88Å; F1761-F1839 HydrophobicContact CZ-CE1 4Å; F1761-F1839 HydrophobicContact CZ-CE2 4.41Å; F1761-F1839 AromaticContact CZ-CZ 3.44Å; F1761-F1839 HydrophobicContact CZ-CZ 3.44Å; F1761-F1839 VanDerWaalsContact CZ-CZ 3.41Å; C1837-F1839 HydrophobicContact CB-CE2 4.05Å; C1837-F1839 HydrophobicContact CB-CZ 4.17Å; C1837-F1839 WeakPolarHBondContact SG-CE2 3.32Å; C1837-F1839 WeakPolarHBondContact SG-CZ 3.47Å; F1839-V1843 HydrophobicContact CD1-CG1 4.35Å; F1839-L1895 HydrophobicContact CD2-CD2 4.02Å; F1839-L1895 HydrophobicContact CD2-CG 4.32Å; F1839-L1895 HydrophobicContact CE2-CD1 4.23Å; F1839-L1895 HydrophobicContact CE2-CD2 4.29Å; F1839-L1895 HydrophobicContact CE2-CG 4.16Å; F1839-I1896 PolarHBondContact N-O 3.07Å; F1839-F1897 HydrophobicContact CB-CD2 3.98Å; F1839-F1897 CarbonylContact O-C 3.54Å; F1839-F1897 WeakPolarHBondContact O-CA 3.36Å; F1839-W1898 PolarHBondContact O-N 3.13Å
1840	Y	81.4	Confident	79.3	Confident	24.6 Å²	24.6	58.3 Å²	58.3	10%	0.096	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	153.9	171.7	-56.5	-87.3	0	0	0	109.6	Y1754 S1838 S1842 V1843 W1898 Y1901	Y1754-Y1840 HydrophobicContact CD1-CD2 4.34Å; Y1754-Y1840 HydrophobicContact CD1-CE2 4.29Å; Y1754-Y1840 AromaticContact CE1-CD1 3.95Å; Y1754-Y1840 HydrophobicContact CE1-CD1 3.95Å; Y1754-Y1840 AromaticContact CE1-CD2 3.58Å; Y1754-Y1840 HydrophobicContact CE1-CD2 3.58Å; Y1754-Y1840 HydrophobicContact CE1-CE1 4.22Å; Y1754-Y1840 AromaticContact CE1-CE2 3.88Å; Y1754-Y1840 HydrophobicContact CE1-CE2 3.88Å; Y1754-Y1840 AromaticContact CE1-CG 3.63Å; Y1754-Y1840 HydrophobicContact CE1-CG 3.63Å; Y1754-Y1840 AromaticContact CZ-CG 3.96Å; Y1754-Y1840 WeakPolarHBondContact OH-CB 3.46Å; S1838-Y1840 PolarHBondContact OG-OH 2.84Å; Y1840-S1842 WeakPolarHBondContact CB-OG 3.35Å; Y1840-S1842 PolarHBondContact O-N 3Å; Y1840-S1842 VanDerWaalsContact O-N 3.07Å; Y1840-V1843 HydrophobicContact CD2-CG2 4.19Å; Y1840-V1843 WeakPolarHBondContact O-CA 3.29Å; Y1840-V1843 VanDerWaalsContact O-CB 3.24Å; Y1840-V1843 WeakPolarHBondContact O-CB 3.29Å; Y1840-V1843 VanDerWaalsContact O-CG2 3.29Å; Y1840-V1843 WeakPolarHBondContact O-CG2 3.25Å; Y1840-V1843 PolarHBondContact O-N 3.06Å; Y1840-W1898 WeakPolarHBondContact CA-O 3.31Å; Y1840-W1898 HydrophobicContact CD1-CB 3.74Å; Y1840-W1898 HydrophobicContact CD1-CG 4.4Å; Y1840-W1898 HydrophobicContact CE1-CB 3.85Å; Y1840-W1898 AromaticContact CE1-CD1 3.71Å; Y1840-W1898 AromaticContact CE1-CG 3.97Å; Y1840-W1898 HydrophobicContact CE1-CG 4.1Å; Y1840-W1898 AromaticContact CZ-CD1 3.96Å; Y1840-Y1901 HydrophobicContact CD1-CD2 4.32Å; Y1840-Y1901 AromaticContact CE1-CD2 3.9Å; Y1840-Y1901 HydrophobicContact CE1-CD2 4.02Å; Y1840-Y1901 HydrophobicContact CE2-CD2 4.46Å
1841	T	78.3	Confident	80.7	Confident	52.4 Å²	52.4	61.8 Å²	61.8	32%	0.321	30%	0.302	S	S	.	.	H	α-helix	trans	-56.4	-25.7	173.7	-13.8	0	0	0	0	113.2	V1843 L1844 F1897 W1898 V1899	T1841-V1843 VanDerWaalsContact C-N 3.26Å; T1841-V1843 PolarHBondContact O-N 3.13Å; T1841-L1844 HydrophobicContact CG2-CD1 4.47Å; T1841-L1844 WeakPolarHBondContact O-CB 3.28Å; T1841-L1844 PolarHBondContact O-N 3.19Å; T1841-F1897 HydrophobicContact CG2-CE2 4.21Å; T1841-F1897 HydrophobicContact CG2-CZ 3.76Å; T1841-W1898 PolarHBondContact N-O 3.03Å; T1841-V1899 VanDerWaalsContact CB-O 3.26Å; T1841-V1899 WeakPolarHBondContact CB-O 3.42Å; T1841-V1899 HydrophobicContact CG2-CG1 4.48Å; T1841-V1899 WeakPolarHBondContact CG2-O 3.41Å; T1841-V1899 WeakPolarHBondContact OG1-CA 3.28Å; T1841-V1899 PolarHBondContact OG1-O 2.99Å
1842	S	76.5	Confident	82.2	Confident	48.8 Å²	48.8	60.8 Å²	60.8	34%	0.341	30%	0.299	S	S	.	.	H	α-helix	trans	-66.1	-26.3	173.4	57.6	0	0	0	0	113.6	Y1754 Y1840 L1844 K1845 F1846	Y1754-S1842 WeakPolarHBondContact CE2-OG 3.48Å; Y1754-S1842 WeakPolarHBondContact OH-CB 3.41Å; Y1754-S1842 PolarHBondContact OH-OG 2.78Å; Y1840-S1842 WeakPolarHBondContact CB-OG 3.35Å; Y1840-S1842 PolarHBondContact O-N 3Å; Y1840-S1842 VanDerWaalsContact O-N 3.07Å; S1842-L1844 VanDerWaalsContact C-N 3.28Å; S1842-L1844 PolarHBondContact O-N 3.01Å; S1842-K1845 WeakPolarHBondContact O-CB 3.35Å; S1842-K1845 PolarHBondContact O-N 3.05Å; S1842-K1845 VanDerWaalsContact O-N 3.13Å; S1842-F1846 WeakPolarHBondContact O-CD2 3.33Å; S1842-F1846 PolarHBondContact O-N 3.03Å
1843	V	79.4	Confident	83.4	Confident	19 Å²	19	56 Å²	56	12%	0.115	27%	0.273	C	S	.	.	H	α-helix	trans	-61.3	-31.9	177.8	-177.9	0	0	0	0	110.8	L1760 F1839 Y1840 T1841 K1845 F1846 A1847	L1760-V1843 HydrophobicContact CD1-CG1 4.42Å; L1760-V1843 HydrophobicContact CD2-CB 4.48Å; L1760-V1843 HydrophobicContact CD2-CG1 3.97Å; L1760-V1843 HydrophobicContact CD2-CG2 3.62Å; F1839-V1843 HydrophobicContact CD1-CG1 4.35Å; Y1840-V1843 HydrophobicContact CD2-CG2 4.19Å; Y1840-V1843 WeakPolarHBondContact O-CA 3.29Å; Y1840-V1843 VanDerWaalsContact O-CB 3.24Å; Y1840-V1843 WeakPolarHBondContact O-CB 3.29Å; Y1840-V1843 VanDerWaalsContact O-CG2 3.29Å; Y1840-V1843 WeakPolarHBondContact O-CG2 3.25Å; Y1840-V1843 PolarHBondContact O-N 3.06Å; T1841-V1843 VanDerWaalsContact C-N 3.26Å; T1841-V1843 PolarHBondContact O-N 3.13Å; V1843-K1845 VanDerWaalsContact C-N 3.32Å; V1843-K1845 PolarHBondContact O-N 3.04Å; V1843-F1846 HydrophobicContact CG1-CD1 4.12Å; V1843-F1846 HydrophobicContact CG2-CD2 4.44Å; V1843-F1846 CarbonylContact O-C 3.54Å; V1843-F1846 WeakPolarHBondContact O-CA 3.09Å; V1843-F1846 VanDerWaalsContact O-CB 3.3Å; V1843-F1846 WeakPolarHBondContact O-CB 3.31Å; V1843-F1846 PolarHBondContact O-N 3.02Å; V1843-F1846 VanDerWaalsContact O-N 3.11Å; V1843-A1847 PolarHBondContact O-N 3.03Å
1844	L	78.6	Confident	84	Confident	115.4 Å²	115.4	58.4 Å²	58.4	60%	0.604	29%	0.288	S	S	*	.	H	α-helix	trans	-62.9	-40.3	174.6	-60.5	176.4	0	0	0	112.2	T1841 S1842 F1846 A1847 D1848	T1841-L1844 HydrophobicContact CG2-CD1 4.47Å; T1841-L1844 WeakPolarHBondContact O-CB 3.28Å; T1841-L1844 PolarHBondContact O-N 3.19Å; S1842-L1844 VanDerWaalsContact C-N 3.28Å; S1842-L1844 PolarHBondContact O-N 3.01Å; L1844-F1846 VanDerWaalsContact C-N 3.28Å; L1844-F1846 PolarHBondContact O-N 2.97Å; L1844-A1847 WeakPolarHBondContact O-CB 3.41Å; L1844-A1847 PolarHBondContact O-N 3.13Å; L1844-A1847 VanDerWaalsContact O-N 3.12Å; L1844-D1848 PolarHBondContact O-N 2.97Å; L1844-D1848 VanDerWaalsContact O-N 3.09Å
1845	K	78.2	Confident	84	Confident	155.4 Å²	155.4	57.2 Å²	57.2	68%	0.676	30%	0.295	S	S	*	.	H	α-helix	trans	-66.8	-34.6	175.2	-63.4	-179.2	179.6	177.4	0	111.5	S1842 V1843 K1849	S1842-K1845 WeakPolarHBondContact O-CB 3.35Å; S1842-K1845 PolarHBondContact O-N 3.05Å; S1842-K1845 VanDerWaalsContact O-N 3.13Å; V1843-K1845 VanDerWaalsContact C-N 3.32Å; V1843-K1845 PolarHBondContact O-N 3.04Å; K1845-K1849 WeakPolarHBondContact O-CB 3.24Å; K1845-K1849 WeakPolarHBondContact O-CG 3.44Å; K1845-K1849 PolarHBondContact O-N 3.13Å; K1845-K1849 VanDerWaalsContact O-N 3.11Å
1846	F	80.1	Confident	83.5	Confident	15.2 Å²	15.2	60.9 Å²	60.9	7%	0.067	31%	0.311	C	S	.	.	H	α-helix	trans	-66.9	-43	172.4	-167.2	-83	0	0	0	111.6	T1711 F1722 Y1748 T1750 Y1754 L1760 S1842 V1843 L1844 D1848 K1849 L1850	T1711-F1846 HydrophobicContact CG2-CD2 4.39Å; T1711-F1846 HydrophobicContact CG2-CE2 3.76Å; F1722-F1846 HydrophobicContact CB-CE2 4.02Å; F1722-F1846 HydrophobicContact CB-CZ 3.9Å; F1722-F1846 HydrophobicContact CD2-CE1 4.11Å; F1722-F1846 HydrophobicContact CD2-CE2 4.35Å; F1722-F1846 AromaticContact CD2-CZ 3.43Å; F1722-F1846 HydrophobicContact CD2-CZ 3.43Å; F1722-F1846 VanDerWaalsContact CD2-CZ 3.43Å; F1722-F1846 HydrophobicContact CE2-CE1 4.37Å; F1722-F1846 HydrophobicContact CE2-CZ 4.05Å; F1722-F1846 HydrophobicContact CG-CE2 4.37Å; F1722-F1846 AromaticContact CG-CZ 3.76Å; F1722-F1846 HydrophobicContact CG-CZ 3.76Å; Y1748-F1846 HydrophobicContact CD1-CB 4.05Å; Y1748-F1846 AromaticContact CD1-CD1 3.86Å; Y1748-F1846 HydrophobicContact CD1-CD1 4.1Å; Y1748-F1846 AromaticContact CD1-CD2 3.58Å; Y1748-F1846 HydrophobicContact CD1-CD2 3.7Å; Y1748-F1846 VanDerWaalsContact CD1-CD2 3.42Å; Y1748-F1846 HydrophobicContact CD1-CE1 4.23Å; Y1748-F1846 AromaticContact CD1-CE2 3.7Å; Y1748-F1846 HydrophobicContact CD1-CE2 3.7Å; Y1748-F1846 AromaticContact CD1-CG 3.67Å; Y1748-F1846 HydrophobicContact CD1-CG 3.67Å; Y1748-F1846 AromaticContact CD1-CZ 3.99Å; Y1748-F1846 HydrophobicContact CD1-CZ 4.11Å; Y1748-F1846 HydrophobicContact CD2-CB 4.12Å; Y1748-F1846 HydrophobicContact CD2-CD1 4.44Å; Y1748-F1846 AromaticContact CD2-CD2 3.34Å; Y1748-F1846 HydrophobicContact CD2-CD2 3.34Å; Y1748-F1846 VanDerWaalsContact CD2-CD2 3.41Å; Y1748-F1846 HydrophobicContact CD2-CE1 4.43Å; Y1748-F1846 AromaticContact CD2-CE2 3.32Å; Y1748-F1846 HydrophobicContact CD2-CE2 3.32Å; Y1748-F1846 VanDerWaalsContact CD2-CE2 3.47Å; Y1748-F1846 AromaticContact CD2-CG 3.93Å; Y1748-F1846 HydrophobicContact CD2-CG 4.09Å; Y1748-F1846 AromaticContact CD2-CZ 3.81Å; Y1748-F1846 HydrophobicContact CD2-CZ 3.91Å; Y1748-F1846 HydrophobicContact CE1-CB 3.68Å; Y1748-F1846 AromaticContact CE1-CD1 3.22Å; Y1748-F1846 HydrophobicContact CE1-CD1 3.22Å; Y1748-F1846 AromaticContact CE1-CD2 3.68Å; Y1748-F1846 HydrophobicContact CE1-CD2 3.68Å; Y1748-F1846 AromaticContact CE1-CE1 3.57Å; Y1748-F1846 HydrophobicContact CE1-CE1 3.57Å; Y1748-F1846 AromaticContact CE1-CE2 3.73Å; Y1748-F1846 HydrophobicContact CE1-CE2 3.9Å; Y1748-F1846 AromaticContact CE1-CG 3.47Å; Y1748-F1846 HydrophobicContact CE1-CG 3.47Å; Y1748-F1846 AromaticContact CE1-CZ 3.9Å; Y1748-F1846 HydrophobicContact CE1-CZ 3.9Å; Y1748-F1846 HydrophobicContact CE2-CB 4.01Å; Y1748-F1846 AromaticContact CE2-CD2 3.14Å; Y1748-F1846 HydrophobicContact CE2-CD2 3.14Å; Y1748-F1846 AromaticContact CE2-CE2 3.48Å; Y1748-F1846 HydrophobicContact CE2-CE2 3.48Å; Y1748-F1846 AromaticContact CE2-CG 3.93Å; Y1748-F1846 HydrophobicContact CE2-CG 4.06Å; Y1748-F1846 HydrophobicContact CE2-CZ 4.32Å; Y1748-F1846 HydrophobicContact CG-CB 4.28Å; Y1748-F1846 HydrophobicContact CG-CD1 4.12Å; Y1748-F1846 AromaticContact CG-CD2 3.81Å; Y1748-F1846 HydrophobicContact CG-CD2 3.89Å; Y1748-F1846 HydrophobicContact CG-CE1 4.28Å; Y1748-F1846 AromaticContact CG-CE2 3.87Å; Y1748-F1846 HydrophobicContact CG-CE2 4.12Å; Y1748-F1846 AromaticContact CG-CG 3.85Å; Y1748-F1846 HydrophobicContact CG-CG 4.02Å; Y1748-F1846 HydrophobicContact CG-CZ 4.2Å; Y1748-F1846 VanDerWaalsContact CZ-CB 3.49Å; Y1748-F1846 AromaticContact CZ-CD1 3.6Å; Y1748-F1846 VanDerWaalsContact CZ-CD1 3.48Å; Y1748-F1846 AromaticContact CZ-CD2 3.37Å; Y1748-F1846 AromaticContact CZ-CE2 3.98Å; Y1748-F1846 AromaticContact CZ-CG 3.69Å; Y1748-F1846 VanDerWaalsContact CZ-CG 3.45Å; Y1748-F1846 WeakPolarHBondContact OH-CD1 3.31Å; T1750-F1846 HydrophobicContact CG2-CE1 4.29Å; T1750-F1846 HydrophobicContact CG2-CE2 4.33Å; T1750-F1846 HydrophobicContact CG2-CZ 3.8Å; Y1754-F1846 HydrophobicContact CD2-CE2 4.11Å; Y1754-F1846 AromaticContact CD2-CZ 3.92Å; Y1754-F1846 HydrophobicContact CD2-CZ 3.92Å; Y1754-F1846 AromaticContact CE2-CE2 3.83Å; Y1754-F1846 HydrophobicContact CE2-CE2 3.83Å; Y1754-F1846 AromaticContact CE2-CZ 3.71Å; Y1754-F1846 HydrophobicContact CE2-CZ 3.71Å; L1760-F1846 HydrophobicContact CD1-CE1 4.13Å; S1842-F1846 WeakPolarHBondContact O-CD2 3.33Å; S1842-F1846 PolarHBondContact O-N 3.03Å; V1843-F1846 HydrophobicContact CG1-CD1 4.12Å; V1843-F1846 HydrophobicContact CG2-CD2 4.44Å; V1843-F1846 CarbonylContact O-C 3.54Å; V1843-F1846 WeakPolarHBondContact O-CA 3.09Å; V1843-F1846 VanDerWaalsContact O-CB 3.3Å; V1843-F1846 WeakPolarHBondContact O-CB 3.31Å; V1843-F1846 PolarHBondContact O-N 3.02Å; V1843-F1846 VanDerWaalsContact O-N 3.11Å; L1844-F1846 VanDerWaalsContact C-N 3.28Å; L1844-F1846 PolarHBondContact O-N 2.97Å; F1846-D1848 VanDerWaalsContact C-N 3.32Å; F1846-D1848 PolarHBondContact O-N 2.99Å; F1846-K1849 CarbonylContact O-C 3.57Å; F1846-K1849 WeakPolarHBondContact O-CA 3.38Å; F1846-K1849 WeakPolarHBondContact O-CB 3.38Å; F1846-K1849 PolarHBondContact O-N 3Å; F1846-K1849 VanDerWaalsContact O-N 3.08Å; F1846-L1850 HydrophobicContact CD2-CB 4.32Å; F1846-L1850 HydrophobicContact CE1-CD2 4.47Å; F1846-L1850 HydrophobicContact CE2-CB 3.84Å; F1846-L1850 HydrophobicContact CE2-CD1 4.19Å; F1846-L1850 HydrophobicContact CE2-CD2 4.31Å; F1846-L1850 HydrophobicContact CE2-CG 4.28Å; F1846-L1850 HydrophobicContact CZ-CB 4.19Å; F1846-L1850 HydrophobicContact CZ-CD1 4.12Å; F1846-L1850 HydrophobicContact CZ-CD2 3.85Å; F1846-L1850 HydrophobicContact CZ-CG 4.18Å; F1846-L1850 WeakPolarHBondContact O-CB 3.36Å; F1846-L1850 PolarHBondContact O-N 2.93Å
1847	A	83.8	Confident	82.8	Confident	48.6 Å²	48.6	64.8 Å²	64.8	40%	0.402	33%	0.334	S	S	.	.	H	α-helix	trans	-60.7	-40.8	176.3	0	0	0	0	0	111.9	V1843 L1844 K1849 L1850 R1851	V1843-A1847 PolarHBondContact O-N 3.03Å; L1844-A1847 WeakPolarHBondContact O-CB 3.41Å; L1844-A1847 PolarHBondContact O-N 3.13Å; L1844-A1847 VanDerWaalsContact O-N 3.12Å; A1847-K1849 VanDerWaalsContact C-N 3.32Å; A1847-K1849 PolarHBondContact O-N 2.88Å; A1847-L1850 PolarHBondContact O-N 2.96Å; A1847-R1851 VanDerWaalsContact O-CB 3.29Å; A1847-R1851 WeakPolarHBondContact O-CB 3.32Å; A1847-R1851 PolarHBondContact O-N 3.11Å
1848	D	83.9	Confident	82	Confident	80.8 Å²	80.8	67.6 Å²	67.6	43%	0.432	35%	0.353	S	S	.	.	H	α-helix	trans	-61.1	-43.8	172.5	-86.2	-26.4	0	0	0	112	L1844 F1846 R1851 N1852 K2260	L1844-D1848 PolarHBondContact O-N 2.97Å; L1844-D1848 VanDerWaalsContact O-N 3.09Å; F1846-D1848 VanDerWaalsContact C-N 3.32Å; F1846-D1848 PolarHBondContact O-N 2.99Å; D1848-R1851 PolarHBondContact O-N 3.04Å; D1848-N1852 WeakPolarHBondContact O-CB 3.44Å; D1848-N1852 PolarHBondContact O-N 3.03Å; D1848-N1852 VanDerWaalsContact O-N 3.08Å; D1848-N1852 PolarHBondContact O-ND2 3.07Å; D1848-N1852 VanDerWaalsContact O-ND2 3.1Å; D1848-K2260 IonicContact OD2-NZ 3.77Å; D1848-K2260 PolarHBondContact OD2-NZ 2.81Å
1849	K	84.1	Confident	81.8	Confident	70.6 Å²	70.6	77.4 Å²	77.4	31%	0.307	39%	0.388	S	S	.	.	H	α-helix	trans	-63.3	-46.3	176	-142.1	175.9	174.7	173.5	0	112.2	T1711 E1720 K1845 F1846 A1847 R1851 N1852 C1853	T1711-K1849 WeakPolarHBondContact O-CE 3.33Å; T1711-K1849 WeakPolarHBondContact O-CG 3.33Å; E1720-K1849 IonicContact OE1-NZ 3.47Å; E1720-K1849 PolarHBondContact OE1-NZ 3.21Å; E1720-K1849 VanDerWaalsContact OE2-CE 3.31Å; E1720-K1849 WeakPolarHBondContact OE2-CE 3.2Å; E1720-K1849 IonicContact OE2-NZ 3.16Å; E1720-K1849 PolarHBondContact OE2-NZ 3.03Å; K1845-K1849 WeakPolarHBondContact O-CB 3.24Å; K1845-K1849 WeakPolarHBondContact O-CG 3.44Å; K1845-K1849 PolarHBondContact O-N 3.13Å; K1845-K1849 VanDerWaalsContact O-N 3.11Å; F1846-K1849 CarbonylContact O-C 3.57Å; F1846-K1849 WeakPolarHBondContact O-CA 3.38Å; F1846-K1849 WeakPolarHBondContact O-CB 3.38Å; F1846-K1849 PolarHBondContact O-N 3Å; F1846-K1849 VanDerWaalsContact O-N 3.08Å; A1847-K1849 VanDerWaalsContact C-N 3.32Å; A1847-K1849 PolarHBondContact O-N 2.88Å; K1849-R1851 VanDerWaalsContact C-N 3.33Å; K1849-R1851 PolarHBondContact O-N 2.9Å; K1849-N1852 WeakPolarHBondContact O-CB 3.47Å; K1849-N1852 PolarHBondContact O-N 2.91Å; K1849-C1853 PolarHBondContact O-N 3.11Å; K1849-C1853 VanDerWaalsContact O-N 3.13Å; K1849-C1853 PolarHBondContact O-SG 3.13Å
1850	L	87.9	Confident	81.5	Confident	28.4 Å²	28.4	79.5 Å²	79.5	15%	0.149	41%	0.407	C	S	.	.	H	α-helix	trans	-59.6	-47.6	176	-180	66.3	0	0	0	110.6	Y1709 T1711 F1722 F1846 A1847 N1852 C1853 L1854	Y1709-L1850 HydrophobicContact CD1-CD1 3.55Å; Y1709-L1850 HydrophobicContact CE1-CD1 3.83Å; Y1709-L1850 HydrophobicContact CG-CD1 4.44Å; T1711-L1850 HydrophobicContact CG2-CB 4.23Å; T1711-L1850 HydrophobicContact CG2-CD1 3.89Å; T1711-L1850 HydrophobicContact CG2-CG 4.46Å; F1722-L1850 HydrophobicContact CB-CD1 4.46Å; F1722-L1850 HydrophobicContact CD1-CD1 4.37Å; F1722-L1850 HydrophobicContact CD1-CD2 4.2Å; F1722-L1850 HydrophobicContact CE1-CD2 4.4Å; F1722-L1850 HydrophobicContact CG-CD2 4.37Å; F1846-L1850 HydrophobicContact CD2-CB 4.32Å; F1846-L1850 HydrophobicContact CE1-CD2 4.47Å; F1846-L1850 HydrophobicContact CE2-CB 3.84Å; F1846-L1850 HydrophobicContact CE2-CD1 4.19Å; F1846-L1850 HydrophobicContact CE2-CD2 4.31Å; F1846-L1850 HydrophobicContact CE2-CG 4.28Å; F1846-L1850 HydrophobicContact CZ-CB 4.19Å; F1846-L1850 HydrophobicContact CZ-CD1 4.12Å; F1846-L1850 HydrophobicContact CZ-CD2 3.85Å; F1846-L1850 HydrophobicContact CZ-CG 4.18Å; F1846-L1850 WeakPolarHBondContact O-CB 3.36Å; F1846-L1850 PolarHBondContact O-N 2.93Å; A1847-L1850 PolarHBondContact O-N 2.96Å; L1850-N1852 VanDerWaalsContact C-N 3.3Å; L1850-N1852 PolarHBondContact O-N 3.07Å; L1850-C1853 WeakPolarHBondContact O-CB 3.36Å; L1850-C1853 PolarHBondContact O-N 3.05Å; L1850-C1853 VanDerWaalsContact O-N 3.13Å; L1850-L1854 HydrophobicContact CD1-CD1 4.06Å; L1850-L1854 HydrophobicContact CD1-CG 4.21Å; L1850-L1854 HydrophobicContact CD2-CD1 4.4Å; L1850-L1854 HydrophobicContact CG-CD1 3.85Å; L1850-L1854 HydrophobicContact CG-CG 4.36Å; L1850-L1854 WeakPolarHBondContact O-CB 3.35Å; L1850-L1854 VanDerWaalsContact O-CG 3.29Å; L1850-L1854 WeakPolarHBondContact O-CG 3.36Å; L1850-L1854 PolarHBondContact O-N 3.05Å
1851	R	87.9	Confident	81.7	Confident	148.4 Å²	148.4	80.5 Å²	80.5	56%	0.56	41%	0.414	S	S	*	.	H	α-helix	trans	-57.2	-43.8	175.6	178.3	-177.5	171.3	-104.6	0.4	111.8	A1847 D1848 K1849 C1853 L1854 S1855 A2325 S2327	A1847-R1851 VanDerWaalsContact O-CB 3.29Å; A1847-R1851 WeakPolarHBondContact O-CB 3.32Å; A1847-R1851 PolarHBondContact O-N 3.11Å; D1848-R1851 PolarHBondContact O-N 3.04Å; K1849-R1851 VanDerWaalsContact C-N 3.33Å; K1849-R1851 PolarHBondContact O-N 2.9Å; R1851-C1853 VanDerWaalsContact C-N 3.32Å; R1851-C1853 PolarHBondContact O-N 3.04Å; R1851-L1854 PolarHBondContact O-N 3.16Å; R1851-S1855 VanDerWaalsContact O-CB 3.26Å; R1851-S1855 WeakPolarHBondContact O-CB 3.38Å; R1851-S1855 PolarHBondContact O-N 3Å; R1851-S1855 PolarHBondContact O-OG 3.06Å; R1851-S1855 VanDerWaalsContact O-OG 3.12Å; R1851-A2325 PolarHBondContact NH2-O 2.87Å; R1851-S2327 VanDerWaalsContact CZ-OG 3.24Å; R1851-S2327 PolarHBondContact NH1-OG 2.95Å; R1851-S2327 PolarHBondContact NH2-OG 3.39Å
1852	N	85.8	Confident	82.1	Confident	85.6 Å²	85.6	80.5 Å²	80.5	46%	0.458	41%	0.408	S	S	.	.	H	α-helix	trans	-62.8	-40.4	177.6	-69.6	-21.5	0	0	0	111.7	D1848 K1849 L1850 S1855 Q1856	D1848-N1852 WeakPolarHBondContact O-CB 3.44Å; D1848-N1852 PolarHBondContact O-N 3.03Å; D1848-N1852 VanDerWaalsContact O-N 3.08Å; D1848-N1852 PolarHBondContact O-ND2 3.07Å; D1848-N1852 VanDerWaalsContact O-ND2 3.1Å; K1849-N1852 WeakPolarHBondContact O-CB 3.47Å; K1849-N1852 PolarHBondContact O-N 2.91Å; L1850-N1852 VanDerWaalsContact C-N 3.3Å; L1850-N1852 PolarHBondContact O-N 3.07Å; N1852-S1855 PolarHBondContact O-N 3.31Å; N1852-S1855 PolarHBondContact O-OG 2.96Å; N1852-Q1856 PolarHBondContact O-N 3.19Å
1853	C	87.5	Confident	82.4	Confident	4.8 Å²	4.8	83.4 Å²	83.4	3%	0.032	41%	0.412	C	S	.	.	H	α-helix	trans	-67.8	-45.4	175.1	-64.8	0	0	0	0	112.5	A1656 Y1709 T1711 K1849 L1850 R1851 S1855 Q1856	A1656-C1853 VanDerWaalsContact CB-O 3.28Å; A1656-C1853 WeakPolarHBondContact CB-O 3.32Å; Y1709-C1853 HydrophobicContact CE1-CB 4.06Å; T1711-C1853 VanDerWaalsContact C-SG 3.54Å; T1711-C1853 PolarHBondContact O-SG 2.99Å; T1711-C1853 VanDerWaalsContact O-SG 3.36Å; K1849-C1853 PolarHBondContact O-N 3.11Å; K1849-C1853 VanDerWaalsContact O-N 3.13Å; K1849-C1853 PolarHBondContact O-SG 3.13Å; L1850-C1853 WeakPolarHBondContact O-CB 3.36Å; L1850-C1853 PolarHBondContact O-N 3.05Å; L1850-C1853 VanDerWaalsContact O-N 3.13Å; R1851-C1853 VanDerWaalsContact C-N 3.32Å; R1851-C1853 PolarHBondContact O-N 3.04Å; C1853-S1855 VanDerWaalsContact C-N 3.3Å; C1853-S1855 PolarHBondContact O-N 2.94Å; C1853-Q1856 VanDerWaalsContact O-CB 3.26Å; C1853-Q1856 WeakPolarHBondContact O-CB 3.31Å; C1853-Q1856 PolarHBondContact O-N 3.15Å; C1853-Q1856 VanDerWaalsContact O-N 3.08Å
1854	L	84.2	Confident	82.6	Confident	100.8 Å²	100.8	83.8 Å²	83.8	53%	0.528	42%	0.419	S	S	.	.	H	α-helix	trans	-65.5	-32.7	178.6	-70.5	172.3	0	0	0	112.8	Y1709 L1850 R1851 Q1856	Y1709-L1854 HydrophobicContact CE1-CD2 3.98Å; Y1709-L1854 HydrophobicContact CE1-CG 4.23Å; Y1709-L1854 HydrophobicContact CE2-CD2 3.87Å; Y1709-L1854 VanDerWaalsContact CZ-CD2 3.5Å; L1850-L1854 HydrophobicContact CD1-CD1 4.06Å; L1850-L1854 HydrophobicContact CD1-CG 4.21Å; L1850-L1854 HydrophobicContact CD2-CD1 4.4Å; L1850-L1854 HydrophobicContact CG-CD1 3.85Å; L1850-L1854 HydrophobicContact CG-CG 4.36Å; L1850-L1854 WeakPolarHBondContact O-CB 3.35Å; L1850-L1854 VanDerWaalsContact O-CG 3.29Å; L1850-L1854 WeakPolarHBondContact O-CG 3.36Å; L1850-L1854 PolarHBondContact O-N 3.05Å; R1851-L1854 PolarHBondContact O-N 3.16Å; L1854-Q1856 VanDerWaalsContact C-N 3.31Å; L1854-Q1856 PolarHBondContact O-N 3.23Å
1855	S	82	Confident	82.9	Confident	75.4 Å²	75.4	82.8 Å²	82.8	53%	0.527	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-7.9	178.7	64.8	0	0	0	0	114.1	R1851 N1852 C1853 I1857	R1851-S1855 VanDerWaalsContact O-CB 3.26Å; R1851-S1855 WeakPolarHBondContact O-CB 3.38Å; R1851-S1855 PolarHBondContact O-N 3Å; R1851-S1855 PolarHBondContact O-OG 3.06Å; R1851-S1855 VanDerWaalsContact O-OG 3.12Å; N1852-S1855 PolarHBondContact O-N 3.31Å; N1852-S1855 PolarHBondContact O-OG 2.96Å; C1853-S1855 VanDerWaalsContact C-N 3.3Å; C1853-S1855 PolarHBondContact O-N 2.94Å; S1855-I1857 PolarHBondContact O-N 3.02Å
1856	Q	80	Confident	83.3	Confident	85.8 Å²	85.8	82.2 Å²	82.2	40%	0.401	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-67.6	124.7	-177.9	-167.6	-178	28.9	0	0	111.4	A1656 N1852 C1853 L1854 P1858	A1656-Q1856 HydrophobicContact CB-CB 4.35Å; N1852-Q1856 PolarHBondContact O-N 3.19Å; C1853-Q1856 VanDerWaalsContact O-CB 3.26Å; C1853-Q1856 WeakPolarHBondContact O-CB 3.31Å; C1853-Q1856 PolarHBondContact O-N 3.15Å; C1853-Q1856 VanDerWaalsContact O-N 3.08Å; L1854-Q1856 VanDerWaalsContact C-N 3.31Å; L1854-Q1856 PolarHBondContact O-N 3.23Å; Q1856-P1858 WeakPolarHBondContact O-CD 3.45Å
1857	I	76.8	Confident	83.5	Confident	132.8 Å²	132.8	87.5 Å²	87.5	68%	0.681	45%	0.446	S	S	*	.	P	Polyproline II helix	trans	-89.7	118.7	174.1	-58.8	173.8	0	0	0	108.5	S1855 R1859 R1994	S1855-I1857 PolarHBondContact O-N 3.02Å; I1857-R1859 PolarHBondContact O-N 3.23Å; I1857-R1994 VanDerWaalsContact CD1-NH2 3.33Å
1858	P	74.1	Confident	83.4	Confident	60.6 Å²	60.6	94.6 Å²	94.6	39%	0.394	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-67.3	137.9	-179.9	28.2	-35.9	0	0	0	111.2	E1659 Q1856	E1659-P1858 HydrophobicContact CB-CB 4.17Å; E1659-P1858 HydrophobicContact CB-CG 4.22Å; E1659-P1858 HydrophobicContact CG-CB 3.5Å; E1659-P1858 HydrophobicContact CG-CG 3.88Å; Q1856-P1858 WeakPolarHBondContact O-CD 3.45Å
1859	R	81	Confident	83.4	Confident	215.8 Å²	215.8	93.6 Å²	93.6	81%	0.814	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-74.9	142.8	176.1	-65.2	-174.4	-178.5	-130.5	1.5	110.2	I1857 I1861	I1857-R1859 PolarHBondContact O-N 3.23Å; R1859-I1861 PolarHBondContact O-N 3.18Å; R1859-I1861 VanDerWaalsContact O-N 3.1Å
1860	P	79.7	Confident	83.2	Confident	100 Å²	100	97.8 Å²	97.8	65%	0.649	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-66.2	120.6	176.6	9.2	-8.3	0	0	0	111.1	R1863	P1860-R1863 HydrophobicContact CB-CB 4.39Å; P1860-R1863 HydrophobicContact CB-CG 4.26Å
1861	I	86.3	Confident	82.8	Confident	46.4 Å²	46.4	98.3 Å²	98.3	24%	0.238	48%	0.481	C	S	.	.	S	Bend	trans	-92.6	128.8	178.7	-61.4	-96.8	0	0	0	110	P1660 W1664 Q1667 R1859 R1863	P1660-I1861 HydrophobicContact CB-CD1 3.87Å; P1660-I1861 HydrophobicContact CB-CG1 3.98Å; P1660-I1861 HydrophobicContact CG-CD1 4.24Å; P1660-I1861 WeakPolarHBondContact O-CD1 3.44Å; W1664-I1861 HydrophobicContact CB-CG2 4.29Å; Q1667-I1861 PolarHBondContact NE2-O 3.06Å; Q1667-I1861 PolarHBondContact OE1-O 3.01Å; R1859-I1861 PolarHBondContact O-N 3.18Å; R1859-I1861 VanDerWaalsContact O-N 3.1Å; I1861-R1863 VanDerWaalsContact C-N 3.3Å; I1861-R1863 WeakPolarHBondContact O-CG 3.4Å; I1861-R1863 PolarHBondContact O-N 3.21Å; I1861-R1863 VanDerWaalsContact O-N 3.12Å
1862	R	85.1	Confident	82.3	Confident	51.2 Å²	51.2	95.2 Å²	95.2	19%	0.193	48%	0.481	C	S	.	.	S	Bend	trans	52.7	32.7	173.7	-65.2	176.4	171.8	-134.7	-8.9	115.2	Y1336 D1441 E1444 W1664 Y1867	Y1336-R1862 PolarHBondContact OH-NH1 3.41Å; D1441-R1862 IonicContact OD2-CZ 3.33Å; D1441-R1862 VanDerWaalsContact OD2-CZ 3.27Å; D1441-R1862 IonicContact OD2-NH1 3.49Å; D1441-R1862 PolarHBondContact OD2-NH1 3.23Å; D1441-R1862 IonicContact OD2-NH2 3.09Å; D1441-R1862 PolarHBondContact OD2-NH2 3.2Å; E1444-R1862 VanDerWaalsContact CD-NH2 3.35Å; E1444-R1862 IonicContact OE1-CZ 3.84Å; E1444-R1862 VanDerWaalsContact OE1-CZ 3.26Å; E1444-R1862 IonicContact OE1-NE 3.11Å; E1444-R1862 PolarHBondContact OE1-NE 3.21Å; E1444-R1862 IonicContact OE1-NH2 3.18Å; E1444-R1862 PolarHBondContact OE1-NH2 3.2Å; E1444-R1862 IonicContact OE2-NE 3.81Å; E1444-R1862 IonicContact OE2-NH2 2.84Å; W1664-R1862 HydrophobicContact CE3-CB 4.48Å; W1664-R1862 VanDerWaalsContact CH2-CD 3.49Å; W1664-R1862 HydrophobicContact CZ3-CB 4.31Å; W1664-R1862 VanDerWaalsContact CZ3-CD 3.41Å; W1664-R1862 HydrophobicContact CZ3-CG 4.42Å; R1862-Y1867 VanDerWaalsContact C-CD2 3.44Å; R1862-Y1867 HydrophobicContact CB-CD1 4.1Å; R1862-Y1867 HydrophobicContact CB-CD2 4.43Å; R1862-Y1867 HydrophobicContact CB-CE1 4.27Å; R1862-Y1867 HydrophobicContact CB-CG 4.2Å; R1862-Y1867 HydrophobicContact CG-CD1 4.21Å; R1862-Y1867 HydrophobicContact CG-CE1 3.93Å; R1862-Y1867 VanDerWaalsContact O-CB 3.28Å; R1862-Y1867 WeakPolarHBondContact O-CB 3.44Å
1863	R	83.1	Confident	81.8	Confident	110.8 Å²	110.8	101 Å²	101	42%	0.418	50%	0.496	S	S	.	.			trans	-112	147.4	177.2	-63.8	178.5	-169.7	176.4	6.2	111.1	S1663 P1860 I1861 Y1869 P1871	S1663-R1863 PolarHBondContact OG-NH2 3.28Å; S1663-R1863 VanDerWaalsContact OG-NH2 3.09Å; P1860-R1863 HydrophobicContact CB-CB 4.39Å; P1860-R1863 HydrophobicContact CB-CG 4.26Å; I1861-R1863 VanDerWaalsContact C-N 3.3Å; I1861-R1863 WeakPolarHBondContact O-CG 3.4Å; I1861-R1863 PolarHBondContact O-N 3.21Å; I1861-R1863 VanDerWaalsContact O-N 3.12Å; R1863-Y1869 WeakPolarHBondContact CA-O 3.43Å; R1863-Y1869 HydrophobicContact CG-CD1 3.94Å; R1863-Y1869 HydrophobicContact CG-CE1 4.16Å; R1863-P1871 HydrophobicContact CG-CG 4.18Å
1864	G	84.3	Confident	81.3	Confident	26.6 Å²	26.6	106 Å²	106	27%	0.274	52%	0.518	S	S	.	.	B	Isolated β-bridge	trans	127	-172.2	174.9	0	0	0	0	0	113.6	L1866 Y1867 K1868 Y1869	G1864-L1866 VanDerWaalsContact C-N 3.32Å; G1864-L1866 PolarHBondContact O-N 3.35Å; G1864-Y1867 PolarHBondContact O-N 3.06Å; G1864-K1868 PolarHBondContact O-N 3.35Å; G1864-Y1869 PolarHBondContact N-O 2.98Å; G1864-Y1869 PolarHBondContact O-N 3.03Å
1865	S	85.1	Confident	81.1	Confident	95 Å²	95	103.6 Å²	103.6	66%	0.664	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-43.3	177.2	39.9	0	0	0	0	112.5	Y1867 K1868	S1865-Y1867 VanDerWaalsContact C-N 3.29Å; S1865-Y1867 PolarHBondContact O-N 3.13Å; S1865-K1868 PolarHBondContact O-N 3.13Å; S1865-K1868 VanDerWaalsContact O-N 3.11Å
1866	L	86.5	Confident	81	Confident	143.4 Å²	143.4	105.6 Å²	105.6	75%	0.751	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-44.2	-178.8	-177	64.9	0	0	0	112.6	G1864 K1868	G1864-L1866 VanDerWaalsContact C-N 3.32Å; G1864-L1866 PolarHBondContact O-N 3.35Å; L1866-K1868 VanDerWaalsContact C-N 3.31Å; L1866-K1868 PolarHBondContact O-N 2.63Å
1867	Y	83.6	Confident	81.2	Confident	125.4 Å²	125.4	103.9 Å²	103.9	49%	0.492	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	0.4	-178.7	-62.3	-77.8	0	0	0	113.7	R1862 G1864 S1865 Y1869	R1862-Y1867 VanDerWaalsContact C-CD2 3.44Å; R1862-Y1867 HydrophobicContact CB-CD1 4.1Å; R1862-Y1867 HydrophobicContact CB-CD2 4.43Å; R1862-Y1867 HydrophobicContact CB-CE1 4.27Å; R1862-Y1867 HydrophobicContact CB-CG 4.2Å; R1862-Y1867 HydrophobicContact CG-CD1 4.21Å; R1862-Y1867 HydrophobicContact CG-CE1 3.93Å; R1862-Y1867 VanDerWaalsContact O-CB 3.28Å; R1862-Y1867 WeakPolarHBondContact O-CB 3.44Å; G1864-Y1867 PolarHBondContact O-N 3.06Å; S1865-Y1867 VanDerWaalsContact C-N 3.29Å; S1865-Y1867 PolarHBondContact O-N 3.13Å; Y1867-Y1869 PolarHBondContact O-N 3.07Å
1868	K	83.1	Confident	81.4	Confident	197 Å²	197	99.4 Å²	99.4	86%	0.857	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	10.8	-172.2	-57	-179.9	-178.7	178.4	0	114.6	G1864 S1865 L1866 K1870	G1864-K1868 PolarHBondContact O-N 3.35Å; S1865-K1868 PolarHBondContact O-N 3.13Å; S1865-K1868 VanDerWaalsContact O-N 3.11Å; L1866-K1868 VanDerWaalsContact C-N 3.31Å; L1866-K1868 PolarHBondContact O-N 2.63Å; K1868-K1870 PolarHBondContact O-N 2.97Å
1869	Y	82.3	Confident	81.9	Confident	60.6 Å²	60.6	99.8 Å²	99.8	24%	0.238	48%	0.48	C	S	.	.	B	Isolated β-bridge	trans	-108.7	109.6	-178.9	-177	-110.8	0	0	0	110.9	Q1667 D1670 R1863 G1864 Y1867 P1871	Q1667-Y1869 HydrophobicContact CB-CE1 4.41Å; Q1667-Y1869 HydrophobicContact CG-CD1 4.35Å; Q1667-Y1869 HydrophobicContact CG-CE1 3.52Å; Q1667-Y1869 VanDerWaalsContact CG-CE1 3.48Å; Q1667-Y1869 VanDerWaalsContact OE1-CD1 3.29Å; D1670-Y1869 WeakPolarHBondContact OD2-CE2 3.22Å; D1670-Y1869 PolarHBondContact OD2-OH 3.12Å; R1863-Y1869 WeakPolarHBondContact CA-O 3.43Å; R1863-Y1869 HydrophobicContact CG-CD1 3.94Å; R1863-Y1869 HydrophobicContact CG-CE1 4.16Å; G1864-Y1869 PolarHBondContact N-O 2.98Å; G1864-Y1869 PolarHBondContact O-N 3.03Å; Y1867-Y1869 PolarHBondContact O-N 3.07Å; Y1869-P1871 VanDerWaalsContact C-CD 3.48Å; Y1869-P1871 VanDerWaalsContact CD1-CD 3.49Å; Y1869-P1871 HydrophobicContact CD1-CG 4.1Å; Y1869-P1871 HydrophobicContact CE1-CB 4.18Å; Y1869-P1871 VanDerWaalsContact CE1-CD 3.43Å; Y1869-P1871 HydrophobicContact CE1-CG 3.43Å; Y1869-P1871 VanDerWaalsContact CE1-CG 3.42Å; Y1869-P1871 HydrophobicContact CE2-CB 4.31Å; Y1869-P1871 HydrophobicContact CE2-CG 4.37Å; Y1869-P1871 WeakPolarHBondContact O-CD 3.2Å
1870	K	81.1	Confident	82.2	Confident	158.4 Å²	158.4	90 Å²	90	69%	0.689	44%	0.444	S	S	*	.			trans	-130.3	68.8	-179.3	-64.7	-178.6	-177.8	176.5	0	110.4	K1868	K1868-K1870 PolarHBondContact O-N 2.97Å
1871	P	79.6	Confident	82.7	Confident	38.8 Å²	38.8	86.2 Å²	86.2	25%	0.252	42%	0.418	S	S	.	.			trans	-64.6	149.4	-179.6	30	-37.7	0	0	0	110.8	R1863 Y1869	R1863-P1871 HydrophobicContact CG-CG 4.18Å; Y1869-P1871 VanDerWaalsContact C-CD 3.48Å; Y1869-P1871 VanDerWaalsContact CD1-CD 3.49Å; Y1869-P1871 HydrophobicContact CD1-CG 4.1Å; Y1869-P1871 HydrophobicContact CE1-CB 4.18Å; Y1869-P1871 VanDerWaalsContact CE1-CD 3.43Å; Y1869-P1871 HydrophobicContact CE1-CG 3.43Å; Y1869-P1871 VanDerWaalsContact CE1-CG 3.42Å; Y1869-P1871 HydrophobicContact CE2-CB 4.31Å; Y1869-P1871 HydrophobicContact CE2-CG 4.37Å; Y1869-P1871 WeakPolarHBondContact O-CD 3.2Å
1872	P	76.6	Confident	83	Confident	83.8 Å²	83.8	84.3 Å²	84.3	54%	0.544	41%	0.408	S	S	.	.			trans	-60.9	145.2	173.7	27.8	-34.8	0	0	0	110.1	P1683 K1874	P1683-P1872 HydrophobicContact CG-CB 4.12Å; P1683-P1872 HydrophobicContact CG-CG 4.15Å; P1872-K1874 PolarHBondContact O-N 3.26Å; P1872-K1874 VanDerWaalsContact O-N 3.11Å
1873	R	75.7	Confident	83.4	Confident	207 Å²	207	82.9 Å²	82.9	78%	0.781	41%	0.406	S	S	*	.			trans	-65.3	113.6	179.8	-71.8	-177.7	175.5	159.1	-0.2	109.7	P1683	P1683-R1873 VanDerWaalsContact CG-O 3.26Å; P1683-R1873 WeakPolarHBondContact CG-O 3.45Å
1874	K	77	Confident	83.9	Confident	111.2 Å²	111.2	79.3 Å²	79.3	48%	0.483	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-69.6	142.2	171	-63.5	-179.7	-177.6	174.9	0	109.5	D1670 P1683 P1872	D1670-K1874 IonicContact OD1-NZ 3.91Å; D1670-K1874 IonicContact OD2-NZ 3.59Å; P1683-K1874 HydrophobicContact CB-CG 4.45Å; P1683-K1874 HydrophobicContact CG-CG 4.35Å; P1872-K1874 PolarHBondContact O-N 3.26Å; P1872-K1874 VanDerWaalsContact O-N 3.11Å
1875	P	79.6	Confident	84.4	Confident	50 Å²	50	81.8 Å²	81.8	33%	0.325	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-65.1	150.2	175.3	28.8	-35.2	0	0	0	110.7	P1683 W1687	P1683-P1875 VanDerWaalsContact O-CD 3.29Å; P1683-P1875 WeakPolarHBondContact O-CD 3.39Å; W1687-P1875 HydrophobicContact CH2-CB 3.74Å; W1687-P1875 HydrophobicContact CH2-CG 3.73Å; W1687-P1875 WeakPolarHBondContact CH2-O 3.35Å; W1687-P1875 HydrophobicContact CZ2-CB 3.93Å; W1687-P1875 HydrophobicContact CZ2-CG 3.81Å
1876	H	80.6	Confident	85	Confident	117 Å²	117	79.8 Å²	79.8	54%	0.542	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-99.7	132.4	178.4	-82.7	-87.7	0	0	0	110.8	G1878 R1879 R1994	H1876-G1878 PolarHBondContact ND1-N 2.9Å; H1876-G1878 VanDerWaalsContact ND1-N 3.11Å; H1876-G1878 PolarHBondContact O-N 3.29Å; H1876-R1879 HydrophobicContact CB-CB 4.47Å; H1876-R1879 HydrophobicContact CB-CG 4.08Å; H1876-R1879 PolarHBondContact O-N 2.98Å; H1876-R1879 VanDerWaalsContact O-N 3.12Å; H1876-R1994 PolarHBondContact CD2-NH1 3.16Å; H1876-R1994 PolarHBondContact CD2-NH2 3Å; H1876-R1994 PolarHBondContact NE2-NH1 2.97Å; H1876-R1994 PolarHBondContact NE2-NH2 3.38Å
1877	F	84.1	Confident	85.4	Confident	50.4 Å²	50.4	74.1 Å²	74.1	22%	0.221	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-60.4	-44	-175.4	-178.2	-101.7	0	0	0	113	W1686 W1687 W1774 L1813 M1815 R1879 L1880 L1881	W1686-F1877 HydrophobicContact CZ2-CB 4.38Å; W1686-F1877 AromaticContact CZ2-CD2 3.99Å; W1686-F1877 HydrophobicContact CZ2-CD2 4.03Å; W1686-F1877 HydrophobicContact CZ2-CE2 4.45Å; W1686-F1877 HydrophobicContact CZ2-CG 4.13Å; W1687-F1877 HydrophobicContact CB-CD2 4.39Å; W1687-F1877 HydrophobicContact CB-CE2 4.41Å; W1687-F1877 AromaticContact CD2-CD2 3.89Å; W1687-F1877 HydrophobicContact CD2-CD2 3.95Å; W1687-F1877 HydrophobicContact CE3-CB 3.95Å; W1687-F1877 AromaticContact CE3-CD2 3.61Å; W1687-F1877 HydrophobicContact CE3-CD2 3.61Å; W1687-F1877 HydrophobicContact CE3-CG 4.26Å; W1687-F1877 HydrophobicContact CG-CD2 4.3Å; W1687-F1877 HydrophobicContact CH2-CB 4.38Å; W1687-F1877 VanDerWaalsContact CZ3-CA 3.48Å; W1687-F1877 HydrophobicContact CZ3-CB 3.67Å; W1687-F1877 HydrophobicContact CZ3-CD2 4.14Å; W1687-F1877 HydrophobicContact CZ3-CG 4.38Å; W1774-F1877 AromaticContact CH2-CE2 3.91Å; W1774-F1877 HydrophobicContact CH2-CE2 4.07Å; W1774-F1877 HydrophobicContact CZ3-CE2 4.26Å; L1813-F1877 HydrophobicContact CD2-CE1 4.39Å; L1813-F1877 HydrophobicContact CD2-CE2 3.94Å; L1813-F1877 HydrophobicContact CD2-CZ 3.69Å; M1815-F1877 HydrophobicContact CE-CE1 4.49Å; M1815-F1877 HydrophobicContact CE-CZ 4.43Å; F1877-R1879 PolarHBondContact O-N 3.02Å; F1877-R1879 VanDerWaalsContact O-N 3.09Å; F1877-L1880 HydrophobicContact CD2-CD1 3.73Å; F1877-L1880 HydrophobicContact CD2-CD2 4.34Å; F1877-L1880 HydrophobicContact CE2-CD1 4.06Å; F1877-L1880 HydrophobicContact CE2-CD2 4.29Å; F1877-L1880 WeakPolarHBondContact O-CA 3.32Å; F1877-L1880 VanDerWaalsContact O-CB 3.28Å; F1877-L1880 WeakPolarHBondContact O-CB 3.35Å; F1877-L1880 WeakPolarHBondContact O-CG 3.31Å; F1877-L1880 PolarHBondContact O-N 2.87Å; F1877-L1881 HydrophobicContact CE1-CD1 3.83Å; F1877-L1881 HydrophobicContact CZ-CD1 4.27Å
1878	G	81.4	Confident	86	Confident	39 Å²	39	70.2 Å²	70.2	40%	0.402	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-63.4	-12.2	178.8	0	0	0	0	0	115.1	H1876 L1880	H1876-G1878 PolarHBondContact ND1-N 2.9Å; H1876-G1878 VanDerWaalsContact ND1-N 3.11Å; H1876-G1878 PolarHBondContact O-N 3.29Å; G1878-L1880 VanDerWaalsContact C-N 3.32Å
1879	R	83.4	Confident	86.6	Confident	69 Å²	69	62.8 Å²	62.8	26%	0.26	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-91	-8.3	171.2	-69.4	-168.3	171.2	-131.3	-11	113.7	R1812 H1876 F1877 L1881 I1924 P1995 V1997	R1812-R1879 PolarHBondContact NH1-O 3.32Å; H1876-R1879 HydrophobicContact CB-CB 4.47Å; H1876-R1879 HydrophobicContact CB-CG 4.08Å; H1876-R1879 PolarHBondContact O-N 2.98Å; H1876-R1879 VanDerWaalsContact O-N 3.12Å; F1877-R1879 PolarHBondContact O-N 3.02Å; F1877-R1879 VanDerWaalsContact O-N 3.09Å; R1879-L1881 VanDerWaalsContact C-N 3.31Å; R1879-I1924 HydrophobicContact CB-CD1 4.27Å; R1879-I1924 HydrophobicContact CG-CD1 4.5Å; R1879-I1924 WeakPolarHBondContact O-CD1 3.34Å; R1879-P1995 VanDerWaalsContact CZ-O 3.26Å; R1879-P1995 PolarHBondContact NH1-O 3.17Å; R1879-P1995 PolarHBondContact NH2-O 3.09Å; R1879-V1997 HydrophobicContact CG-CG2 4.12Å; R1879-V1997 VanDerWaalsContact CZ-CG2 3.42Å; R1879-V1997 VanDerWaalsContact NH2-CG2 3.32Å
1880	L	88.3	Confident	87.2	Confident	8.4 Å²	8.4	60.9 Å²	60.9	4%	0.044	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-36.1	174.5	-150.6	85.7	0	0	0	110.4	W1687 W1774 A1810 R1812 L1813 F1877 G1878 Q1882	W1687-L1880 HydrophobicContact CD2-CD1 3.65Å; W1687-L1880 HydrophobicContact CD2-CD2 4.33Å; W1687-L1880 HydrophobicContact CE3-CD1 4.19Å; W1687-L1880 HydrophobicContact CG-CD1 4.07Å; W1687-L1880 HydrophobicContact CG-CD2 4.34Å; W1687-L1880 HydrophobicContact CH2-CD1 4.09Å; W1687-L1880 HydrophobicContact CH2-CG 4.43Å; W1687-L1880 HydrophobicContact CZ2-CD1 4.14Å; W1687-L1880 HydrophobicContact CZ2-CD2 4.26Å; W1687-L1880 HydrophobicContact CZ2-CG 4.01Å; W1687-L1880 HydrophobicContact CZ3-CD1 4.38Å; W1774-L1880 HydrophobicContact CE3-CD2 3.87Å; W1774-L1880 HydrophobicContact CZ3-CD1 4.02Å; W1774-L1880 HydrophobicContact CZ3-CD2 3.43Å; W1774-L1880 VanDerWaalsContact CZ3-CD2 3.43Å; A1810-L1880 HydrophobicContact CB-CD1 4.07Å; A1810-L1880 HydrophobicContact CB-CD2 4.27Å; A1810-L1880 HydrophobicContact CB-CG 4.46Å; A1810-L1880 WeakPolarHBondContact O-CD1 3.23Å; A1810-L1880 WeakPolarHBondContact O-CD2 3.41Å; R1812-L1880 CarbonylContact C-O 3.53Å; R1812-L1880 VanDerWaalsContact C-O 3.3Å; R1812-L1880 WeakPolarHBondContact CA-O 3.29Å; R1812-L1880 VanDerWaalsContact CB-O 3.27Å; R1812-L1880 WeakPolarHBondContact CB-O 3.45Å; R1812-L1880 VanDerWaalsContact CD-O 3.27Å; R1812-L1880 WeakPolarHBondContact CD-O 3.36Å; R1812-L1880 PolarHBondContact NE-O 2.96Å; L1813-L1880 HydrophobicContact CB-CB 4.24Å; L1813-L1880 HydrophobicContact CB-CD2 3.75Å; L1813-L1880 HydrophobicContact CB-CG 3.68Å; L1813-L1880 HydrophobicContact CD2-CD2 4.22Å; L1813-L1880 PolarHBondContact N-O 3.1Å; F1877-L1880 HydrophobicContact CD2-CD1 3.73Å; F1877-L1880 HydrophobicContact CD2-CD2 4.34Å; F1877-L1880 HydrophobicContact CE2-CD1 4.06Å; F1877-L1880 HydrophobicContact CE2-CD2 4.29Å; F1877-L1880 WeakPolarHBondContact O-CA 3.32Å; F1877-L1880 VanDerWaalsContact O-CB 3.28Å; F1877-L1880 WeakPolarHBondContact O-CB 3.35Å; F1877-L1880 WeakPolarHBondContact O-CG 3.31Å; F1877-L1880 PolarHBondContact O-N 2.87Å; G1878-L1880 VanDerWaalsContact C-N 3.32Å; L1880-Q1882 PolarHBondContact O-N 3.17Å; L1880-Q1882 VanDerWaalsContact O-N 3.16Å
1881	L	90.7	Very high	87.6	Confident	20.6 Å²	20.6	56 Å²	56	11%	0.108	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.2	118.2	-179.6	-73.7	161.3	0	0	0	110.9	R1812 L1813 M1815 F1877 R1879 L1884 C1922 W1999	R1812-L1881 PolarHBondContact NE-O 2.85Å; R1812-L1881 PolarHBondContact NH2-O 3.03Å; L1813-L1881 HydrophobicContact CB-CD2 4.5Å; L1813-L1881 HydrophobicContact CD2-CD1 4.2Å; L1813-L1881 HydrophobicContact CD2-CD2 3.82Å; L1813-L1881 HydrophobicContact CD2-CG 4.3Å; L1813-L1881 HydrophobicContact CG-CD2 4.12Å; L1813-L1881 CarbonylContact O-C 3.59Å; L1813-L1881 WeakPolarHBondContact O-CA 3.43Å; M1815-L1881 HydrophobicContact CB-CD2 3.87Å; M1815-L1881 HydrophobicContact CB-CG 4.47Å; M1815-L1881 HydrophobicContact CE-CD2 3.88Å; M1815-L1881 HydrophobicContact SD-CD1 4.17Å; M1815-L1881 HydrophobicContact SD-CD2 4.17Å; F1877-L1881 HydrophobicContact CE1-CD1 3.83Å; F1877-L1881 HydrophobicContact CZ-CD1 4.27Å; R1879-L1881 VanDerWaalsContact C-N 3.31Å; L1881-L1884 HydrophobicContact CD2-CB 3.75Å; L1881-C1922 VanDerWaalsContact O-CB 3.31Å; L1881-C1922 WeakPolarHBondContact O-CB 3.41Å; L1881-C1922 PolarHBondContact O-SG 2.98Å; L1881-W1999 HydrophobicContact CB-CH2 3.82Å; L1881-W1999 HydrophobicContact CB-CZ2 4.26Å; L1881-W1999 HydrophobicContact CD1-CH2 3.93Å; L1881-W1999 HydrophobicContact CD1-CZ2 4.2Å; L1881-W1999 HydrophobicContact CD2-CH2 3.96Å; L1881-W1999 HydrophobicContact CG-CH2 4.44Å
1882	Q	92.2	Very high	88.1	Confident	7.2 Å²	7.2	57.6 Å²	57.6	3%	0.034	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	-39.6	172.4	179.4	174.7	-61	0	0	110.4	L1775 R1812 L1813 L1880 K1921 C1922 Y1977 M1979	L1775-Q1882 HydrophobicContact CD1-CB 4.35Å; R1812-Q1882 HydrophobicContact CB-CB 3.89Å; R1812-Q1882 HydrophobicContact CG-CB 4.18Å; R1812-Q1882 VanDerWaalsContact CG-OE1 3.28Å; L1813-Q1882 PolarHBondContact O-N 2.91Å; L1880-Q1882 PolarHBondContact O-N 3.17Å; L1880-Q1882 VanDerWaalsContact O-N 3.16Å; Q1882-K1921 CarbonylContact O-C 3.52Å; Q1882-K1921 WeakPolarHBondContact O-CA 3.36Å; Q1882-K1921 WeakPolarHBondContact O-CG 3.48Å; Q1882-C1922 PolarHBondContact O-N 3.21Å; Q1882-Y1977 PolarHBondContact NE2-O 3.33Å; Q1882-M1979 VanDerWaalsContact OE1-N 3.08Å
1883	S	92.4	Very high	88.8	Confident	21.8 Å²	21.8	54.6 Å²	54.6	15%	0.152	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	144	175.3	46.2	0	0	0	0	110.5	A1814 M1815 L1920 H1975	A1814-S1883 WeakPolarHBondContact CA-O 3.3Å; A1814-S1883 WeakPolarHBondContact CA-OG 3.31Å; A1814-S1883 VanDerWaalsContact CB-OG 3.3Å; A1814-S1883 WeakPolarHBondContact CB-OG 3.37Å; M1815-S1883 PolarHBondContact N-O 3.04Å; S1883-L1920 CarbonylContact C-O 3.5Å; S1883-L1920 VanDerWaalsContact CA-O 3.28Å; S1883-L1920 WeakPolarHBondContact CA-O 3.32Å; S1883-L1920 WeakPolarHBondContact CB-O 3.23Å; S1883-H1975 PolarHBondContact OG-NE2 3.44Å
1884	L	94.5	Very high	89.6	Confident	34.4 Å²	34.4	46.8 Å²	46.8	18%	0.18	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	114.6	171.2	173.4	60.8	0	0	0	107.3	M1815 I1817 L1881 L1920 W1999	M1815-L1884 HydrophobicContact CB-CD1 4.02Å; M1815-L1884 HydrophobicContact CG-CD1 3.87Å; M1815-L1884 CarbonylContact O-C 3.55Å; M1815-L1884 WeakPolarHBondContact O-CA 3.38Å; M1815-L1884 HydrophobicContact SD-CD1 3.97Å; I1817-L1884 HydrophobicContact CD1-CD1 3.86Å; I1817-L1884 HydrophobicContact CG1-CD1 4.06Å; L1881-L1884 HydrophobicContact CD2-CB 3.75Å; L1884-L1920 HydrophobicContact CB-CB 4.31Å; L1884-L1920 HydrophobicContact CD2-CD1 4.21Å; L1884-L1920 HydrophobicContact CG-CD1 4.43Å; L1884-L1920 PolarHBondContact N-O 3.12Å; L1884-L1920 WeakPolarHBondContact O-CB 3.44Å; L1884-L1920 PolarHBondContact O-N 3.05Å; L1884-W1999 HydrophobicContact CB-CH2 4.4Å; L1884-W1999 HydrophobicContact CB-CZ3 4.19Å
1885	E	95.5	Very high	90.3	Very high	80.2 Å²	80.2	44.1 Å²	44.1	38%	0.375	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	134.4	172.6	-160.9	167.8	167.6	0	0	108.5	M1815 G1816 I1817 G1918 K1919	M1815-E1885 PolarHBondContact O-N 3.12Å; G1816-E1885 CarbonylContact C-O 3.59Å; G1816-E1885 VanDerWaalsContact CA-O 3.27Å; G1816-E1885 WeakPolarHBondContact CA-O 3.44Å; I1817-E1885 PolarHBondContact N-O 2.99Å; E1885-G1918 CarbonylContact C-O 3.54Å; E1885-G1918 VanDerWaalsContact CA-O 3.28Å; E1885-G1918 WeakPolarHBondContact CA-O 3.42Å; E1885-K1919 HydrophobicContact CB-CG 4.43Å; E1885-K1919 HydrophobicContact CG-CB 4.43Å; E1885-K1919 HydrophobicContact CG-CD 4.42Å; E1885-K1919 HydrophobicContact CG-CG 4.09Å; E1885-K1919 WeakPolarHBondContact OE1-CD 3.36Å; E1885-K1919 VanDerWaalsContact OE1-CE 3.25Å; E1885-K1919 WeakPolarHBondContact OE1-CE 3.42Å; E1885-K1919 IonicContact OE1-NZ 2.98Å; E1885-K1919 PolarHBondContact OE1-NZ 3.19Å; E1885-K1919 WeakPolarHBondContact OE2-CD 3Å; E1885-K1919 VanDerWaalsContact OE2-CE 3.25Å; E1885-K1919 WeakPolarHBondContact OE2-CE 3.37Å; E1885-K1919 IonicContact OE2-NZ 3.07Å; E1885-K1919 PolarHBondContact OE2-NZ 3.1Å
1886	F	96.3	Very high	90.7	Very high	51.6 Å²	51.6	42.6 Å²	42.6	23%	0.226	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	144.9	172.9	66.5	-90.1	0	0	0	111.5	I1817 I1888 I1916 I1917 G1918 L1920 L2004	I1817-F1886 HydrophobicContact CB-CB 4.29Å; I1817-F1886 CarbonylContact O-C 3.53Å; I1817-F1886 WeakPolarHBondContact O-CA 3.28Å; I1817-F1886 WeakPolarHBondContact O-CB 3.3Å; F1886-I1888 HydrophobicContact CD2-CD1 4.37Å; F1886-I1888 HydrophobicContact CD2-CG1 4.45Å; F1886-I1888 HydrophobicContact CE2-CD1 4.47Å; F1886-I1916 HydrophobicContact CE2-CG2 4.09Å; F1886-I1917 CarbonylContact O-C 3.51Å; F1886-I1917 WeakPolarHBondContact O-CA 3.28Å; F1886-G1918 WeakPolarHBondContact CD1-O 3.15Å; F1886-G1918 PolarHBondContact N-O 2.96Å; F1886-G1918 PolarHBondContact O-N 2.9Å; F1886-L1920 HydrophobicContact CE1-CD1 4.24Å; F1886-L1920 HydrophobicContact CE1-CG 4.4Å; F1886-L2004 HydrophobicContact CE2-CD1 4.37Å; F1886-L2004 HydrophobicContact CZ-CD1 4.06Å
1887	S	96.5	Very high	91.1	Very high	24.6 Å²	24.6	40.5 Å²	40.5	17%	0.172	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	135.4	175.1	158	0	0	0	0	109	I1817 N1818 F1819 N1889 I1916	I1817-S1887 PolarHBondContact O-N 3.04Å; N1818-S1887 CarbonylContact C-O 3.53Å; N1818-S1887 WeakPolarHBondContact CA-O 3.29Å; N1818-S1887 VanDerWaalsContact OD1-CB 3.3Å; N1818-S1887 WeakPolarHBondContact OD1-CB 3.4Å; N1818-S1887 PolarHBondContact OD1-O 2.86Å; N1818-S1887 PolarHBondContact OD1-OG 2.97Å; F1819-S1887 PolarHBondContact N-O 3.14Å; S1887-N1889 PolarHBondContact OG-ND2 3.14Å; S1887-I1916 CarbonylContact C-O 3.56Å; S1887-I1916 VanDerWaalsContact CA-O 3.27Å; S1887-I1916 WeakPolarHBondContact CA-O 3.39Å
1888	I	95.8	Very high	91	Very high	42.6 Å²	42.6	39 Å²	39	22%	0.218	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	121.1	176.5	-58.2	168.1	0	0	0	106.7	F1819 F1886 I1890 Q1915 I1916	F1819-I1888 HydrophobicContact CB-CB 4.43Å; F1819-I1888 HydrophobicContact CB-CG1 4.2Å; F1819-I1888 HydrophobicContact CB-CG2 4.38Å; F1819-I1888 HydrophobicContact CD2-CG1 3.86Å; F1819-I1888 HydrophobicContact CG-CG1 4.42Å; F1819-I1888 CarbonylContact O-C 3.55Å; F1819-I1888 WeakPolarHBondContact O-CA 3.38Å; F1886-I1888 HydrophobicContact CD2-CD1 4.37Å; F1886-I1888 HydrophobicContact CD2-CG1 4.45Å; F1886-I1888 HydrophobicContact CE2-CD1 4.47Å; I1888-I1890 HydrophobicContact CG2-CD1 3.74Å; I1888-I1890 HydrophobicContact CG2-CG1 3.84Å; I1888-Q1915 CarbonylContact O-C 3.54Å; I1888-Q1915 WeakPolarHBondContact O-CA 3.32Å; I1888-I1916 HydrophobicContact CB-CB 4.26Å; I1888-I1916 HydrophobicContact CD1-CD1 4.46Å; I1888-I1916 PolarHBondContact N-O 3.11Å; I1888-I1916 PolarHBondContact O-N 3.14Å
1889	N	95.6	Very high	90.9	Very high	41.8 Å²	41.8	39.3 Å²	39.3	22%	0.224	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	114.7	178.4	-55.1	-76.9	0	0	0	108.6	N1818 F1819 T1820 V1821 S1887 I1914 Q1915	N1818-N1889 PolarHBondContact OD1-ND2 2.92Å; F1819-N1889 PolarHBondContact O-N 2.98Å; T1820-N1889 HydrophobicContact CG2-CB 4.21Å; V1821-N1889 PolarHBondContact N-O 3.13Å; V1821-N1889 VanDerWaalsContact N-O 3.09Å; S1887-N1889 PolarHBondContact OG-ND2 3.14Å; N1889-I1914 WeakPolarHBondContact CA-O 3.29Å; N1889-Q1915 WeakPolarHBondContact OD1-CG 3.39Å; N1889-Q1915 PolarHBondContact OD1-NE2 3.12Å; N1889-Q1915 VanDerWaalsContact OD1-NE2 3.09Å
1890	I	93.6	Very high	90.4	Very high	20.6 Å²	20.6	38.1 Å²	38.1	11%	0.106	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	127.4	-176.8	-56.2	173.1	0	0	0	107.7	V1821 P1835 I1888 Q1892 L1893 P1913 I1914	V1821-I1890 HydrophobicContact CB-CG2 4.4Å; V1821-I1890 HydrophobicContact CG2-CB 4.47Å; V1821-I1890 HydrophobicContact CG2-CG1 4.02Å; V1821-I1890 HydrophobicContact CG2-CG2 4.3Å; P1835-I1890 HydrophobicContact CB-CG2 4.47Å; P1835-I1890 HydrophobicContact CG-CG2 3.86Å; I1888-I1890 HydrophobicContact CG2-CD1 3.74Å; I1888-I1890 HydrophobicContact CG2-CG1 3.84Å; I1890-Q1892 VanDerWaalsContact CG2-O 3.24Å; I1890-Q1892 WeakPolarHBondContact CG2-O 3.32Å; I1890-L1893 HydrophobicContact CD1-CD2 4.45Å; I1890-L1893 HydrophobicContact CG2-CB 4.33Å; I1890-P1913 CarbonylContact O-C 3.56Å; I1890-P1913 WeakPolarHBondContact O-CA 3.37Å; I1890-I1914 HydrophobicContact CB-CB 4.38Å; I1890-I1914 PolarHBondContact N-O 3.16Å; I1890-I1914 PolarHBondContact O-N 3.05Å
1891	P	90.9	Very high	89.4	Confident	56 Å²	56	41 Å²	41	36%	0.364	21%	0.211	S	C	.	.	S	Bend	trans	-73.2	-29.6	-172.1	27.5	-34.7	0	0	0	114.3	V1821 G1912 P1913	V1821-P1891 HydrophobicContact CB-CG 4.46Å; V1821-P1891 HydrophobicContact CG1-CG 4.24Å; P1891-G1912 CarbonylContact O-C 3.52Å; P1891-G1912 VanDerWaalsContact O-C 3.26Å; P1891-P1913 VanDerWaalsContact O-CA 3.25Å; P1891-P1913 WeakPolarHBondContact O-CA 3.35Å; P1891-P1913 WeakPolarHBondContact O-CD 3.31Å; P1891-P1913 VanDerWaalsContact O-N 3.13Å
1892	Q	90.1	Very high	88.2	Confident	72.6 Å²	72.6	42.6 Å²	42.6	34%	0.339	23%	0.227	S	C	.	.			trans	-157.4	148.3	176.6	-179.9	177.4	18.5	0	0	106.7	P1835 I1890 T1911	P1835-Q1892 WeakPolarHBondContact CG-O 3.37Å; I1890-Q1892 VanDerWaalsContact CG2-O 3.24Å; I1890-Q1892 WeakPolarHBondContact CG2-O 3.32Å; Q1892-T1911 WeakPolarHBondContact CA-O 3.3Å; Q1892-T1911 VanDerWaalsContact CG-O 3.27Å; Q1892-T1911 WeakPolarHBondContact CG-O 3.39Å
1893	L	91.5	Very high	87.1	Confident	20.2 Å²	20.2	47.9 Å²	47.9	11%	0.106	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	136.8	174.7	-179.3	65.9	0	0	0	110.9	P1835 I1890 L1895 N1910 T1911 I1914	P1835-L1893 HydrophobicContact CB-CD1 4.16Å; P1835-L1893 HydrophobicContact CG-CD1 4.43Å; I1890-L1893 HydrophobicContact CD1-CD2 4.45Å; I1890-L1893 HydrophobicContact CG2-CB 4.33Å; L1893-L1895 HydrophobicContact CD1-CD2 4.49Å; L1893-L1895 HydrophobicContact CD2-CD1 4.48Å; L1893-L1895 HydrophobicContact CD2-CD2 3.34Å; L1893-L1895 HydrophobicContact CD2-CG 4.14Å; L1893-L1895 HydrophobicContact CG-CD2 3.69Å; L1893-L1895 HydrophobicContact CG-CG 4.14Å; L1893-N1910 CarbonylContact O-C 3.5Å; L1893-N1910 WeakPolarHBondContact O-CA 3.33Å; L1893-T1911 WeakPolarHBondContact CB-OG1 3.3Å; L1893-T1911 PolarHBondContact N-O 3.26Å; L1893-T1911 VanDerWaalsContact N-O 3.1Å; L1893-T1911 PolarHBondContact N-OG1 3.34Å; L1893-T1911 VanDerWaalsContact N-OG1 3.17Å; L1893-T1911 PolarHBondContact O-N 3.01Å; L1893-T1911 PolarHBondContact O-OG1 3.21Å; L1893-I1914 HydrophobicContact CB-CD1 3.63Å; L1893-I1914 HydrophobicContact CD2-CD1 3.57Å; L1893-I1914 HydrophobicContact CG-CD1 4.24Å
1894	E	91.7	Very high	86.1	Confident	43.8 Å²	43.8	49.6 Å²	49.6	21%	0.205	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	122.9	168.7	-175.4	172.1	165.8	0	0	109.7	M1831 P1835 W1836 C1837 I1896 H1908 N1910	M1831-E1894 WeakPolarHBondContact CE-OE2 3.31Å; P1835-E1894 PolarHBondContact O-N 3.17Å; P1835-E1894 VanDerWaalsContact O-N 3.16Å; W1836-E1894 CarbonylContact C-O 3.57Å; W1836-E1894 VanDerWaalsContact CA-O 3.25Å; W1836-E1894 WeakPolarHBondContact CA-O 3.28Å; W1836-E1894 HydrophobicContact CB-CB 4.02Å; W1836-E1894 HydrophobicContact CB-CG 4.5Å; C1837-E1894 PolarHBondContact N-O 3.11Å; E1894-I1896 HydrophobicContact CG-CD1 4.42Å; E1894-I1896 HydrophobicContact CG-CG1 4.26Å; E1894-I1896 WeakPolarHBondContact OE1-CD1 3.34Å; E1894-H1908 VanDerWaalsContact CD-NE2 3.28Å; E1894-H1908 VanDerWaalsContact CG-NE2 3.29Å; E1894-H1908 WeakPolarHBondContact CG-NE2 3.28Å; E1894-H1908 IonicContact OE1-CD2 3.2Å; E1894-H1908 IonicContact OE1-CE1 3.04Å; E1894-H1908 IonicContact OE1-NE2 2.99Å; E1894-H1908 PolarHBondContact OE1-NE2 3.26Å; E1894-N1910 WeakPolarHBondContact CG-OD1 3.46Å
1895	L	91.2	Very high	85.3	Confident	53.4 Å²	53.4	49.1 Å²	49.1	28%	0.28	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	118.7	-179.9	-129.8	162.7	0	0	0	109.5	C1837 F1839 L1893 H1908 V1909 T1911	C1837-L1895 HydrophobicContact CB-CG 4.45Å; C1837-L1895 WeakPolarHBondContact O-CA 3.43Å; C1837-L1895 VanDerWaalsContact SG-CB 3.6Å; C1837-L1895 WeakPolarHBondContact SG-CD2 3.47Å; C1837-L1895 VanDerWaalsContact SG-CG 3.57Å; C1837-L1895 WeakPolarHBondContact SG-CG 3.28Å; F1839-L1895 HydrophobicContact CD2-CD2 4.02Å; F1839-L1895 HydrophobicContact CD2-CG 4.32Å; F1839-L1895 HydrophobicContact CE2-CD1 4.23Å; F1839-L1895 HydrophobicContact CE2-CD2 4.29Å; F1839-L1895 HydrophobicContact CE2-CG 4.16Å; L1893-L1895 HydrophobicContact CD1-CD2 4.49Å; L1893-L1895 HydrophobicContact CD2-CD1 4.48Å; L1893-L1895 HydrophobicContact CD2-CD2 3.34Å; L1893-L1895 HydrophobicContact CD2-CG 4.14Å; L1893-L1895 HydrophobicContact CG-CD2 3.69Å; L1893-L1895 HydrophobicContact CG-CG 4.14Å; L1895-H1908 CarbonylContact O-C 3.52Å; L1895-H1908 WeakPolarHBondContact O-CA 3.44Å; L1895-V1909 HydrophobicContact CB-CB 4.22Å; L1895-V1909 HydrophobicContact CD1-CB 4.32Å; L1895-V1909 HydrophobicContact CD1-CG1 4.38Å; L1895-V1909 HydrophobicContact CD2-CB 4.45Å; L1895-V1909 HydrophobicContact CD2-CG2 4.3Å; L1895-V1909 PolarHBondContact N-O 2.98Å; L1895-V1909 PolarHBondContact O-N 3.03Å; L1895-T1911 HydrophobicContact CD1-CG2 4.14Å
1896	I	88.4	Confident	84.7	Confident	20.4 Å²	20.4	45.5 Å²	45.5	11%	0.105	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	118.5	-179.6	-53	170.5	0	0	0	108.9	C1837 S1838 F1839 E1894 W1898	C1837-I1896 PolarHBondContact O-N 2.99Å; S1838-I1896 CarbonylContact C-O 3.56Å; S1838-I1896 VanDerWaalsContact CA-O 3.31Å; S1838-I1896 WeakPolarHBondContact CA-O 3.33Å; F1839-I1896 PolarHBondContact N-O 3.07Å; E1894-I1896 HydrophobicContact CG-CD1 4.42Å; E1894-I1896 HydrophobicContact CG-CG1 4.26Å; E1894-I1896 WeakPolarHBondContact OE1-CD1 3.34Å; I1896-W1898 HydrophobicContact CG2-CD2 4.2Å; I1896-W1898 VanDerWaalsContact CG2-CE2 3.44Å; I1896-W1898 HydrophobicContact CG2-CG 4.33Å; I1896-W1898 HydrophobicContact CG2-CZ2 3.95Å; I1896-W1898 VanDerWaalsContact CG2-NE1 3.27Å
1897	F	87.8	Confident	84.2	Confident	72.6 Å²	72.6	44.9 Å²	44.9	32%	0.318	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	122.4	172.9	174	-98.6	0	0	0	110.7	F1839 T1841 V1899 G1906 V1907	F1839-F1897 HydrophobicContact CB-CD2 3.98Å; F1839-F1897 CarbonylContact O-C 3.54Å; F1839-F1897 WeakPolarHBondContact O-CA 3.36Å; T1841-F1897 HydrophobicContact CG2-CE2 4.21Å; T1841-F1897 HydrophobicContact CG2-CZ 3.76Å; F1897-V1899 HydrophobicContact CE1-CG2 4.26Å; F1897-G1906 CarbonylContact O-C 3.54Å; F1897-G1906 WeakPolarHBondContact O-CA 3.35Å; F1897-V1907 HydrophobicContact CD1-CG2 4.43Å; F1897-V1907 PolarHBondContact N-O 3.24Å; F1897-V1907 PolarHBondContact O-N 3.23Å
1898	W	82.9	Confident	83.9	Confident	17.8 Å²	17.8	44 Å²	44	7%	0.067	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	133.7	174.5	-64.6	115.7	0	0	0	111.5	F1839 Y1840 T1841 I1896 S1900 K1903 R1904 R2016	F1839-W1898 PolarHBondContact O-N 3.13Å; Y1840-W1898 WeakPolarHBondContact CA-O 3.31Å; Y1840-W1898 HydrophobicContact CD1-CB 3.74Å; Y1840-W1898 HydrophobicContact CD1-CG 4.4Å; Y1840-W1898 HydrophobicContact CE1-CB 3.85Å; Y1840-W1898 AromaticContact CE1-CD1 3.71Å; Y1840-W1898 AromaticContact CE1-CG 3.97Å; Y1840-W1898 HydrophobicContact CE1-CG 4.1Å; Y1840-W1898 AromaticContact CZ-CD1 3.96Å; T1841-W1898 PolarHBondContact N-O 3.03Å; I1896-W1898 HydrophobicContact CG2-CD2 4.2Å; I1896-W1898 VanDerWaalsContact CG2-CE2 3.44Å; I1896-W1898 HydrophobicContact CG2-CG 4.33Å; I1896-W1898 HydrophobicContact CG2-CZ2 3.95Å; I1896-W1898 VanDerWaalsContact CG2-NE1 3.27Å; W1898-S1900 VanDerWaalsContact C-N 3.27Å; W1898-S1900 WeakPolarHBondContact CB-O 3.47Å; W1898-S1900 PolarHBondContact O-N 3.08Å; W1898-K1903 HydrophobicContact CD2-CB 3.91Å; W1898-K1903 HydrophobicContact CD2-CD 4.46Å; W1898-K1903 HydrophobicContact CD2-CG 3.94Å; W1898-K1903 HydrophobicContact CE3-CB 3.95Å; W1898-K1903 HydrophobicContact CE3-CG 4.32Å; W1898-K1903 HydrophobicContact CG-CB 4.49Å; W1898-K1903 HydrophobicContact CG-CG 4.1Å; W1898-K1903 HydrophobicContact CH2-CB 4.24Å; W1898-K1903 HydrophobicContact CZ2-CB 4.19Å; W1898-K1903 HydrophobicContact CZ2-CD 4.24Å; W1898-K1903 HydrophobicContact CZ2-CG 4.39Å; W1898-K1903 HydrophobicContact CZ3-CB 4.13Å; W1898-K1903 WeakPolarHBondContact CZ3-O 3.37Å; W1898-R1904 HydrophobicContact CD2-CB 4.15Å; W1898-R1904 HydrophobicContact CD2-CG 4.32Å; W1898-R1904 VanDerWaalsContact CE3-CA 3.46Å; W1898-R1904 HydrophobicContact CE3-CB 3.95Å; W1898-R1904 HydrophobicContact CE3-CG 4.48Å; W1898-R1904 HydrophobicContact CH2-CB 4.22Å; W1898-R1904 HydrophobicContact CZ2-CB 4.42Å; W1898-R1904 HydrophobicContact CZ3-CB 3.94Å; W1898-R1904 WeakPolarHBondContact CZ3-O 3.45Å; W1898-R2016 HydrophobicContact CH2-CB 3.92Å; W1898-R2016 HydrophobicContact CZ3-CB 4.12Å
1899	V	79.5	Confident	83.6	Confident	46 Å²	46	43.1 Å²	43.1	28%	0.279	23%	0.226	S	C	.	.	S	Bend	trans	-61.3	-36.5	176.1	175.3	0	0	0	0	111.2	T1841 F1897 T1905 L2249	T1841-V1899 VanDerWaalsContact CB-O 3.26Å; T1841-V1899 WeakPolarHBondContact CB-O 3.42Å; T1841-V1899 HydrophobicContact CG2-CG1 4.48Å; T1841-V1899 WeakPolarHBondContact CG2-O 3.41Å; T1841-V1899 WeakPolarHBondContact OG1-CA 3.28Å; T1841-V1899 PolarHBondContact OG1-O 2.99Å; F1897-V1899 HydrophobicContact CE1-CG2 4.26Å; V1899-T1905 WeakPolarHBondContact CB-O 3.12Å; V1899-T1905 WeakPolarHBondContact CG2-O 3.37Å; V1899-T1905 WeakPolarHBondContact CG2-OG1 3.27Å; V1899-T1905 PolarHBondContact N-O 3.09Å; V1899-T1905 VanDerWaalsContact N-O 3.12Å; V1899-L2249 HydrophobicContact CG2-CD2 3.46Å; V1899-L2249 VanDerWaalsContact CG2-CD2 3.45Å
1900	S	72.2	Confident	83.4	Confident	42.6 Å²	42.6	43.1 Å²	43.1	30%	0.298	23%	0.226	S	C	.	.			trans	-151.7	156.1	175.9	138	0	0	0	0	110.7	W1898 A1902 K1903 R1904	W1898-S1900 VanDerWaalsContact C-N 3.27Å; W1898-S1900 WeakPolarHBondContact CB-O 3.47Å; W1898-S1900 PolarHBondContact O-N 3.08Å; S1900-A1902 PolarHBondContact O-N 2.94Å; S1900-A1902 PolarHBondContact OG-N 3.18Å; S1900-K1903 PolarHBondContact N-O 2.94Å; S1900-K1903 CarbonylContact O-C 3.58Å; S1900-K1903 VanDerWaalsContact O-C 3.29Å; S1900-K1903 PolarHBondContact O-N 3.15Å; S1900-K1903 VanDerWaalsContact O-N 3.13Å; S1900-R1904 PolarHBondContact O-N 2.94Å; S1900-R1904 VanDerWaalsContact O-N 3.13Å
1901	Y	67	Low	83.3	Confident	69.8 Å²	69.8	42.6 Å²	42.6	27%	0.274	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-28.6	173.5	-170.4	-97	0	0	0	113	Y1754 D1755 Y1840 K1903 R1904 P2024 I2026 Q2027	Y1754-Y1901 AromaticContact CD1-CD1 3.75Å; Y1754-Y1901 HydrophobicContact CD1-CD1 3.75Å; Y1754-Y1901 AromaticContact CD1-CD2 3.93Å; Y1754-Y1901 HydrophobicContact CD1-CD2 3.93Å; Y1754-Y1901 HydrophobicContact CD1-CE1 4.48Å; Y1754-Y1901 HydrophobicContact CD1-CE2 4.37Å; Y1754-Y1901 AromaticContact CD1-CG 3.83Å; Y1754-Y1901 HydrophobicContact CD1-CG 4.04Å; Y1754-Y1901 HydrophobicContact CE1-CD1 4.14Å; Y1754-Y1901 AromaticContact CE1-CD2 3.9Å; Y1754-Y1901 HydrophobicContact CE1-CD2 3.9Å; Y1754-Y1901 HydrophobicContact CE1-CG 4.18Å; Y1754-Y1901 HydrophobicContact CG-CD1 4.21Å; Y1754-Y1901 HydrophobicContact CG-CG 4.32Å; D1755-Y1901 PolarHBondContact OD2-OH 2.91Å; Y1840-Y1901 HydrophobicContact CD1-CD2 4.32Å; Y1840-Y1901 AromaticContact CE1-CD2 3.9Å; Y1840-Y1901 HydrophobicContact CE1-CD2 4.02Å; Y1840-Y1901 HydrophobicContact CE2-CD2 4.46Å; Y1901-K1903 VanDerWaalsContact C-N 3.29Å; Y1901-K1903 PolarHBondContact O-N 3.38Å; Y1901-K1903 VanDerWaalsContact O-N 3.14Å; Y1901-R1904 WeakPolarHBondContact O-CG 3.36Å; Y1901-P2024 HydrophobicContact CD1-CB 3.93Å; Y1901-P2024 HydrophobicContact CD1-CG 3.68Å; Y1901-P2024 HydrophobicContact CE1-CB 4.13Å; Y1901-P2024 HydrophobicContact CE1-CG 4.27Å; Y1901-I2026 WeakPolarHBondContact OH-CG2 3.42Å; Y1901-Q2027 PolarHBondContact OH-NE2 2.83Å; Y1901-Q2027 PolarHBondContact OH-OE1 3.14Å
1902	A	66.1	Low	83.3	Confident	53.6 Å²	53.6	40.4 Å²	40.4	44%	0.443	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-17.1	179.3	0	0	0	0	0	114.3	S1900 R1904 P2024	S1900-A1902 PolarHBondContact O-N 2.94Å; S1900-A1902 PolarHBondContact OG-N 3.18Å; A1902-R1904 HydrophobicContact CB-CG 4.23Å; A1902-R1904 PolarHBondContact O-N 3.3Å; A1902-P2024 HydrophobicContact CB-CG 4.35Å
1903	K	68.6	Low	83.4	Confident	119 Å²	119	40.1 Å²	40.1	52%	0.517	22%	0.216	S	C	.	.			trans	-67.5	46.8	178.1	-64.5	-171.3	178.2	-174.3	0	111.6	W1898 S1900 Y1901 T1905 L2021	W1898-K1903 HydrophobicContact CD2-CB 3.91Å; W1898-K1903 HydrophobicContact CD2-CD 4.46Å; W1898-K1903 HydrophobicContact CD2-CG 3.94Å; W1898-K1903 HydrophobicContact CE3-CB 3.95Å; W1898-K1903 HydrophobicContact CE3-CG 4.32Å; W1898-K1903 HydrophobicContact CG-CB 4.49Å; W1898-K1903 HydrophobicContact CG-CG 4.1Å; W1898-K1903 HydrophobicContact CH2-CB 4.24Å; W1898-K1903 HydrophobicContact CZ2-CB 4.19Å; W1898-K1903 HydrophobicContact CZ2-CD 4.24Å; W1898-K1903 HydrophobicContact CZ2-CG 4.39Å; W1898-K1903 HydrophobicContact CZ3-CB 4.13Å; W1898-K1903 WeakPolarHBondContact CZ3-O 3.37Å; S1900-K1903 PolarHBondContact N-O 2.94Å; S1900-K1903 CarbonylContact O-C 3.58Å; S1900-K1903 VanDerWaalsContact O-C 3.29Å; S1900-K1903 PolarHBondContact O-N 3.15Å; S1900-K1903 VanDerWaalsContact O-N 3.13Å; Y1901-K1903 VanDerWaalsContact C-N 3.29Å; Y1901-K1903 PolarHBondContact O-N 3.38Å; Y1901-K1903 VanDerWaalsContact O-N 3.14Å; K1903-T1905 HydrophobicContact CB-CG2 4.31Å; K1903-T1905 WeakPolarHBondContact O-CG2 3.44Å; K1903-T1905 PolarHBondContact O-N 3Å; K1903-L2021 HydrophobicContact CB-CD2 4.42Å
1904	R	71.3	Confident	83.6	Confident	57 Å²	57	39.7 Å²	39.7	22%	0.215	21%	0.214	C	C	.	.	S	Bend	trans	-63.1	22.1	-179.2	-69.6	-169.6	-177.4	-175	-1.6	111.9	W1898 S1900 Y1901 A1902 H2017 R2018 L2021 E2060	W1898-R1904 HydrophobicContact CD2-CB 4.15Å; W1898-R1904 HydrophobicContact CD2-CG 4.32Å; W1898-R1904 VanDerWaalsContact CE3-CA 3.46Å; W1898-R1904 HydrophobicContact CE3-CB 3.95Å; W1898-R1904 HydrophobicContact CE3-CG 4.48Å; W1898-R1904 HydrophobicContact CH2-CB 4.22Å; W1898-R1904 HydrophobicContact CZ2-CB 4.42Å; W1898-R1904 HydrophobicContact CZ3-CB 3.94Å; W1898-R1904 WeakPolarHBondContact CZ3-O 3.45Å; S1900-R1904 PolarHBondContact O-N 2.94Å; S1900-R1904 VanDerWaalsContact O-N 3.13Å; Y1901-R1904 WeakPolarHBondContact O-CG 3.36Å; A1902-R1904 HydrophobicContact CB-CG 4.23Å; A1902-R1904 PolarHBondContact O-N 3.3Å; R1904-H2017 CarbonylContact O-C 3.57Å; R1904-H2017 WeakPolarHBondContact O-CA 3.35Å; R1904-H2017 PolarHBondContact O-ND1 2.89Å; R1904-R2018 HydrophobicContact CB-CB 4.03Å; R1904-R2018 WeakPolarHBondContact CG-O 3.23Å; R1904-R2018 PolarHBondContact O-N 3.12Å; R1904-L2021 HydrophobicContact CG-CB 4.28Å; R1904-L2021 PolarHBondContact NE-O 2.97Å; R1904-L2021 PolarHBondContact NH2-O 3.45Å; R1904-E2060 IonicContact CZ-OE1 2.86Å; R1904-E2060 IonicContact NH1-OE1 3.78Å; R1904-E2060 PolarHBondContact NH1-OE1 3.07Å; R1904-E2060 IonicContact NH2-OE1 3.39Å; R1904-E2060 PolarHBondContact NH2-OE1 3.18Å
1905	T	78.1	Confident	83.7	Confident	24.2 Å²	24.2	41.2 Å²	41.2	15%	0.148	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	127.4	175.8	55.6	0	0	0	0	107.8	V1899 K1903 R2016 H2017 I2248	V1899-T1905 WeakPolarHBondContact CB-O 3.12Å; V1899-T1905 WeakPolarHBondContact CG2-O 3.37Å; V1899-T1905 WeakPolarHBondContact CG2-OG1 3.27Å; V1899-T1905 PolarHBondContact N-O 3.09Å; V1899-T1905 VanDerWaalsContact N-O 3.12Å; K1903-T1905 HydrophobicContact CB-CG2 4.31Å; K1903-T1905 WeakPolarHBondContact O-CG2 3.44Å; K1903-T1905 PolarHBondContact O-N 3Å; T1905-R2016 WeakPolarHBondContact CA-O 3.46Å; T1905-H2017 VanDerWaalsContact CG2-CE1 3.44Å; T1905-H2017 WeakPolarHBondContact CG2-CE1 3.43Å; T1905-H2017 VanDerWaalsContact CG2-ND1 3.26Å; T1905-H2017 WeakPolarHBondContact CG2-ND1 3.37Å; T1905-I2248 HydrophobicContact CG2-CG2 4.08Å
1906	G	83.8	Confident	84	Confident	5.4 Å²	5.4	41 Å²	41	6%	0.056	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.7	-175.8	-168.9	0	0	0	0	0	114.4	F1897 R2016	F1897-G1906 CarbonylContact O-C 3.54Å; F1897-G1906 WeakPolarHBondContact O-CA 3.35Å; G1906-R2016 PolarHBondContact N-O 2.97Å; G1906-R2016 PolarHBondContact O-N 3.31Å; G1906-R2016 VanDerWaalsContact O-N 3.13Å
1907	V	86.4	Confident	84.3	Confident	38.4 Å²	38.4	42.3 Å²	42.3	23%	0.233	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	130.4	178.6	-173.6	0	0	0	0	107.5	F1897 V1909 I2013 L2015 L2249	F1897-V1907 HydrophobicContact CD1-CG2 4.43Å; F1897-V1907 PolarHBondContact N-O 3.24Å; F1897-V1907 PolarHBondContact O-N 3.23Å; V1907-V1909 HydrophobicContact CG1-CG2 3.84Å; V1907-I2013 HydrophobicContact CG1-CG2 3.55Å; V1907-I2013 VanDerWaalsContact CG1-CG2 3.47Å; V1907-L2015 HydrophobicContact CG1-CD2 4.28Å; V1907-L2015 HydrophobicContact CG2-CD2 4.02Å; V1907-L2249 HydrophobicContact CG2-CD1 4.05Å
1908	H	88.7	Confident	84.6	Confident	6.8 Å²	6.8	38.8 Å²	38.8	3%	0.031	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	123.4	174.5	173.5	-139.1	0	0	0	108.3	E1894 L1895 N1910 I2013 H2014 R2016	E1894-H1908 VanDerWaalsContact CD-NE2 3.28Å; E1894-H1908 VanDerWaalsContact CG-NE2 3.29Å; E1894-H1908 WeakPolarHBondContact CG-NE2 3.28Å; E1894-H1908 IonicContact OE1-CD2 3.2Å; E1894-H1908 IonicContact OE1-CE1 3.04Å; E1894-H1908 IonicContact OE1-NE2 2.99Å; E1894-H1908 PolarHBondContact OE1-NE2 3.26Å; L1895-H1908 CarbonylContact O-C 3.52Å; L1895-H1908 WeakPolarHBondContact O-CA 3.44Å; H1908-N1910 PolarHBondContact CE1-ND2 3.22Å; H1908-N1910 PolarHBondContact NE2-OD1 2.91Å; H1908-N1910 VanDerWaalsContact NE2-OD1 3.12Å; H1908-I2013 CarbonylContact O-C 3.48Å; H1908-I2013 WeakPolarHBondContact O-CA 3.34Å; H1908-H2014 HydrophobicContact CB-CB 4.34Å; H1908-H2014 PolarHBondContact N-O 3.27Å; H1908-H2014 PolarHBondContact O-N 3.05Å; H1908-R2016 HydrophobicContact CB-CG 4.31Å; H1908-R2016 VanDerWaalsContact CG-NH1 3.34Å; H1908-R2016 PolarHBondContact ND1-NE 2.87Å; H1908-R2016 PolarHBondContact ND1-NH1 3.14Å; H1908-R2016 PolarHBondContact ND1-NH2 2.98Å; H1908-R2016 VanDerWaalsContact ND1-NH2 3.12Å
1909	V	90.7	Very high	85.1	Confident	23.8 Å²	23.8	41.7 Å²	41.7	14%	0.144	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	116.5	-176	-174.7	0	0	0	0	108.9	L1895 V1907 T1911 I2011 A2012 I2013	L1895-V1909 HydrophobicContact CB-CB 4.22Å; L1895-V1909 HydrophobicContact CD1-CB 4.32Å; L1895-V1909 HydrophobicContact CD1-CG1 4.38Å; L1895-V1909 HydrophobicContact CD2-CB 4.45Å; L1895-V1909 HydrophobicContact CD2-CG2 4.3Å; L1895-V1909 PolarHBondContact N-O 2.98Å; L1895-V1909 PolarHBondContact O-N 3.03Å; V1907-V1909 HydrophobicContact CG1-CG2 3.84Å; V1909-T1911 HydrophobicContact CG1-CG2 3.93Å; V1909-I2011 HydrophobicContact CG1-CG2 3.71Å; V1909-A2012 WeakPolarHBondContact CA-O 3.46Å; V1909-I2013 HydrophobicContact CG1-CG1 4.16Å; V1909-I2013 HydrophobicContact CG2-CG1 4.17Å; V1909-I2013 HydrophobicContact CG2-CG2 4.23Å
1910	N	90.7	Very high	85.8	Confident	41.6 Å²	41.6	41.4 Å²	41.4	22%	0.222	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	137.4	165.8	-74.5	-29.4	0	0	0	108.6	L1893 E1894 H1908 I2011 A2012	L1893-N1910 CarbonylContact O-C 3.5Å; L1893-N1910 WeakPolarHBondContact O-CA 3.33Å; E1894-N1910 WeakPolarHBondContact CG-OD1 3.46Å; H1908-N1910 PolarHBondContact CE1-ND2 3.22Å; H1908-N1910 PolarHBondContact NE2-OD1 2.91Å; H1908-N1910 VanDerWaalsContact NE2-OD1 3.12Å; N1910-I2011 CarbonylContact O-C 3.53Å; N1910-I2011 VanDerWaalsContact O-CA 3.31Å; N1910-I2011 WeakPolarHBondContact O-CA 3.24Å; N1910-A2012 HydrophobicContact CB-CB 4.4Å; N1910-A2012 PolarHBondContact N-O 3.1Å; N1910-A2012 PolarHBondContact O-N 3.05Å
1911	T	92.1	Very high	86.6	Confident	8.6 Å²	8.6	41.9 Å²	41.9	5%	0.053	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	148.2	174.6	71.7	0	0	0	0	110.5	Q1892 L1893 L1895 V1909 I1914 I2008 D2010 I2011	Q1892-T1911 WeakPolarHBondContact CA-O 3.3Å; Q1892-T1911 VanDerWaalsContact CG-O 3.27Å; Q1892-T1911 WeakPolarHBondContact CG-O 3.39Å; L1893-T1911 WeakPolarHBondContact CB-OG1 3.3Å; L1893-T1911 PolarHBondContact N-O 3.26Å; L1893-T1911 VanDerWaalsContact N-O 3.1Å; L1893-T1911 PolarHBondContact N-OG1 3.34Å; L1893-T1911 VanDerWaalsContact N-OG1 3.17Å; L1893-T1911 PolarHBondContact O-N 3.01Å; L1893-T1911 PolarHBondContact O-OG1 3.21Å; L1895-T1911 HydrophobicContact CD1-CG2 4.14Å; V1909-T1911 HydrophobicContact CG1-CG2 3.93Å; T1911-I1914 HydrophobicContact CG2-CD1 4.43Å; T1911-I1914 VanDerWaalsContact OG1-CD1 3.28Å; T1911-I1914 WeakPolarHBondContact OG1-CD1 3.29Å; T1911-I1914 WeakPolarHBondContact OG1-CG1 3.47Å; T1911-I2008 HydrophobicContact CG2-CG2 3.8Å; T1911-D2010 WeakPolarHBondContact CA-O 3.41Å; T1911-I2011 HydrophobicContact CG2-CG1 4.26Å; T1911-I2011 HydrophobicContact CG2-CG2 4.43Å
1912	G	90.4	Very high	87.7	Confident	11.4 Å²	11.4	38.6 Å²	38.6	12%	0.118	21%	0.205	C	C	.	.	S	Bend	trans	-73.5	-150	159.3	0	0	0	0	0	111.8	P1891 I1914 H2009 D2010	P1891-G1912 CarbonylContact O-C 3.52Å; P1891-G1912 VanDerWaalsContact O-C 3.26Å; G1912-I1914 PolarHBondContact O-N 3.11Å; G1912-H2009 WeakPolarHBondContact CA-O 3.29Å; G1912-H2009 PolarHBondContact N-O 3.02Å; G1912-D2010 PolarHBondContact N-O 3.21Å
1913	P	92.9	Very high	88.6	Confident	65.6 Å²	65.6	41.5 Å²	41.5	43%	0.426	21%	0.207	S	C	.	.			trans	-54.6	130.6	-178.2	-29.6	35.3	0	0	0	113.9	I1890 P1891 H2009	I1890-P1913 CarbonylContact O-C 3.56Å; I1890-P1913 WeakPolarHBondContact O-CA 3.37Å; P1891-P1913 VanDerWaalsContact O-CA 3.25Å; P1891-P1913 WeakPolarHBondContact O-CA 3.35Å; P1891-P1913 WeakPolarHBondContact O-CD 3.31Å; P1891-P1913 VanDerWaalsContact O-N 3.13Å; P1913-H2009 HydrophobicContact CB-CB 4.46Å; P1913-H2009 PolarHBondContact O-CD2 2.87Å; P1913-H2009 PolarHBondContact O-N 2.96Å
1914	I	94.2	Very high	89.3	Confident	12.4 Å²	12.4	36.2 Å²	36.2	6%	0.064	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	128.1	172.6	-63.2	174.7	0	0	0	108.8	N1889 I1890 L1893 T1911 G1912 I1916 S2007 I2008	N1889-I1914 WeakPolarHBondContact CA-O 3.29Å; I1890-I1914 HydrophobicContact CB-CB 4.38Å; I1890-I1914 PolarHBondContact N-O 3.16Å; I1890-I1914 PolarHBondContact O-N 3.05Å; L1893-I1914 HydrophobicContact CB-CD1 3.63Å; L1893-I1914 HydrophobicContact CD2-CD1 3.57Å; L1893-I1914 HydrophobicContact CG-CD1 4.24Å; T1911-I1914 HydrophobicContact CG2-CD1 4.43Å; T1911-I1914 VanDerWaalsContact OG1-CD1 3.28Å; T1911-I1914 WeakPolarHBondContact OG1-CD1 3.29Å; T1911-I1914 WeakPolarHBondContact OG1-CG1 3.47Å; G1912-I1914 PolarHBondContact O-N 3.11Å; I1914-I1916 HydrophobicContact CG2-CD1 3.99Å; I1914-I1916 HydrophobicContact CG2-CG1 3.85Å; I1914-S2007 WeakPolarHBondContact CA-O 3.39Å; I1914-I2008 HydrophobicContact CG1-CG1 4.28Å; I1914-I2008 HydrophobicContact CG1-CG2 4.04Å; I1914-I2008 HydrophobicContact CG2-CG1 4.4Å
1915	Q	95.3	Very high	89.8	Confident	75.4 Å²	75.4	35.6 Å²	35.6	35%	0.352	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	124.1	166.3	175.5	169	69.1	0	0	109.6	I1888 N1889 I1917 Y2005 A2006 S2007	I1888-Q1915 CarbonylContact O-C 3.54Å; I1888-Q1915 WeakPolarHBondContact O-CA 3.32Å; N1889-Q1915 WeakPolarHBondContact OD1-CG 3.39Å; N1889-Q1915 PolarHBondContact OD1-NE2 3.12Å; N1889-Q1915 VanDerWaalsContact OD1-NE2 3.09Å; Q1915-I1917 HydrophobicContact CG-CD1 4.12Å; Q1915-I1917 HydrophobicContact CG-CG1 4.1Å; Q1915-Y2005 HydrophobicContact CG-CE1 4.25Å; Q1915-A2006 CarbonylContact O-C 3.54Å; Q1915-A2006 VanDerWaalsContact O-CA 3.27Å; Q1915-A2006 WeakPolarHBondContact O-CA 3.37Å; Q1915-S2007 PolarHBondContact N-O 3.11Å; Q1915-S2007 PolarHBondContact O-N 3.09Å
1916	I	96.1	Very high	90	Very high	47.8 Å²	47.8	39.6 Å²	39.6	25%	0.245	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	129	174.3	-55.9	169.3	0	0	0	108.1	F1886 S1887 I1888 I1914 L2004 Y2005 A2006	F1886-I1916 HydrophobicContact CE2-CG2 4.09Å; S1887-I1916 CarbonylContact C-O 3.56Å; S1887-I1916 VanDerWaalsContact CA-O 3.27Å; S1887-I1916 WeakPolarHBondContact CA-O 3.39Å; I1888-I1916 HydrophobicContact CB-CB 4.26Å; I1888-I1916 HydrophobicContact CD1-CD1 4.46Å; I1888-I1916 PolarHBondContact N-O 3.11Å; I1888-I1916 PolarHBondContact O-N 3.14Å; I1914-I1916 HydrophobicContact CG2-CD1 3.99Å; I1914-I1916 HydrophobicContact CG2-CG1 3.85Å; I1916-L2004 HydrophobicContact CG2-CD1 4.15Å; I1916-Y2005 CarbonylContact C-O 3.54Å; I1916-Y2005 WeakPolarHBondContact CA-O 3.36Å; I1916-A2006 HydrophobicContact CG1-CB 4.06Å; I1916-A2006 HydrophobicContact CG2-CB 4.45Å
1917	I	95.9	Very high	90	Very high	47.8 Å²	47.8	40.9 Å²	40.9	25%	0.245	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	118.3	178.4	-57.3	172.8	0	0	0	108.6	F1886 Q1915 L2004 Y2005	F1886-I1917 CarbonylContact O-C 3.51Å; F1886-I1917 WeakPolarHBondContact O-CA 3.28Å; Q1915-I1917 HydrophobicContact CG-CD1 4.12Å; Q1915-I1917 HydrophobicContact CG-CG1 4.1Å; I1917-L2004 CarbonylContact O-C 3.57Å; I1917-L2004 WeakPolarHBondContact O-CA 3.34Å; I1917-Y2005 HydrophobicContact CD1-CD1 4.39Å; I1917-Y2005 PolarHBondContact N-O 3.03Å; I1917-Y2005 PolarHBondContact O-N 3.13Å
1918	G	94.4	Very high	89.9	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	132.1	177.9	0	0	0	0	0	112	E1885 F1886	E1885-G1918 CarbonylContact C-O 3.54Å; E1885-G1918 VanDerWaalsContact CA-O 3.28Å; E1885-G1918 WeakPolarHBondContact CA-O 3.42Å; F1886-G1918 WeakPolarHBondContact CD1-O 3.15Å; F1886-G1918 PolarHBondContact N-O 2.96Å; F1886-G1918 PolarHBondContact O-N 2.9Å
1919	K	93.1	Very high	89.8	Confident	78 Å²	78	49.5 Å²	49.5	34%	0.339	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	111.7	174.2	-97.6	-174.3	-172.1	-165.9	0	109.4	E1885 L2002 N2003	E1885-K1919 HydrophobicContact CB-CG 4.43Å; E1885-K1919 HydrophobicContact CG-CB 4.43Å; E1885-K1919 HydrophobicContact CG-CD 4.42Å; E1885-K1919 HydrophobicContact CG-CG 4.09Å; E1885-K1919 WeakPolarHBondContact OE1-CD 3.36Å; E1885-K1919 VanDerWaalsContact OE1-CE 3.25Å; E1885-K1919 WeakPolarHBondContact OE1-CE 3.42Å; E1885-K1919 IonicContact OE1-NZ 2.98Å; E1885-K1919 PolarHBondContact OE1-NZ 3.19Å; E1885-K1919 WeakPolarHBondContact OE2-CD 3Å; E1885-K1919 VanDerWaalsContact OE2-CE 3.25Å; E1885-K1919 WeakPolarHBondContact OE2-CE 3.37Å; E1885-K1919 IonicContact OE2-NZ 3.07Å; E1885-K1919 PolarHBondContact OE2-NZ 3.1Å; K1919-L2002 HydrophobicContact CB-CB 4.46Å; K1919-L2002 HydrophobicContact CD-CD1 4.47Å; K1919-L2002 HydrophobicContact CG-CB 4.48Å; K1919-L2002 HydrophobicContact CG-CD1 4.31Å; K1919-L2002 WeakPolarHBondContact O-CA 3.47Å; K1919-L2002 WeakPolarHBondContact O-CB 3.43Å; K1919-L2002 PolarHBondContact O-N 3.09Å; K1919-N2003 HydrophobicContact CB-CB 4.33Å; K1919-N2003 PolarHBondContact N-O 3.18Å; K1919-N2003 PolarHBondContact O-N 2.97Å
1920	L	92.9	Very high	89.4	Confident	41.2 Å²	41.2	52 Å²	52	22%	0.216	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	142	-178.6	-54.3	177.2	0	0	0	109.9	S1883 L1884 F1886 W1999 C2000 V2001	S1883-L1920 CarbonylContact C-O 3.5Å; S1883-L1920 VanDerWaalsContact CA-O 3.28Å; S1883-L1920 WeakPolarHBondContact CA-O 3.32Å; S1883-L1920 WeakPolarHBondContact CB-O 3.23Å; L1884-L1920 HydrophobicContact CB-CB 4.31Å; L1884-L1920 HydrophobicContact CD2-CD1 4.21Å; L1884-L1920 HydrophobicContact CG-CD1 4.43Å; L1884-L1920 PolarHBondContact N-O 3.12Å; L1884-L1920 WeakPolarHBondContact O-CB 3.44Å; L1884-L1920 PolarHBondContact O-N 3.05Å; F1886-L1920 HydrophobicContact CE1-CD1 4.24Å; F1886-L1920 HydrophobicContact CE1-CG 4.4Å; L1920-W1999 HydrophobicContact CB-CE3 4.12Å; L1920-W1999 HydrophobicContact CB-CZ3 4.22Å; L1920-C2000 WeakPolarHBondContact CA-O 3.31Å; L1920-V2001 HydrophobicContact CD2-CB 4.12Å; L1920-V2001 HydrophobicContact CD2-CG1 4.16Å; L1920-V2001 HydrophobicContact CD2-CG2 3.71Å
1921	K	90.3	Very high	89	Confident	51.2 Å²	51.2	55.8 Å²	55.8	22%	0.223	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	133.1	173.4	179	172	-178.2	173.9	0	110.6	Q1882 K1923 Y1977 W1999 C2000 L2002	Q1882-K1921 CarbonylContact O-C 3.52Å; Q1882-K1921 WeakPolarHBondContact O-CA 3.36Å; Q1882-K1921 WeakPolarHBondContact O-CG 3.48Å; K1921-K1923 HydrophobicContact CG-CG 4.45Å; K1921-Y1977 PolarHBondContact NZ-OH 3.1Å; K1921-Y1977 VanDerWaalsContact NZ-OH 3.09Å; K1921-W1999 WeakPolarHBondContact O-CA 3.31Å; K1921-C2000 PolarHBondContact N-O 2.98Å; K1921-C2000 PolarHBondContact O-N 3.18Å; K1921-C2000 PolarHBondContact O-SG 3.1Å; K1921-C2000 VanDerWaalsContact O-SG 3.34Å; K1921-L2002 HydrophobicContact CB-CD1 3.72Å; K1921-L2002 HydrophobicContact CB-CD2 4.09Å; K1921-L2002 HydrophobicContact CB-CG 3.77Å; K1921-L2002 HydrophobicContact CD-CD1 4.19Å; K1921-L2002 HydrophobicContact CD-CD2 4.27Å; K1921-L2002 HydrophobicContact CG-CD1 4.46Å
1922	C	88.9	Confident	88.2	Confident	0.8 Å²	0.8	57.1 Å²	57.1	1%	0.005	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	118.9	173.8	176.1	0	0	0	0	109	R1812 L1881 Q1882 V1997 N1998 W1999	R1812-C1922 PolarHBondContact NH2-O 3.06Å; L1881-C1922 VanDerWaalsContact O-CB 3.31Å; L1881-C1922 WeakPolarHBondContact O-CB 3.41Å; L1881-C1922 PolarHBondContact O-SG 2.98Å; Q1882-C1922 PolarHBondContact O-N 3.21Å; C1922-V1997 VanDerWaalsContact SG-CG1 3.53Å; C1922-V1997 WeakPolarHBondContact SG-CG1 3.4Å; C1922-N1998 CarbonylContact C-O 3.49Å; C1922-N1998 WeakPolarHBondContact CA-O 3.34Å; C1922-W1999 HydrophobicContact CB-CD2 3.97Å; C1922-W1999 HydrophobicContact CB-CE3 3.83Å; C1922-W1999 HydrophobicContact CB-CH2 3.79Å; C1922-W1999 HydrophobicContact CB-CZ2 3.9Å; C1922-W1999 HydrophobicContact CB-CZ3 3.75Å
1923	K	85.3	Confident	87.3	Confident	115.6 Å²	115.6	62.3 Å²	62.3	50%	0.503	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	130.7	173	-104.3	178.9	-177.3	179.7	0	109.2	K1921 N1998	K1921-K1923 HydrophobicContact CG-CG 4.45Å; K1923-N1998 PolarHBondContact N-O 2.99Å; K1923-N1998 PolarHBondContact O-N 2.95Å
1924	I	84.7	Confident	85.9	Confident	6.6 Å²	6.6	62.7 Å²	62.7	3%	0.034	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	142.1	170.8	-54.4	-173.7	0	0	0	108.7	R1812 R1879 N1926 E1927 P1981 P1995 I1996 V1997	R1812-I1924 VanDerWaalsContact NH1-CD1 3.3Å; R1879-I1924 HydrophobicContact CB-CD1 4.27Å; R1879-I1924 HydrophobicContact CG-CD1 4.5Å; R1879-I1924 WeakPolarHBondContact O-CD1 3.34Å; I1924-N1926 PolarHBondContact O-N 3Å; I1924-E1927 WeakPolarHBondContact CA-OE1 3.46Å; I1924-E1927 HydrophobicContact CB-CG 4.05Å; I1924-E1927 WeakPolarHBondContact CB-OE1 3.4Å; I1924-E1927 WeakPolarHBondContact CG1-OE1 3.47Å; I1924-E1927 VanDerWaalsContact N-CD 3.35Å; I1924-E1927 PolarHBondContact N-OE1 3.31Å; I1924-E1927 PolarHBondContact N-OE2 3.25Å; I1924-E1927 WeakPolarHBondContact O-CB 3.34Å; I1924-E1927 VanDerWaalsContact O-CG 3.24Å; I1924-E1927 WeakPolarHBondContact O-CG 3.33Å; I1924-E1927 PolarHBondContact O-N 2.95Å; I1924-P1981 HydrophobicContact CB-CB 4.38Å; I1924-P1981 HydrophobicContact CD1-CB 4.04Å; I1924-P1981 HydrophobicContact CD1-CG 4.22Å; I1924-P1981 HydrophobicContact CG2-CB 4.05Å; I1924-P1995 HydrophobicContact CG2-CB 3.76Å; I1924-I1996 CarbonylContact C-O 3.53Å; I1924-I1996 WeakPolarHBondContact CA-O 3.28Å; I1924-I1996 WeakPolarHBondContact CG2-O 3.32Å; I1924-V1997 HydrophobicContact CD1-CG1 4.39Å; I1924-V1997 HydrophobicContact CD1-CG2 4.05Å; I1924-V1997 HydrophobicContact CG1-CB 4.47Å; I1924-V1997 HydrophobicContact CG1-CG1 4.27Å; I1924-V1997 HydrophobicContact CG1-CG2 4.23Å; I1924-V1997 HydrophobicContact CG2-CG2 4.28Å
1925	E	81.1	Confident	83.8	Confident	45.2 Å²	45.2	64.8 Å²	64.8	21%	0.211	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	133.4	175.7	-174.5	179.7	-165.8	0	0	111.8	E1927 P1982 I1986 R1988 R1993 P1995 I1996	E1925-E1927 VanDerWaalsContact C-N 3.28Å; E1925-E1927 PolarHBondContact O-N 2.88Å; E1925-P1982 VanDerWaalsContact O-CD 3.28Å; E1925-P1982 WeakPolarHBondContact O-CD 3.23Å; E1925-P1982 WeakPolarHBondContact O-CG 3.29Å; E1925-I1986 HydrophobicContact CB-CD1 4.35Å; E1925-I1986 HydrophobicContact CG-CD1 3.83Å; E1925-R1988 IonicContact OE1-CZ 3.33Å; E1925-R1988 IonicContact OE1-NE 2.68Å; E1925-R1988 PolarHBondContact OE1-NE 3.44Å; E1925-R1988 IonicContact OE1-NH1 2.65Å; E1925-R1988 PolarHBondContact OE1-NH1 3.37Å; E1925-R1988 IonicContact OE1-NH2 2.66Å; E1925-R1988 PolarHBondContact OE1-NH2 2.97Å; E1925-R1988 IonicContact OE2-CZ 2.68Å; E1925-R1988 IonicContact OE2-NE 3.91Å; E1925-R1988 IonicContact OE2-NH2 2.95Å; E1925-R1988 PolarHBondContact OE2-NH2 3.37Å; E1925-R1993 VanDerWaalsContact CD-NH2 3.3Å; E1925-R1993 IonicContact OE1-CZ 3.01Å; E1925-R1993 IonicContact OE1-NE 2.64Å; E1925-R1993 PolarHBondContact OE1-NE 2.81Å; E1925-R1993 IonicContact OE1-NH1 2.72Å; E1925-R1993 PolarHBondContact OE1-NH1 2.84Å; E1925-R1993 IonicContact OE1-NH2 3.04Å; E1925-R1993 PolarHBondContact OE1-NH2 3.03Å; E1925-R1993 IonicContact OE2-CZ 3.31Å; E1925-R1993 IonicContact OE2-NE 2.64Å; E1925-R1993 PolarHBondContact OE2-NE 3.15Å; E1925-R1993 IonicContact OE2-NH1 2.96Å; E1925-R1993 PolarHBondContact OE2-NH1 2.76Å; E1925-R1993 IonicContact OE2-NH2 3.34Å; E1925-R1993 PolarHBondContact OE2-NH2 3.32Å; E1925-P1995 HydrophobicContact CB-CB 4.11Å; E1925-I1996 HydrophobicContact CB-CB 4.33Å; E1925-I1996 PolarHBondContact N-O 3.21Å; E1925-I1996 WeakPolarHBondContact OE2-CG1 3.42Å; E1925-I1996 PolarHBondContact OE2-N 3.18Å; E1925-I1996 VanDerWaalsContact OE2-N 3.12Å
1926	N	81.5	Confident	81.2	Confident	108.6 Å²	108.6	71.1 Å²	71.1	58%	0.581	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	33.2	-179.8	-59	2.9	0	0	0	115.1	I1924 P1982 I1986	I1924-N1926 PolarHBondContact O-N 3Å; N1926-P1982 HydrophobicContact CB-CB 4.47Å; N1926-P1982 HydrophobicContact CB-CG 4.25Å; N1926-P1982 WeakPolarHBondContact O-CD 3.41Å; N1926-I1986 HydrophobicContact CB-CD1 4.28Å
1927	E	84.2	Confident	78.2	Confident	31.2 Å²	31.2	78.4 Å²	78.4	15%	0.146	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-71.3	142.6	170.4	46.5	-179	166.1	0	0	112.6	R1812 I1924 E1925 M1979 I1980	R1812-E1927 IonicContact CZ-OE1 3.28Å; R1812-E1927 IonicContact CZ-OE2 3.27Å; R1812-E1927 IonicContact NE-OE1 3.96Å; R1812-E1927 PolarHBondContact NE-OE1 3.21Å; R1812-E1927 IonicContact NH1-OE1 3.04Å; R1812-E1927 PolarHBondContact NH1-OE1 3.01Å; R1812-E1927 IonicContact NH1-OE2 3.43Å; R1812-E1927 PolarHBondContact NH1-OE2 3.39Å; R1812-E1927 IonicContact NH2-OE1 3.61Å; R1812-E1927 PolarHBondContact NH2-OE1 2.68Å; R1812-E1927 IonicContact NH2-OE2 3.36Å; R1812-E1927 PolarHBondContact NH2-OE2 3.04Å; I1924-E1927 WeakPolarHBondContact CA-OE1 3.46Å; I1924-E1927 HydrophobicContact CB-CG 4.05Å; I1924-E1927 WeakPolarHBondContact CB-OE1 3.4Å; I1924-E1927 WeakPolarHBondContact CG1-OE1 3.47Å; I1924-E1927 VanDerWaalsContact N-CD 3.35Å; I1924-E1927 PolarHBondContact N-OE1 3.31Å; I1924-E1927 PolarHBondContact N-OE2 3.25Å; I1924-E1927 WeakPolarHBondContact O-CB 3.34Å; I1924-E1927 VanDerWaalsContact O-CG 3.24Å; I1924-E1927 WeakPolarHBondContact O-CG 3.33Å; I1924-E1927 PolarHBondContact O-N 2.95Å; E1925-E1927 VanDerWaalsContact C-N 3.28Å; E1925-E1927 PolarHBondContact O-N 2.88Å; E1927-M1979 HydrophobicContact CB-CB 4.34Å; E1927-M1979 HydrophobicContact CB-CE 4.14Å; E1927-M1979 HydrophobicContact CG-CB 4.31Å; E1927-M1979 HydrophobicContact CG-CE 3.63Å; E1927-M1979 WeakPolarHBondContact OE1-CE 3.5Å; E1927-M1979 WeakPolarHBondContact OE2-CB 3.26Å; E1927-I1980 CarbonylContact C-O 3.53Å; E1927-I1980 VanDerWaalsContact CA-O 3.28Å; E1927-I1980 WeakPolarHBondContact CA-O 3.38Å
1928	I	84.2	Confident	74.9	Confident	113 Å²	113	81 Å²	81	58%	0.579	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.1	129.2	178.9	-58.6	170.3	0	0	0	108.8	L1930 M1979 I1980	I1928-L1930 HydrophobicContact CG2-CD1 4.39Å; I1928-L1930 HydrophobicContact CG2-CG 4.31Å; I1928-M1979 CarbonylContact O-C 3.55Å; I1928-M1979 WeakPolarHBondContact O-CA 3.37Å; I1928-I1980 PolarHBondContact N-O 3.18Å; I1928-I1980 PolarHBondContact O-N 3.05Å
1929	K	86.5	Confident	71.6	Confident	114.4 Å²	114.4	86.3 Å²	86.3	50%	0.497	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	123.6	173.7	-172.1	-179.7	-179.1	-173.7	0	109.4	Y1977 M1979 E2163	K1929-Y1977 HydrophobicContact CD-CD2 4.28Å; K1929-Y1977 HydrophobicContact CD-CG 4.29Å; K1929-Y1977 VanDerWaalsContact CE-CD1 3.44Å; K1929-Y1977 VanDerWaalsContact CE-CG 3.48Å; K1929-Y1977 HydrophobicContact CG-CD2 3.99Å; K1929-Y1977 HydrophobicContact CG-CG 4.13Å; K1929-M1979 HydrophobicContact CB-CE 3.9Å; K1929-M1979 HydrophobicContact CB-SD 3.68Å; K1929-M1979 HydrophobicContact CD-SD 4.43Å; K1929-M1979 HydrophobicContact CG-SD 3.81Å; K1929-E2163 IonicContact NZ-OE1 2.74Å; K1929-E2163 PolarHBondContact NZ-OE1 2.64Å; K1929-E2163 IonicContact NZ-OE2 3.4Å; K1929-E2163 PolarHBondContact NZ-OE2 2.97Å
1930	L	83.4	Confident	68.3	Low	76.6 Å²	76.6	87.1 Å²	87.1	40%	0.401	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	137.7	175.8	-131.2	122	0	0	0	110.4	L1777 I1928 Y1977 V1978 I1980	L1777-L1930 HydrophobicContact CD2-CD2 3.38Å; L1777-L1930 VanDerWaalsContact CD2-CD2 3.45Å; I1928-L1930 HydrophobicContact CG2-CD1 4.39Å; I1928-L1930 HydrophobicContact CG2-CG 4.31Å; L1930-Y1977 CarbonylContact O-C 3.52Å; L1930-Y1977 VanDerWaalsContact O-CA 3.26Å; L1930-Y1977 WeakPolarHBondContact O-CA 3.36Å; L1930-Y1977 WeakPolarHBondContact O-CB 3.3Å; L1930-V1978 HydrophobicContact CB-CG1 4.33Å; L1930-V1978 PolarHBondContact N-O 3.07Å; L1930-V1978 PolarHBondContact O-N 2.99Å; L1930-I1980 HydrophobicContact CB-CD1 4.05Å; L1930-I1980 HydrophobicContact CB-CG1 4.48Å; L1930-I1980 HydrophobicContact CD1-CD1 3.85Å; L1930-I1980 HydrophobicContact CD1-CG1 4.06Å; L1930-I1980 HydrophobicContact CD2-CD1 4.08Å; L1930-I1980 HydrophobicContact CG-CD1 4.4Å
1931	N	80.9	Confident	65.1	Low	119.6 Å²	119.6	90.9 Å²	90.9	64%	0.64	50%	0.499	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.6	141.8	174.8	-66	-17	0	0	0	110.4
1932	R	76.3	Confident	61.9	Low	36.4 Å²	36.4	93.2 Å²	93.2	14%	0.137	53%	0.528	C	S	.	.			trans	-77.5	139.7	175.7	-67.1	175.1	92	-178.1	0.1	109.9	W1774 S1776 I1934 H1975 P1976 V1978	W1774-R1932 PolarHBondContact O-NH2 3.13Å; S1776-R1932 WeakPolarHBondContact O-CG 3.4Å; S1776-R1932 PolarHBondContact O-NE 2.97Å; S1776-R1932 VanDerWaalsContact O-NE 3.09Å; R1932-I1934 VanDerWaalsContact C-N 3.3Å; R1932-I1934 HydrophobicContact CB-CD1 4.03Å; R1932-I1934 HydrophobicContact CB-CG1 4.01Å; R1932-I1934 VanDerWaalsContact NE-CD1 3.35Å; R1932-I1934 PolarHBondContact O-N 3.11Å; R1932-I1934 VanDerWaalsContact O-N 3.16Å; R1932-H1975 WeakPolarHBondContact CD-O 3.41Å; R1932-H1975 PolarHBondContact NH1-O 3.24Å; R1932-H1975 VanDerWaalsContact NH1-O 3.09Å; R1932-P1976 WeakPolarHBondContact CG-O 3.37Å; R1932-P1976 PolarHBondContact N-O 3.17Å; R1932-V1978 HydrophobicContact CG-CB 4.32Å; R1932-V1978 HydrophobicContact CG-CG1 4.24Å; R1932-V1978 HydrophobicContact CG-CG2 3.58Å
1933	L	71.7	Confident	58.9	Low	120.4 Å²	120.4	98.2 Å²	98.2	63%	0.63	56%	0.562	S	S	*	*			trans	-89	65.4	177.6	-66.1	168.6	0	0	0	109.7	L1777 R1778 G1935	L1777-L1933 PolarHBondContact O-N 3.38Å; R1778-L1933 HydrophobicContact CG-CB 4.31Å; L1933-G1935 PolarHBondContact O-N 2.75Å
1934	I	62	Low	55.9	Low	74.4 Å²	74.4	98 Å²	98	38%	0.382	58%	0.576	S	S	.	*			trans	-102.6	94.9	177.4	-56.4	174.1	0	0	0	108.1	R1932 I1973 P1976	R1932-I1934 VanDerWaalsContact C-N 3.3Å; R1932-I1934 HydrophobicContact CB-CD1 4.03Å; R1932-I1934 HydrophobicContact CB-CG1 4.01Å; R1932-I1934 VanDerWaalsContact NE-CD1 3.35Å; R1932-I1934 PolarHBondContact O-N 3.11Å; R1932-I1934 VanDerWaalsContact O-N 3.16Å; I1934-I1973 HydrophobicContact CB-CD1 4.14Å; I1934-I1973 HydrophobicContact CD1-CD1 4.26Å; I1934-I1973 HydrophobicContact CD1-CG2 4.47Å; I1934-I1973 HydrophobicContact CG2-CD1 3.97Å; I1934-I1973 HydrophobicContact CG2-CG1 4.34Å; I1934-P1976 HydrophobicContact CD1-CG 4.15Å
1935	G	51	Low	53.1	Low	56 Å²	56	102.9 Å²	102.9	58%	0.577	61%	0.611	S	S	*	*			trans	-139.4	130.9	172.4	0	0	0	0	0	110.2	L1933 F1937	L1933-G1935 PolarHBondContact O-N 2.75Å; G1935-F1937 PolarHBondContact O-N 3.16Å; G1935-F1937 VanDerWaalsContact O-N 3.08Å
1936	K	40.8	Very low	50.3	Low	207.8 Å²	207.8	106.8 Å²	106.8	90%	0.903	64%	0.643	S	S	*	*			trans	-69.2	100.4	164.6	-74.8	-178.9	177.6	177	0	107.3	S1938	K1936-S1938 PolarHBondContact O-N 3.09Å; K1936-S1938 VanDerWaalsContact O-N 3.15Å
1937	F	32.9	Very low	47.6	Very low	201.4 Å²	201.4	107.4 Å²	107.4	88%	0.883	65%	0.651	S	S	*	*			trans	-68.7	103.6	165	-83.3	-82.3	0	0	0	107.8	G1935 A1939	G1935-F1937 PolarHBondContact O-N 3.16Å; G1935-F1937 VanDerWaalsContact O-N 3.08Å; F1937-A1939 PolarHBondContact O-N 3.22Å; F1937-A1939 VanDerWaalsContact O-N 3.15Å
1938	S	26.3	Very low	44.6	Very low	103.2 Å²	103.2	111.7 Å²	111.7	72%	0.722	68%	0.679	S	S	*	*			trans	-55.4	122.9	164.3	-3.2	0	0	0	0	108.2	K1936 S1940	K1936-S1938 PolarHBondContact O-N 3.09Å; K1936-S1938 VanDerWaalsContact O-N 3.15Å; S1938-S1940 VanDerWaalsContact C-N 3.31Å; S1938-S1940 PolarHBondContact O-N 3.17Å
1939	A	24.7	Very low	41.7	Very low	110.8 Å²	110.8	112.4 Å²	112.4	92%	0.916	69%	0.689	S	S	*	*	S	Bend	trans	-71.7	78.1	-175.3	0	0	0	0	0	111.9	F1937	F1937-A1939 PolarHBondContact O-N 3.22Å; F1937-A1939 VanDerWaalsContact O-N 3.15Å
1940	S	25.2	Very low	38.7	Very low	94 Å²	94	113.8 Å²	113.8	66%	0.657	70%	0.7	S	S	*	*			trans	-133.7	110.8	168.6	56.8	0	0	0	0	110.1	S1938 A1942	S1938-S1940 VanDerWaalsContact C-N 3.31Å; S1938-S1940 PolarHBondContact O-N 3.17Å; S1940-A1942 PolarHBondContact O-N 3Å
1941	S	24.9	Very low	35.8	Very low	120.8 Å²	120.8	116.7 Å²	116.7	85%	0.845	72%	0.72	S	S	*	*			trans	69.8	116.1	169.1	17.2	0	0	0	0	115.1	S1943	S1941-S1943 PolarHBondContact O-N 3.13Å
1942	A	24.3	Very low	33.1	Very low	100.4 Å²	100.4	116 Å²	116	83%	0.83	73%	0.725	S	S	*	*			trans	-123.7	122.4	153.1	0	0	0	0	0	111.1	S1940	S1940-A1942 PolarHBondContact O-N 3Å
1943	S	24.3	Very low	30.5	Very low	105.2 Å²	105.2	118 Å²	118	74%	0.736	76%	0.757	S	S	*	*			trans	-98.7	124.1	150.4	60.1	0	0	0	0	113.5	S1941	S1941-S1943 PolarHBondContact O-N 3.13Å
1944	S	23	Very low	28.2	Very low	112.4 Å²	112.4	117.5 Å²	117.5	79%	0.786	76%	0.763	S	S	*	*			trans	16.8	121.9	153.3	57.4	0	0	0	0	118.9
1945	S	26	Very low	26.2	Very low	109.6 Å²	109.6	123.4 Å²	123.4	77%	0.766	79%	0.789	S	S	*	*			trans	163.1	118.9	145.7	10.5	0	0	0	0	113.6	T1947	S1945-T1947 PolarHBondContact O-N 3.12Å; S1945-T1947 VanDerWaalsContact O-N 3.11Å; S1945-T1947 PolarHBondContact O-OG1 3.07Å
1946	S	21.9	Very low	25	Very low	126.2 Å²	126.2	126.2 Å²	126.2	88%	0.883	80%	0.801	S	S	*	*			trans	-68.9	113.5	175.4	-55	0	0	0	0	111.3	T1948	S1946-T1948 PolarHBondContact O-N 2.71Å
1947	T	24.5	Very low	24.1	Very low	122.4 Å²	122.4	122.7 Å²	122.7	75%	0.751	80%	0.796	S	S	*	*			trans	-126	120.4	161.9	-56.9	0	0	0	0	109.6	S1945 V1949	S1945-T1947 PolarHBondContact O-N 3.12Å; S1945-T1947 VanDerWaalsContact O-N 3.11Å; S1945-T1947 PolarHBondContact O-OG1 3.07Å; T1947-V1949 PolarHBondContact O-N 2.87Å
1948	T	21.6	Very low	23.8	Very low	120.2 Å²	120.2	119.1 Å²	119.1	74%	0.737	79%	0.794	S	S	*	*			trans	-68	128	174.4	43.1	0	0	0	0	111.3	S1946 I1950	S1946-T1948 PolarHBondContact O-N 2.71Å; T1948-I1950 PolarHBondContact O-N 3.09Å; T1948-I1950 VanDerWaalsContact O-N 3.1Å
1949	V	23	Very low	23.7	Very low	128.8 Å²	128.8	122.4 Å²	122.4	78%	0.781	80%	0.802	S	S	*	*			trans	-73.1	102.6	169.8	-179.1	0	0	0	0	111.2	T1947 V1951	T1947-V1949 PolarHBondContact O-N 2.87Å; V1949-V1951 HydrophobicContact CG1-CG2 4.44Å
1950	I	23.3	Very low	23.5	Very low	143 Å²	143	125.6 Å²	125.6	73%	0.733	80%	0.798	S	S	*	*			trans	-76.8	128.9	161.7	-64.4	173.2	0	0	0	109.8	T1948 S1952	T1948-I1950 PolarHBondContact O-N 3.09Å; T1948-I1950 VanDerWaalsContact O-N 3.1Å; I1950-S1952 PolarHBondContact O-N 3.18Å; I1950-S1952 VanDerWaalsContact O-N 3.16Å
1951	V	23.7	Very low	23.4	Very low	137.2 Å²	137.2	127.8 Å²	127.8	83%	0.832	81%	0.808	S	S	*	*			trans	-90	102.5	178.4	178.1	0	0	0	0	108.7	V1949	V1949-V1951 HydrophobicContact CG1-CG2 4.44Å
1952	S	23	Very low	23.4	Very low	104.4 Å²	104.4	128.1 Å²	128.1	73%	0.73	81%	0.805	S	S	*	*			trans	-124.5	127.1	162.1	50.1	0	0	0	0	109.3	I1950 S1954	I1950-S1952 PolarHBondContact O-N 3.18Å; I1950-S1952 VanDerWaalsContact O-N 3.16Å; S1952-S1954 PolarHBondContact O-N 2.85Å
1953	G	21.6	Very low	23.2	Very low	79.6 Å²	79.6	129.3 Å²	129.3	82%	0.821	80%	0.802	S	S	*	*			trans	-73.8	122.9	173.3	0	0	0	0	0	113.7
1954	S	23.9	Very low	23.2	Very low	109 Å²	109	130.3 Å²	130.3	76%	0.762	80%	0.804	S	S	*	*			trans	-139.1	133.6	153.5	55.3	0	0	0	0	111.5	S1952 S1956	S1952-S1954 PolarHBondContact O-N 2.85Å; S1954-S1956 PolarHBondContact O-N 3.11Å
1955	E	20.9	Very low	23.3	Very low	198.2 Å²	198.2	131.5 Å²	131.5	93%	0.926	81%	0.806	S	S	*	*			trans	-55.5	120.2	170.2	-65.3	169	153.3	0	0	112.6
1956	S	23.8	Very low	23.3	Very low	116.6 Å²	116.6	133.8 Å²	133.8	82%	0.815	81%	0.81	S	S	*	*			trans	-129.2	128.5	159.3	55.1	0	0	0	0	110.4	S1954	S1954-S1956 PolarHBondContact O-N 3.11Å
1957	T	22.5	Very low	23.5	Very low	132.4 Å²	132.4	135.6 Å²	135.6	81%	0.812	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-76	146.9	178.4	40.4	0	0	0	0	112.5	L1959	T1957-L1959 PolarHBondContact O-N 2.91Å
1958	P	26.1	Very low	23.6	Very low	127.2 Å²	127.2	136.9 Å²	136.9	83%	0.826	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-83.6	135.8	-173.8	27.8	-23.2	0	0	0	112
1959	L	24.4	Very low	23.9	Very low	173 Å²	173	140.1 Å²	140.1	91%	0.906	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-98	143.6	172.4	-160.1	72	0	0	0	110.5	T1957	T1957-L1959 PolarHBondContact O-N 2.91Å
1960	E	21.5	Very low	24.1	Very low	177.4 Å²	177.4	142.5 Å²	142.5	83%	0.829	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-72.6	150.8	-175.3	-63.9	177	137.4	0	0	113.7	T1962	E1960-T1962 PolarHBondContact O-N 3.19Å
1961	T	23.2	Very low	24.6	Very low	139.4 Å²	139.4	141.8 Å²	141.8	86%	0.855	82%	0.823	S	S	*	*			trans	-96	136.9	158.1	-9	0	0	0	0	112.6
1962	T	23.6	Very low	25.2	Very low	127.8 Å²	127.8	141 Å²	141	78%	0.784	82%	0.819	S	S	*	*			trans	-107.9	142.4	163.4	33.3	0	0	0	0	111.2	E1960	E1960-T1962 PolarHBondContact O-N 3.19Å
1963	T	21	Very low	26.4	Very low	125.8 Å²	125.8	140.4 Å²	140.4	77%	0.772	81%	0.807	S	S	*	*			trans	-85.2	146.6	167.3	39.7	0	0	0	0	113.5
1964	T	24.5	Very low	27.9	Very low	126.6 Å²	126.6	143.3 Å²	143.3	78%	0.777	80%	0.802	S	S	*	*			trans	158	115.7	151.8	44.8	0	0	0	0	114
1965	T	25.2	Very low	29.9	Very low	136.2 Å²	136.2	141.4 Å²	141.4	84%	0.836	78%	0.781	S	S	*	*			trans	-38.9	132.7	142.3	41.9	0	0	0	0	115.6	L1967	T1965-L1967 PolarHBondContact O-N 2.86Å
1966	N	25	Very low	32.3	Very low	157.6 Å²	157.6	135.1 Å²	135.1	84%	0.843	76%	0.757	S	S	*	*			trans	-89.1	130.6	158.4	-87.9	-42.8	0	0	0	113.3	N1968	N1966-N1968 PolarHBondContact O-N 3.01Å
1967	L	26.7	Very low	34.8	Very low	165.6 Å²	165.6	132.4 Å²	132.4	87%	0.867	73%	0.73	S	S	*	*			trans	-128.9	123.8	154.9	-89.9	157.2	0	0	0	110	T1965 E1969	T1965-L1967 PolarHBondContact O-N 2.86Å; L1967-E1969 PolarHBondContact O-N 2.95Å
1968	N	26.7	Very low	37.6	Very low	149.4 Å²	149.4	126.1 Å²	126.1	80%	0.799	69%	0.691	S	S	*	*			trans	-89.2	137.7	173.3	-76.3	-14.2	0	0	0	114.1	N1966 Q1970	N1966-N1968 PolarHBondContact O-N 3.01Å; N1968-Q1970 PolarHBondContact O-N 3.28Å; N1968-Q1970 VanDerWaalsContact O-N 3.09Å
1969	E	28	Very low	40.3	Very low	187.6 Å²	187.6	121.1 Å²	121.1	88%	0.877	66%	0.657	S	S	*	*			trans	-9.7	87.3	171	-61.1	-178.6	155.2	0	0	114.3	L1967 T1971	L1967-E1969 PolarHBondContact O-N 2.95Å; E1969-T1971 PolarHBondContact O-N 3.44Å; E1969-T1971 VanDerWaalsContact O-N 3.12Å
1970	Q	28.3	Very low	43	Very low	177.8 Å²	177.8	114.7 Å²	114.7	83%	0.831	62%	0.623	S	S	*	*			trans	-89.1	109.4	160.7	-88.8	177.3	0.7	0	0	108.9	N1968 T1972	N1968-Q1970 PolarHBondContact O-N 3.28Å; N1968-Q1970 VanDerWaalsContact O-N 3.09Å; Q1970-T1972 VanDerWaalsContact C-N 3.35Å; Q1970-T1972 PolarHBondContact O-N 3.08Å; Q1970-T1972 VanDerWaalsContact O-N 3.09Å
1971	T	33.6	Very low	45.8	Very low	128.4 Å²	128.4	108.2 Å²	108.2	79%	0.788	60%	0.597	S	S	*	*			trans	-49.7	93.1	164.3	44.4	0	0	0	0	109.9	E1969 I1973	E1969-T1971 PolarHBondContact O-N 3.44Å; E1969-T1971 VanDerWaalsContact O-N 3.12Å; T1971-I1973 PolarHBondContact O-N 3.05Å
1972	T	35.3	Very low	48.3	Very low	120 Å²	120	103.6 Å²	103.6	74%	0.736	57%	0.569	S	S	*	*			trans	-61.6	107.3	176.1	30.1	0	0	0	0	109.6	Q1970 L1974	Q1970-T1972 VanDerWaalsContact C-N 3.35Å; Q1970-T1972 PolarHBondContact O-N 3.08Å; Q1970-T1972 VanDerWaalsContact O-N 3.09Å; T1972-L1974 VanDerWaalsContact C-N 3.34Å; T1972-L1974 PolarHBondContact O-N 3.1Å
1973	I	48.6	Very low	50.4	Low	93.2 Å²	93.2	105.5 Å²	105.5	48%	0.478	56%	0.562	S	S	.	*			trans	-68.8	97.1	174.5	-57.7	172.6	0	0	0	107.5	I1934 T1971 H1975 P1976	I1934-I1973 HydrophobicContact CB-CD1 4.14Å; I1934-I1973 HydrophobicContact CD1-CD1 4.26Å; I1934-I1973 HydrophobicContact CD1-CG2 4.47Å; I1934-I1973 HydrophobicContact CG2-CD1 3.97Å; I1934-I1973 HydrophobicContact CG2-CG1 4.34Å; T1971-I1973 PolarHBondContact O-N 3.05Å; I1973-H1975 VanDerWaalsContact C-N 3.26Å; I1973-H1975 PolarHBondContact O-N 3.18Å; I1973-H1975 VanDerWaalsContact O-N 3.15Å; I1973-P1976 HydrophobicContact CG2-CB 4.45Å
1974	L	52.4	Low	52.6	Low	139.4 Å²	139.4	106.1 Å²	106.1	73%	0.73	56%	0.56	S	S	*	*	S	Bend	trans	-57.1	-19.7	-176.6	-80.6	152.2	0	0	0	112.8	T1972 P1976	T1972-L1974 VanDerWaalsContact C-N 3.34Å; T1972-L1974 PolarHBondContact O-N 3.1Å; L1974-P1976 WeakPolarHBondContact O-CD 3.47Å; L1974-P1976 VanDerWaalsContact O-N 3.1Å
1975	H	65.6	Low	54.7	Low	69.6 Å²	69.6	102.5 Å²	102.5	32%	0.322	54%	0.54	S	S	.	.			trans	-117.4	98.5	175.4	-69.8	-65.4	0	0	0	110.4	D1773 L1775 A1814 S1883 R1932 I1973 Y1977	D1773-H1975 IonicContact OD2-CD2 3.31Å; D1773-H1975 PolarHBondContact OD2-CD2 3.22Å; D1773-H1975 VanDerWaalsContact OD2-CD2 3.25Å; L1775-H1975 HydrophobicContact CD2-CB 3.7Å; A1814-H1975 WeakPolarHBondContact CB-NE2 3.38Å; S1883-H1975 PolarHBondContact OG-NE2 3.44Å; R1932-H1975 WeakPolarHBondContact CD-O 3.41Å; R1932-H1975 PolarHBondContact NH1-O 3.24Å; R1932-H1975 VanDerWaalsContact NH1-O 3.09Å; I1973-H1975 VanDerWaalsContact C-N 3.26Å; I1973-H1975 PolarHBondContact O-N 3.18Å; I1973-H1975 VanDerWaalsContact O-N 3.15Å; H1975-Y1977 VanDerWaalsContact C-N 3.27Å; H1975-Y1977 PolarHBondContact O-N 3.23Å
1976	P	72	Confident	56.8	Low	65.4 Å²	65.4	97.5 Å²	97.5	43%	0.425	51%	0.507	S	S	.	.			trans	-74.1	1	-176.5	26.6	-32.3	0	0	0	113	R1932 I1934 I1973 L1974	R1932-P1976 WeakPolarHBondContact CG-O 3.37Å; R1932-P1976 PolarHBondContact N-O 3.17Å; I1934-P1976 HydrophobicContact CD1-CG 4.15Å; I1973-P1976 HydrophobicContact CG2-CB 4.45Å; L1974-P1976 WeakPolarHBondContact O-CD 3.47Å; L1974-P1976 VanDerWaalsContact O-N 3.1Å
1977	Y	77.2	Confident	58.9	Low	60.8 Å²	60.8	97.2 Å²	97.2	24%	0.238	50%	0.501	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	153.3	177.8	62	-91.9	0	0	0	111.9	Q1882 K1921 K1929 L1930 H1975 M1979	Q1882-Y1977 PolarHBondContact NE2-O 3.33Å; K1921-Y1977 PolarHBondContact NZ-OH 3.1Å; K1921-Y1977 VanDerWaalsContact NZ-OH 3.09Å; K1929-Y1977 HydrophobicContact CD-CD2 4.28Å; K1929-Y1977 HydrophobicContact CD-CG 4.29Å; K1929-Y1977 VanDerWaalsContact CE-CD1 3.44Å; K1929-Y1977 VanDerWaalsContact CE-CG 3.48Å; K1929-Y1977 HydrophobicContact CG-CD2 3.99Å; K1929-Y1977 HydrophobicContact CG-CG 4.13Å; L1930-Y1977 CarbonylContact O-C 3.52Å; L1930-Y1977 VanDerWaalsContact O-CA 3.26Å; L1930-Y1977 WeakPolarHBondContact O-CA 3.36Å; L1930-Y1977 WeakPolarHBondContact O-CB 3.3Å; H1975-Y1977 VanDerWaalsContact C-N 3.27Å; H1975-Y1977 PolarHBondContact O-N 3.23Å; Y1977-M1979 HydrophobicContact CD2-CG 4.19Å; Y1977-M1979 HydrophobicContact CD2-SD 3.91Å; Y1977-M1979 HydrophobicContact CE2-CG 4.13Å; Y1977-M1979 HydrophobicContact CE2-SD 4.09Å
1978	V	81.4	Confident	60.8	Low	0 Å²	0	95.8 Å²	95.8	0%	0	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	133.1	175.5	103.2	0	0	0	0	109.4	L1775 S1776 L1777 N1811 R1812 L1930 R1932 I1980	L1775-V1978 HydrophobicContact CB-CB 4.31Å; L1775-V1978 HydrophobicContact CB-CG2 3.81Å; S1776-V1978 WeakPolarHBondContact O-CG2 3.26Å; L1777-V1978 HydrophobicContact CD2-CG1 4.22Å; N1811-V1978 HydrophobicContact CB-CG1 3.76Å; N1811-V1978 HydrophobicContact CB-CG2 3.92Å; R1812-V1978 HydrophobicContact CB-CG1 4.12Å; R1812-V1978 HydrophobicContact CB-CG2 3.96Å; R1812-V1978 HydrophobicContact CG-CG1 3.98Å; R1812-V1978 HydrophobicContact CG-CG2 3.94Å; L1930-V1978 HydrophobicContact CB-CG1 4.33Å; L1930-V1978 PolarHBondContact N-O 3.07Å; L1930-V1978 PolarHBondContact O-N 2.99Å; R1932-V1978 HydrophobicContact CG-CB 4.32Å; R1932-V1978 HydrophobicContact CG-CG1 4.24Å; R1932-V1978 HydrophobicContact CG-CG2 3.58Å; V1978-I1980 HydrophobicContact CG1-CD1 4.43Å; V1978-I1980 HydrophobicContact CG1-CG1 4.24Å
1979	M	82.8	Confident	63.1	Low	21.8 Å²	21.8	95.9 Å²	95.9	11%	0.107	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	113	174.4	-57.8	-54.3	-60.2	0	0	109.7	R1812 Q1882 E1927 I1928 K1929 Y1977 P1981	R1812-M1979 VanDerWaalsContact CD-O 3.27Å; R1812-M1979 WeakPolarHBondContact CD-O 3.2Å; R1812-M1979 HydrophobicContact CG-CB 4.08Å; R1812-M1979 WeakPolarHBondContact CG-O 3.39Å; R1812-M1979 PolarHBondContact NE-O 2.83Å; R1812-M1979 VanDerWaalsContact NH1-CB 3.3Å; R1812-M1979 PolarHBondContact NH1-O 3.05Å; R1812-M1979 PolarHBondContact NH2-O 2.84Å; Q1882-M1979 VanDerWaalsContact OE1-N 3.08Å; E1927-M1979 HydrophobicContact CB-CB 4.34Å; E1927-M1979 HydrophobicContact CB-CE 4.14Å; E1927-M1979 HydrophobicContact CG-CB 4.31Å; E1927-M1979 HydrophobicContact CG-CE 3.63Å; E1927-M1979 WeakPolarHBondContact OE1-CE 3.5Å; E1927-M1979 WeakPolarHBondContact OE2-CB 3.26Å; I1928-M1979 CarbonylContact O-C 3.55Å; I1928-M1979 WeakPolarHBondContact O-CA 3.37Å; K1929-M1979 HydrophobicContact CB-CE 3.9Å; K1929-M1979 HydrophobicContact CB-SD 3.68Å; K1929-M1979 HydrophobicContact CD-SD 4.43Å; K1929-M1979 HydrophobicContact CG-SD 3.81Å; Y1977-M1979 HydrophobicContact CD2-CG 4.19Å; Y1977-M1979 HydrophobicContact CD2-SD 3.91Å; Y1977-M1979 HydrophobicContact CE2-CG 4.13Å; Y1977-M1979 HydrophobicContact CE2-SD 4.09Å; M1979-P1981 WeakPolarHBondContact O-CD 3.4Å
1980	I	80.7	Confident	65.3	Low	39 Å²	39	90.5 Å²	90.5	20%	0.2	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	121.7	-178.9	-58.6	-174.7	0	0	0	109.3	L1777 N1811 E1927 I1928 L1930 V1978	L1777-I1980 HydrophobicContact CD2-CD1 4.21Å; N1811-I1980 HydrophobicContact CB-CD1 4.35Å; N1811-I1980 HydrophobicContact CB-CG1 4.39Å; E1927-I1980 CarbonylContact C-O 3.53Å; E1927-I1980 VanDerWaalsContact CA-O 3.28Å; E1927-I1980 WeakPolarHBondContact CA-O 3.38Å; I1928-I1980 PolarHBondContact N-O 3.18Å; I1928-I1980 PolarHBondContact O-N 3.05Å; L1930-I1980 HydrophobicContact CB-CD1 4.05Å; L1930-I1980 HydrophobicContact CB-CG1 4.48Å; L1930-I1980 HydrophobicContact CD1-CD1 3.85Å; L1930-I1980 HydrophobicContact CD1-CG1 4.06Å; L1930-I1980 HydrophobicContact CD2-CD1 4.08Å; L1930-I1980 HydrophobicContact CG-CD1 4.4Å; V1978-I1980 HydrophobicContact CG1-CD1 4.43Å; V1978-I1980 HydrophobicContact CG1-CG1 4.24Å
1981	P	79.2	Confident	67.3	Low	41.8 Å²	41.8	87.7 Å²	87.7	27%	0.271	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-73	154.2	177.9	30.5	-31.3	0	0	0	111.4	I1924 M1979 R1983	I1924-P1981 HydrophobicContact CB-CB 4.38Å; I1924-P1981 HydrophobicContact CD1-CB 4.04Å; I1924-P1981 HydrophobicContact CD1-CG 4.22Å; I1924-P1981 HydrophobicContact CG2-CB 4.05Å; M1979-P1981 WeakPolarHBondContact O-CD 3.4Å; P1981-R1983 PolarHBondContact O-N 3.15Å
1982	P	75.5	Confident	69.2	Low	42 Å²	42	85.4 Å²	85.4	27%	0.273	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-64.7	137.1	178.3	28	-34.5	0	0	0	110.8	E1925 N1926 L1984 I1986 P1995	E1925-P1982 VanDerWaalsContact O-CD 3.28Å; E1925-P1982 WeakPolarHBondContact O-CD 3.23Å; E1925-P1982 WeakPolarHBondContact O-CG 3.29Å; N1926-P1982 HydrophobicContact CB-CB 4.47Å; N1926-P1982 HydrophobicContact CB-CG 4.25Å; N1926-P1982 WeakPolarHBondContact O-CD 3.41Å; P1982-L1984 VanDerWaalsContact C-N 3.27Å; P1982-L1984 PolarHBondContact O-N 3.2Å; P1982-I1986 HydrophobicContact CG-CD1 4.35Å; P1982-P1995 HydrophobicContact CG-CB 4.26Å; P1982-P1995 HydrophobicContact CG-CG 3.63Å
1983	R	67.9	Low	71.2	Confident	166.6 Å²	166.6	84.6 Å²	84.6	63%	0.629	44%	0.442	S	S	*	.	S	Bend	trans	-74.2	-26.7	-177	-67.5	-177.5	176.4	-169.1	-4.7	113.3	D1803 P1981	D1803-R1983 IonicContact OD2-NH2 3.74Å; D1803-R1983 PolarHBondContact OD2-NH2 2.82Å; P1981-R1983 PolarHBondContact O-N 3.15Å
1984	L	67.7	Low	72.5	Confident	138.8 Å²	138.8	86.9 Å²	86.9	73%	0.727	45%	0.445	S	S	*	.	S	Bend	trans	-101.7	154.5	-177.6	-64.5	174	0	0	0	111.2	P1982	P1982-L1984 VanDerWaalsContact C-N 3.27Å; P1982-L1984 PolarHBondContact O-N 3.2Å
1985	S	69.2	Low	73.7	Confident	51.6 Å²	51.6	80.8 Å²	80.8	36%	0.361	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-65.5	140.7	168.2	47.5	0	0	0	0	110.6	Q1987 S1992 R1993	S1985-Q1987 PolarHBondContact O-N 3.04Å; S1985-Q1987 VanDerWaalsContact O-N 3.09Å; S1985-S1992 WeakPolarHBondContact CB-OG 3.42Å; S1985-S1992 WeakPolarHBondContact OG-CB 3.44Å; S1985-S1992 PolarHBondContact OG-OG 3.45Å; S1985-R1993 CarbonylContact C-O 3.51Å; S1985-R1993 WeakPolarHBondContact CA-O 3.33Å; S1985-R1993 VanDerWaalsContact CB-O 3.23Å; S1985-R1993 WeakPolarHBondContact CB-O 3.41Å
1986	I	69.4	Low	74.5	Confident	30.4 Å²	30.4	80.8 Å²	80.8	16%	0.156	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	126.6	176.9	-59.1	172.1	0	0	0	107.8	E1925 N1926 P1982 R1988 R1993 P1995	E1925-I1986 HydrophobicContact CB-CD1 4.35Å; E1925-I1986 HydrophobicContact CG-CD1 3.83Å; N1926-I1986 HydrophobicContact CB-CD1 4.28Å; P1982-I1986 HydrophobicContact CG-CD1 4.35Å; I1986-R1988 HydrophobicContact CG2-CG 4.36Å; I1986-R1993 HydrophobicContact CB-CG 4.13Å; I1986-R1993 PolarHBondContact N-O 3.2Å; I1986-R1993 VanDerWaalsContact N-O 3.13Å; I1986-R1993 PolarHBondContact O-N 3.11Å; I1986-P1995 HydrophobicContact CD1-CB 3.94Å; I1986-P1995 HydrophobicContact CD1-CG 4.04Å; I1986-P1995 HydrophobicContact CG1-CG 4.21Å
1987	Q	69.6	Low	75	Confident	151.4 Å²	151.4	79.6 Å²	79.6	71%	0.707	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.2	126.1	170.1	-69.1	-154.7	-4	0	0	109.3	S1985 L1991	S1985-Q1987 PolarHBondContact O-N 3.04Å; S1985-Q1987 VanDerWaalsContact O-N 3.09Å; Q1987-L1991 WeakPolarHBondContact CA-O 3.26Å; Q1987-L1991 VanDerWaalsContact OE1-C 3.27Å; Q1987-L1991 PolarHBondContact OE1-O 3.29Å
1988	R	66.3	Low	75.3	Confident	136.8 Å²	136.8	81.4 Å²	81.4	52%	0.516	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	123.9	170.6	-151.1	175.2	-174	163.4	0.7	108.2	E1925 I1986 G1990 L1991 R1993	E1925-R1988 IonicContact OE1-CZ 3.33Å; E1925-R1988 IonicContact OE1-NE 2.68Å; E1925-R1988 PolarHBondContact OE1-NE 3.44Å; E1925-R1988 IonicContact OE1-NH1 2.65Å; E1925-R1988 PolarHBondContact OE1-NH1 3.37Å; E1925-R1988 IonicContact OE1-NH2 2.66Å; E1925-R1988 PolarHBondContact OE1-NH2 2.97Å; E1925-R1988 IonicContact OE2-CZ 2.68Å; E1925-R1988 IonicContact OE2-NE 3.91Å; E1925-R1988 IonicContact OE2-NH2 2.95Å; E1925-R1988 PolarHBondContact OE2-NH2 3.37Å; I1986-R1988 HydrophobicContact CG2-CG 4.36Å; R1988-G1990 VanDerWaalsContact C-N 3.3Å; R1988-G1990 PolarHBondContact O-N 3.02Å; R1988-L1991 PolarHBondContact N-O 3.32Å; R1988-L1991 VanDerWaalsContact N-O 3.07Å; R1988-L1991 PolarHBondContact O-N 3.21Å; R1988-L1991 VanDerWaalsContact O-N 3.12Å; R1988-R1993 HydrophobicContact CB-CG 4.48Å
1989	N	73.6	Confident	75.5	Confident	151.2 Å²	151.2	87.3 Å²	87.3	81%	0.809	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	45	-178.9	-54.3	11.5	0	0	0	112.5	L1991	N1989-L1991 PolarHBondContact O-N 3.2Å; N1989-L1991 VanDerWaalsContact O-N 3.12Å
1990	G	75.6	Confident	75.7	Confident	74.4 Å²	74.4	88 Å²	88	77%	0.767	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.4	-8.6	-178.1	0	0	0	0	0	115.7	R1988	R1988-G1990 VanDerWaalsContact C-N 3.3Å; R1988-G1990 PolarHBondContact O-N 3.02Å
1991	L	70.3	Confident	76	Confident	119.8 Å²	119.8	88.3 Å²	88.3	63%	0.627	45%	0.453	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.5	128.6	178.9	-65.9	172	0	0	0	111.1	Q1987 R1988 N1989 R1993	Q1987-L1991 WeakPolarHBondContact CA-O 3.26Å; Q1987-L1991 VanDerWaalsContact OE1-C 3.27Å; Q1987-L1991 PolarHBondContact OE1-O 3.29Å; R1988-L1991 PolarHBondContact N-O 3.32Å; R1988-L1991 VanDerWaalsContact N-O 3.07Å; R1988-L1991 PolarHBondContact O-N 3.21Å; R1988-L1991 VanDerWaalsContact O-N 3.12Å; N1989-L1991 PolarHBondContact O-N 3.2Å; N1989-L1991 VanDerWaalsContact O-N 3.12Å; L1991-R1993 HydrophobicContact CB-CG 4.35Å; L1991-R1993 PolarHBondContact O-N 2.96Å
1992	S	72.9	Confident	76.4	Confident	79.8 Å²	79.8	90 Å²	90	56%	0.558	46%	0.459	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.8	109.5	171	99.9	0	0	0	0	110	S1985	S1985-S1992 WeakPolarHBondContact CB-OG 3.42Å; S1985-S1992 WeakPolarHBondContact OG-CB 3.44Å; S1985-S1992 PolarHBondContact OG-OG 3.45Å
1993	R	77.3	Confident	77.1	Confident	102.2 Å²	102.2	90.5 Å²	90.5	39%	0.386	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	154.8	178.2	33.1	-176	-175.4	175.5	0.3	111.7	E1925 S1985 I1986 R1988 L1991	E1925-R1993 VanDerWaalsContact CD-NH2 3.3Å; E1925-R1993 IonicContact OE1-CZ 3.01Å; E1925-R1993 IonicContact OE1-NE 2.64Å; E1925-R1993 PolarHBondContact OE1-NE 2.81Å; E1925-R1993 IonicContact OE1-NH1 2.72Å; E1925-R1993 PolarHBondContact OE1-NH1 2.84Å; E1925-R1993 IonicContact OE1-NH2 3.04Å; E1925-R1993 PolarHBondContact OE1-NH2 3.03Å; E1925-R1993 IonicContact OE2-CZ 3.31Å; E1925-R1993 IonicContact OE2-NE 2.64Å; E1925-R1993 PolarHBondContact OE2-NE 3.15Å; E1925-R1993 IonicContact OE2-NH1 2.96Å; E1925-R1993 PolarHBondContact OE2-NH1 2.76Å; E1925-R1993 IonicContact OE2-NH2 3.34Å; E1925-R1993 PolarHBondContact OE2-NH2 3.32Å; S1985-R1993 CarbonylContact C-O 3.51Å; S1985-R1993 WeakPolarHBondContact CA-O 3.33Å; S1985-R1993 VanDerWaalsContact CB-O 3.23Å; S1985-R1993 WeakPolarHBondContact CB-O 3.41Å; I1986-R1993 HydrophobicContact CB-CG 4.13Å; I1986-R1993 PolarHBondContact N-O 3.2Å; I1986-R1993 VanDerWaalsContact N-O 3.13Å; I1986-R1993 PolarHBondContact O-N 3.11Å; R1988-R1993 HydrophobicContact CB-CG 4.48Å; L1991-R1993 HydrophobicContact CB-CG 4.35Å; L1991-R1993 PolarHBondContact O-N 2.96Å
1994	R	74.8	Confident	78.3	Confident	141.8 Å²	141.8	84.5 Å²	84.5	54%	0.535	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-73.3	143.6	168.7	-17.2	-175.3	-174.9	-173.2	1.8	109	I1857 H1876 I1996	I1857-R1994 VanDerWaalsContact CD1-NH2 3.33Å; H1876-R1994 PolarHBondContact CD2-NH1 3.16Å; H1876-R1994 PolarHBondContact CD2-NH2 3Å; H1876-R1994 PolarHBondContact NE2-NH1 2.97Å; H1876-R1994 PolarHBondContact NE2-NH2 3.38Å; R1994-I1996 PolarHBondContact O-N 3.05Å
1995	P	78.8	Confident	79.6	Confident	12 Å²	12	80.6 Å²	80.6	8%	0.078	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-53	135.4	170.6	-23.6	31.2	0	0	0	111	R1879 I1924 E1925 P1982 I1986	R1879-P1995 VanDerWaalsContact CZ-O 3.26Å; R1879-P1995 PolarHBondContact NH1-O 3.17Å; R1879-P1995 PolarHBondContact NH2-O 3.09Å; I1924-P1995 HydrophobicContact CG2-CB 3.76Å; E1925-P1995 HydrophobicContact CB-CB 4.11Å; P1982-P1995 HydrophobicContact CG-CB 4.26Å; P1982-P1995 HydrophobicContact CG-CG 3.63Å; I1986-P1995 HydrophobicContact CD1-CB 3.94Å; I1986-P1995 HydrophobicContact CD1-CG 4.04Å; I1986-P1995 HydrophobicContact CG1-CG 4.21Å
1996	I	81.5	Confident	80.8	Confident	69 Å²	69	78.8 Å²	78.8	35%	0.354	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-70.5	147.7	177.8	-64.2	175.5	0	0	0	109.7	I1924 E1925 R1994 N1998 L2321	I1924-I1996 CarbonylContact C-O 3.53Å; I1924-I1996 WeakPolarHBondContact CA-O 3.28Å; I1924-I1996 WeakPolarHBondContact CG2-O 3.32Å; E1925-I1996 HydrophobicContact CB-CB 4.33Å; E1925-I1996 PolarHBondContact N-O 3.21Å; E1925-I1996 WeakPolarHBondContact OE2-CG1 3.42Å; E1925-I1996 PolarHBondContact OE2-N 3.18Å; E1925-I1996 VanDerWaalsContact OE2-N 3.12Å; R1994-I1996 PolarHBondContact O-N 3.05Å; I1996-N1998 VanDerWaalsContact CG2-OD1 3.27Å; I1996-N1998 WeakPolarHBondContact CG2-OD1 3.29Å; I1996-L2321 HydrophobicContact CD1-CD1 4.14Å
1997	V	82.7	Confident	82	Confident	39.4 Å²	39.4	77.7 Å²	77.7	24%	0.239	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	121.5	176	-176.8	0	0	0	0	107.4	R1879 C1922 I1924	R1879-V1997 HydrophobicContact CG-CG2 4.12Å; R1879-V1997 VanDerWaalsContact CZ-CG2 3.42Å; R1879-V1997 VanDerWaalsContact NH2-CG2 3.32Å; C1922-V1997 VanDerWaalsContact SG-CG1 3.53Å; C1922-V1997 WeakPolarHBondContact SG-CG1 3.4Å; I1924-V1997 HydrophobicContact CD1-CG1 4.39Å; I1924-V1997 HydrophobicContact CD1-CG2 4.05Å; I1924-V1997 HydrophobicContact CG1-CB 4.47Å; I1924-V1997 HydrophobicContact CG1-CG1 4.27Å; I1924-V1997 HydrophobicContact CG1-CG2 4.23Å; I1924-V1997 HydrophobicContact CG2-CG2 4.28Å
1998	N	84.9	Confident	83.2	Confident	99.8 Å²	99.8	72.2 Å²	72.2	53%	0.534	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	134.3	179.7	-70.2	-19	0	0	0	109.7	C1922 K1923 I1996	C1922-N1998 CarbonylContact C-O 3.49Å; C1922-N1998 WeakPolarHBondContact CA-O 3.34Å; K1923-N1998 PolarHBondContact N-O 2.99Å; K1923-N1998 PolarHBondContact O-N 2.95Å; I1996-N1998 VanDerWaalsContact CG2-OD1 3.27Å; I1996-N1998 WeakPolarHBondContact CG2-OD1 3.29Å
1999	W	85.7	Confident	84.5	Confident	123 Å²	123	68.9 Å²	68.9	47%	0.466	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	136.3	170.9	-71.2	91.2	0	0	0	109.3	L1881 L1884 L1920 K1921 C1922	L1881-W1999 HydrophobicContact CB-CH2 3.82Å; L1881-W1999 HydrophobicContact CB-CZ2 4.26Å; L1881-W1999 HydrophobicContact CD1-CH2 3.93Å; L1881-W1999 HydrophobicContact CD1-CZ2 4.2Å; L1881-W1999 HydrophobicContact CD2-CH2 3.96Å; L1881-W1999 HydrophobicContact CG-CH2 4.44Å; L1884-W1999 HydrophobicContact CB-CH2 4.4Å; L1884-W1999 HydrophobicContact CB-CZ3 4.19Å; L1920-W1999 HydrophobicContact CB-CE3 4.12Å; L1920-W1999 HydrophobicContact CB-CZ3 4.22Å; K1921-W1999 WeakPolarHBondContact O-CA 3.31Å; C1922-W1999 HydrophobicContact CB-CD2 3.97Å; C1922-W1999 HydrophobicContact CB-CE3 3.83Å; C1922-W1999 HydrophobicContact CB-CH2 3.79Å; C1922-W1999 HydrophobicContact CB-CZ2 3.9Å; C1922-W1999 HydrophobicContact CB-CZ3 3.75Å
2000	C	86.4	Confident	85.4	Confident	38 Å²	38	66.6 Å²	66.6	26%	0.257	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	140.6	171.6	57.4	0	0	0	0	109.9	L1920 K1921 L2002	L1920-C2000 WeakPolarHBondContact CA-O 3.31Å; K1921-C2000 PolarHBondContact N-O 2.98Å; K1921-C2000 PolarHBondContact O-N 3.18Å; K1921-C2000 PolarHBondContact O-SG 3.1Å; K1921-C2000 VanDerWaalsContact O-SG 3.34Å; C2000-L2002 PolarHBondContact O-N 3.04Å
2001	V	87.2	Confident	86.2	Confident	44.4 Å²	44.4	63.6 Å²	63.6	27%	0.269	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	118.9	168.7	-174.3	0	0	0	0	107.2	L1920 N2003 L2004 Q2084 C2086	L1920-V2001 HydrophobicContact CD2-CB 4.12Å; L1920-V2001 HydrophobicContact CD2-CG1 4.16Å; L1920-V2001 HydrophobicContact CD2-CG2 3.71Å; V2001-N2003 VanDerWaalsContact C-N 3.32Å; V2001-N2003 PolarHBondContact O-N 3.16Å; V2001-L2004 HydrophobicContact CG1-CB 3.81Å; V2001-Q2084 HydrophobicContact CG1-CB 4.45Å; V2001-C2086 WeakPolarHBondContact O-CB 3.41Å; V2001-C2086 PolarHBondContact O-SG 3.1Å
2002	L	87	Confident	87.2	Confident	76.6 Å²	76.6	58.7 Å²	58.7	40%	0.401	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	-44.6	174.4	-65.7	-178.8	0	0	0	110.8	K1919 K1921 C2000 C2086	K1919-L2002 HydrophobicContact CB-CB 4.46Å; K1919-L2002 HydrophobicContact CD-CD1 4.47Å; K1919-L2002 HydrophobicContact CG-CB 4.48Å; K1919-L2002 HydrophobicContact CG-CD1 4.31Å; K1919-L2002 WeakPolarHBondContact O-CA 3.47Å; K1919-L2002 WeakPolarHBondContact O-CB 3.43Å; K1919-L2002 PolarHBondContact O-N 3.09Å; K1921-L2002 HydrophobicContact CB-CD1 3.72Å; K1921-L2002 HydrophobicContact CB-CD2 4.09Å; K1921-L2002 HydrophobicContact CB-CG 3.77Å; K1921-L2002 HydrophobicContact CD-CD1 4.19Å; K1921-L2002 HydrophobicContact CD-CD2 4.27Å; K1921-L2002 HydrophobicContact CG-CD1 4.46Å; C2000-L2002 PolarHBondContact O-N 3.04Å; L2002-C2086 VanDerWaalsContact O-CB 3.26Å; L2002-C2086 WeakPolarHBondContact O-CB 3.19Å
2003	N	89.4	Confident	88.1	Confident	54.2 Å²	54.2	56.7 Å²	56.7	29%	0.29	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	141.6	172.5	-172.1	10.8	0	0	0	108.1	K1919 V2001 Q2084 L2085	K1919-N2003 HydrophobicContact CB-CB 4.33Å; K1919-N2003 PolarHBondContact N-O 3.18Å; K1919-N2003 PolarHBondContact O-N 2.97Å; V2001-N2003 VanDerWaalsContact C-N 3.32Å; V2001-N2003 PolarHBondContact O-N 3.16Å; N2003-Q2084 CarbonylContact C-O 3.55Å; N2003-Q2084 VanDerWaalsContact CA-O 3.31Å; N2003-Q2084 WeakPolarHBondContact CA-O 3.18Å; N2003-Q2084 PolarHBondContact OD1-O 3.1Å; N2003-L2085 HydrophobicContact CB-CD2 4.41Å
2004	L	93.2	Very high	88.6	Confident	40.2 Å²	40.2	53 Å²	53	21%	0.21	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	112.8	165.3	175.1	64.3	0	0	0	107.6	F1886 I1916 I1917 V2001 Y2082 Q2083 Q2084	F1886-L2004 HydrophobicContact CE2-CD1 4.37Å; F1886-L2004 HydrophobicContact CZ-CD1 4.06Å; I1916-L2004 HydrophobicContact CG2-CD1 4.15Å; I1917-L2004 CarbonylContact O-C 3.57Å; I1917-L2004 WeakPolarHBondContact O-CA 3.34Å; V2001-L2004 HydrophobicContact CG1-CB 3.81Å; L2004-Y2082 HydrophobicContact CB-CE1 4.3Å; L2004-Y2082 HydrophobicContact CD2-CE1 3.94Å; L2004-Y2082 HydrophobicContact CG-CD1 4.47Å; L2004-Y2082 HydrophobicContact CG-CE1 4.02Å; L2004-Q2083 CarbonylContact O-C 3.56Å; L2004-Q2083 VanDerWaalsContact O-CA 3.28Å; L2004-Q2083 WeakPolarHBondContact O-CA 3.32Å; L2004-Q2084 HydrophobicContact CB-CB 4.12Å; L2004-Q2084 PolarHBondContact N-O 3.02Å; L2004-Q2084 VanDerWaalsContact N-O 3.14Å; L2004-Q2084 PolarHBondContact O-N 3.06Å
2005	Y	95	Very high	89.1	Confident	57 Å²	57	47.2 Å²	47.2	22%	0.224	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	140.7	178	175	-99.2	0	0	0	109.5	Q1915 I1916 I1917 S2007 R2081 Y2082 Q2083	Q1915-Y2005 HydrophobicContact CG-CE1 4.25Å; I1916-Y2005 CarbonylContact C-O 3.54Å; I1916-Y2005 WeakPolarHBondContact CA-O 3.36Å; I1917-Y2005 HydrophobicContact CD1-CD1 4.39Å; I1917-Y2005 PolarHBondContact N-O 3.03Å; I1917-Y2005 PolarHBondContact O-N 3.13Å; Y2005-S2007 WeakPolarHBondContact CE1-OG 3.29Å; Y2005-S2007 WeakPolarHBondContact OH-CB 3.34Å; Y2005-S2007 PolarHBondContact OH-OG 3.35Å; Y2005-R2081 HydrophobicContact CE2-CG 4.32Å; Y2005-Y2082 CarbonylContact C-O 3.5Å; Y2005-Y2082 VanDerWaalsContact CA-O 3.3Å; Y2005-Y2082 WeakPolarHBondContact CA-O 3.31Å; Y2005-Y2082 WeakPolarHBondContact CD2-O 3.32Å; Y2005-Q2083 HydrophobicContact CD2-CB 4.43Å; Y2005-Q2083 HydrophobicContact CD2-CG 4.5Å
2006	A	95.2	Very high	89.1	Confident	14 Å²	14	49.1 Å²	49.1	12%	0.116	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	135.9	167.1	0	0	0	0	0	110.1	Q1915 I1916 R2081 Y2082	Q1915-A2006 CarbonylContact O-C 3.54Å; Q1915-A2006 VanDerWaalsContact O-CA 3.27Å; Q1915-A2006 WeakPolarHBondContact O-CA 3.37Å; I1916-A2006 HydrophobicContact CG1-CB 4.06Å; I1916-A2006 HydrophobicContact CG2-CB 4.45Å; A2006-R2081 CarbonylContact O-C 3.54Å; A2006-R2081 VanDerWaalsContact O-CA 3.32Å; A2006-R2081 WeakPolarHBondContact O-CA 3.41Å; A2006-Y2082 HydrophobicContact CB-CD1 4.44Å; A2006-Y2082 PolarHBondContact N-O 3.14Å; A2006-Y2082 PolarHBondContact O-N 3.15Å
2007	S	95.7	Very high	88.9	Confident	5.8 Å²	5.8	48.9 Å²	48.9	4%	0.041	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	129.8	168.9	-176.1	0	0	0	0	108.2	I1914 Q1915 Y2005 H2009 L2080	I1914-S2007 WeakPolarHBondContact CA-O 3.39Å; Q1915-S2007 PolarHBondContact N-O 3.11Å; Q1915-S2007 PolarHBondContact O-N 3.09Å; Y2005-S2007 WeakPolarHBondContact CE1-OG 3.29Å; Y2005-S2007 WeakPolarHBondContact OH-CB 3.34Å; Y2005-S2007 PolarHBondContact OH-OG 3.35Å; S2007-H2009 PolarHBondContact OG-NE2 3.2Å; S2007-H2009 VanDerWaalsContact OG-NE2 3.16Å; S2007-L2080 CarbonylContact C-O 3.55Å; S2007-L2080 WeakPolarHBondContact CA-O 3.39Å
2008	I	94.6	Very high	88.1	Confident	36.6 Å²	36.6	50.4 Å²	50.4	19%	0.188	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	125.2	178.9	-53.6	179.5	0	0	0	107.4	T1911 I1914 I2011 L2079 L2080	T1911-I2008 HydrophobicContact CG2-CG2 3.8Å; I1914-I2008 HydrophobicContact CG1-CG1 4.28Å; I1914-I2008 HydrophobicContact CG1-CG2 4.04Å; I1914-I2008 HydrophobicContact CG2-CG1 4.4Å; I2008-I2011 HydrophobicContact CB-CD1 3.97Å; I2008-I2011 HydrophobicContact CB-CG1 4.32Å; I2008-I2011 HydrophobicContact CG2-CD1 3.59Å; I2008-I2011 HydrophobicContact CG2-CG1 3.48Å; I2008-I2011 VanDerWaalsContact CG2-CG1 3.48Å; I2008-L2079 WeakPolarHBondContact O-CA 3.41Å; I2008-L2080 HydrophobicContact CB-CB 4.47Å; I2008-L2080 HydrophobicContact CD1-CD2 4.41Å; I2008-L2080 PolarHBondContact N-O 3.11Å; I2008-L2080 PolarHBondContact O-N 3Å
2009	H	93	Very high	86.8	Confident	68.4 Å²	68.4	51.4 Å²	51.4	32%	0.317	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	157.1	-179.5	-66.2	-103.2	0	0	0	111.2	G1912 P1913 S2007 I2011 P2078 L2079	G1912-H2009 WeakPolarHBondContact CA-O 3.29Å; G1912-H2009 PolarHBondContact N-O 3.02Å; P1913-H2009 HydrophobicContact CB-CB 4.46Å; P1913-H2009 PolarHBondContact O-CD2 2.87Å; P1913-H2009 PolarHBondContact O-N 2.96Å; S2007-H2009 PolarHBondContact OG-NE2 3.2Å; S2007-H2009 VanDerWaalsContact OG-NE2 3.16Å; H2009-I2011 PolarHBondContact O-N 3.08Å; H2009-P2078 CarbonylContact C-O 3.57Å; H2009-P2078 WeakPolarHBondContact CA-O 3.28Å; H2009-L2079 WeakPolarHBondContact CE1-CD1 3.42Å
2010	D	92.2	Very high	85.3	Confident	101.4 Å²	101.4	52.7 Å²	52.7	54%	0.542	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	46.1	55.5	167.6	-53.9	-47.8	0	0	0	114	T1911 G1912 P2078	T1911-D2010 WeakPolarHBondContact CA-O 3.41Å; G1912-D2010 PolarHBondContact N-O 3.21Å; D2010-P2078 PolarHBondContact N-O 2.98Å
2011	I	92.3	Very high	83.9	Confident	12.4 Å²	12.4	53.2 Å²	53.2	6%	0.064	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	125.2	-180	-51.1	171.3	0	0	0	109.5	V1909 N1910 T1911 I2008 H2009 I2013 L2076 V2077 L2080	V1909-I2011 HydrophobicContact CG1-CG2 3.71Å; N1910-I2011 CarbonylContact O-C 3.53Å; N1910-I2011 VanDerWaalsContact O-CA 3.31Å; N1910-I2011 WeakPolarHBondContact O-CA 3.24Å; T1911-I2011 HydrophobicContact CG2-CG1 4.26Å; T1911-I2011 HydrophobicContact CG2-CG2 4.43Å; I2008-I2011 HydrophobicContact CB-CD1 3.97Å; I2008-I2011 HydrophobicContact CB-CG1 4.32Å; I2008-I2011 HydrophobicContact CG2-CD1 3.59Å; I2008-I2011 HydrophobicContact CG2-CG1 3.48Å; I2008-I2011 VanDerWaalsContact CG2-CG1 3.48Å; H2009-I2011 PolarHBondContact O-N 3.08Å; I2011-I2013 HydrophobicContact CG2-CD1 4.29Å; I2011-I2013 HydrophobicContact CG2-CG1 3.81Å; I2011-L2076 CarbonylContact O-C 3.54Å; I2011-L2076 WeakPolarHBondContact O-CA 3.42Å; I2011-V2077 HydrophobicContact CB-CB 4.12Å; I2011-V2077 WeakPolarHBondContact CB-O 3.45Å; I2011-V2077 HydrophobicContact CD1-CB 4.3Å; I2011-V2077 HydrophobicContact CD1-CG1 4.07Å; I2011-V2077 PolarHBondContact N-O 3.11Å; I2011-V2077 PolarHBondContact O-N 3.24Å; I2011-L2080 HydrophobicContact CD1-CB 3.68Å; I2011-L2080 HydrophobicContact CD1-CD1 4.06Å; I2011-L2080 HydrophobicContact CD1-CD2 3.85Å; I2011-L2080 HydrophobicContact CD1-CG 4.45Å
2012	A	91.7	Very high	82.3	Confident	16.8 Å²	16.8	53.5 Å²	53.5	14%	0.139	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	116.7	167.9	0	0	0	0	0	110	V1909 N1910 A2073 I2075 L2076	V1909-A2012 WeakPolarHBondContact CA-O 3.46Å; N1910-A2012 HydrophobicContact CB-CB 4.4Å; N1910-A2012 PolarHBondContact N-O 3.1Å; N1910-A2012 PolarHBondContact O-N 3.05Å; A2012-A2073 HydrophobicContact CB-CB 4.34Å; A2012-I2075 WeakPolarHBondContact CA-O 3.39Å; A2012-L2076 HydrophobicContact CB-CD1 4.29Å; A2012-L2076 HydrophobicContact CB-CD2 3.75Å
2013	I	91.2	Very high	80.8	Confident	38.6 Å²	38.6	50.7 Å²	50.7	20%	0.198	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	123.9	-179.7	-52.6	-178.9	0	0	0	108.9	V1907 H1908 V1909 I2011 F2074 I2075	V1907-I2013 HydrophobicContact CG1-CG2 3.55Å; V1907-I2013 VanDerWaalsContact CG1-CG2 3.47Å; H1908-I2013 CarbonylContact O-C 3.48Å; H1908-I2013 WeakPolarHBondContact O-CA 3.34Å; V1909-I2013 HydrophobicContact CG1-CG1 4.16Å; V1909-I2013 HydrophobicContact CG2-CG1 4.17Å; V1909-I2013 HydrophobicContact CG2-CG2 4.23Å; I2011-I2013 HydrophobicContact CG2-CD1 4.29Å; I2011-I2013 HydrophobicContact CG2-CG1 3.81Å; I2013-F2074 HydrophobicContact CG2-CD1 4.39Å; I2013-F2074 CarbonylContact O-C 3.59Å; I2013-F2074 VanDerWaalsContact O-CA 3.27Å; I2013-F2074 WeakPolarHBondContact O-CA 3.41Å; I2013-F2074 WeakPolarHBondContact O-CB 3.38Å; I2013-F2074 PolarHBondContact O-N 3.01Å; I2013-I2075 HydrophobicContact CB-CB 4.11Å; I2013-I2075 HydrophobicContact CD1-CB 4.17Å; I2013-I2075 HydrophobicContact CD1-CD1 4.39Å; I2013-I2075 HydrophobicContact CD1-CG2 4.2Å; I2013-I2075 HydrophobicContact CG1-CB 4.3Å; I2013-I2075 PolarHBondContact N-O 3.23Å; I2013-I2075 PolarHBondContact O-N 3.11Å; I2013-I2075 VanDerWaalsContact O-N 3.16Å
2014	H	87.7	Confident	79.2	Confident	24.6 Å²	24.6	51.2 Å²	51.2	11%	0.114	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	134.8	176.9	-57.3	110.9	0	0	0	109.3	H1908 R2016 D2070 I2071 E2072 A2073	H1908-H2014 HydrophobicContact CB-CB 4.34Å; H1908-H2014 PolarHBondContact N-O 3.27Å; H1908-H2014 PolarHBondContact O-N 3.05Å; H2014-R2016 PolarHBondContact O-N 3.18Å; H2014-D2070 PolarHBondContact CE1-O 2.8Å; H2014-D2070 PolarHBondContact ND1-O 3.36Å; H2014-I2071 PolarHBondContact CD2-O 3.1Å; H2014-I2071 VanDerWaalsContact CD2-O 3.26Å; H2014-E2072 IonicContact CE1-OE2 3.84Å; H2014-E2072 IonicContact CG-OE2 3.69Å; H2014-E2072 IonicContact ND1-OE2 2.81Å; H2014-E2072 PolarHBondContact ND1-OE2 3.1Å; H2014-A2073 VanDerWaalsContact CD2-CA 3.49Å; H2014-A2073 WeakPolarHBondContact CD2-CA 3.5Å; H2014-A2073 WeakPolarHBondContact NE2-CA 3.41Å; H2014-A2073 WeakPolarHBondContact NE2-CB 3.41Å
2015	L	85.4	Confident	77.4	Confident	18.8 Å²	18.8	52.5 Å²	52.5	10%	0.098	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	111.7	174.6	-62.4	177	0	0	0	108.6	V1907 F2074 H2242 L2245 V2246 L2249	V1907-L2015 HydrophobicContact CG1-CD2 4.28Å; V1907-L2015 HydrophobicContact CG2-CD2 4.02Å; L2015-F2074 HydrophobicContact CD1-CB 4.33Å; L2015-F2074 HydrophobicContact CD1-CD1 3.69Å; L2015-F2074 HydrophobicContact CD1-CD2 4.02Å; L2015-F2074 HydrophobicContact CD1-CE1 3.92Å; L2015-F2074 HydrophobicContact CD1-CE2 4.24Å; L2015-F2074 HydrophobicContact CD1-CG 3.74Å; L2015-F2074 HydrophobicContact CD1-CZ 4.19Å; L2015-F2074 HydrophobicContact CD2-CD1 4.03Å; L2015-F2074 HydrophobicContact CD2-CE1 4.38Å; L2015-F2074 HydrophobicContact CG-CB 4.01Å; L2015-F2074 HydrophobicContact CG-CD1 3.67Å; L2015-F2074 HydrophobicContact CG-CE1 4.29Å; L2015-F2074 HydrophobicContact CG-CG 3.84Å; L2015-H2242 HydrophobicContact CD1-CB 4.17Å; L2015-L2245 HydrophobicContact CB-CB 4.29Å; L2015-L2245 HydrophobicContact CB-CD1 3.68Å; L2015-L2245 HydrophobicContact CD1-CB 4.17Å; L2015-L2245 WeakPolarHBondContact O-CD1 3.46Å; L2015-V2246 HydrophobicContact CD1-CG2 3.71Å; L2015-L2249 HydrophobicContact CD2-CD1 4.18Å
2016	R	79.3	Confident	75.6	Confident	52.2 Å²	52.2	51.4 Å²	51.4	20%	0.197	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	131.3	-176	-72.8	-172.8	168.2	172.7	-6.2	111.4	W1898 T1905 G1906 H1908 H2014 D2063 E2066 D2070 E2072	W1898-R2016 HydrophobicContact CH2-CB 3.92Å; W1898-R2016 HydrophobicContact CZ3-CB 4.12Å; T1905-R2016 WeakPolarHBondContact CA-O 3.46Å; G1906-R2016 PolarHBondContact N-O 2.97Å; G1906-R2016 PolarHBondContact O-N 3.31Å; G1906-R2016 VanDerWaalsContact O-N 3.13Å; H1908-R2016 HydrophobicContact CB-CG 4.31Å; H1908-R2016 VanDerWaalsContact CG-NH1 3.34Å; H1908-R2016 PolarHBondContact ND1-NE 2.87Å; H1908-R2016 PolarHBondContact ND1-NH1 3.14Å; H1908-R2016 PolarHBondContact ND1-NH2 2.98Å; H1908-R2016 VanDerWaalsContact ND1-NH2 3.12Å; H2014-R2016 PolarHBondContact O-N 3.18Å; R2016-D2063 IonicContact CZ-OD1 2.66Å; R2016-D2063 IonicContact NH1-OD1 2.73Å; R2016-D2063 PolarHBondContact NH1-OD1 2.74Å; R2016-E2066 PolarHBondContact NH2-O 3.14Å; R2016-D2070 IonicContact CZ-OD1 2.71Å; R2016-D2070 IonicContact CZ-OD2 3.56Å; R2016-D2070 VanDerWaalsContact CZ-OD2 3.26Å; R2016-D2070 IonicContact NE-OD1 2.71Å; R2016-D2070 PolarHBondContact NE-OD1 3.07Å; R2016-D2070 IonicContact NE-OD2 3.79Å; R2016-D2070 PolarHBondContact NE-OD2 2.98Å; R2016-D2070 VanDerWaalsContact NE-OD2 3.09Å; R2016-D2070 IonicContact NH2-OD1 3.12Å; R2016-D2070 IonicContact NH2-OD2 3.68Å; R2016-D2070 PolarHBondContact NH2-OD2 2.95Å; R2016-E2072 IonicContact NE-OE1 3.27Å; R2016-E2072 IonicContact NH2-OE1 2.75Å; R2016-E2072 PolarHBondContact NH2-OE1 2.85Å
2017	H	76.8	Confident	73.8	Confident	64.2 Å²	64.2	53.7 Å²	53.7	30%	0.297	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	129.8	173	-167.7	26.7	0	0	0	109.6	R1904 T1905 D2019 L2021 L2245	R1904-H2017 CarbonylContact O-C 3.57Å; R1904-H2017 WeakPolarHBondContact O-CA 3.35Å; R1904-H2017 PolarHBondContact O-ND1 2.89Å; T1905-H2017 VanDerWaalsContact CG2-CE1 3.44Å; T1905-H2017 WeakPolarHBondContact CG2-CE1 3.43Å; T1905-H2017 VanDerWaalsContact CG2-ND1 3.26Å; T1905-H2017 WeakPolarHBondContact CG2-ND1 3.37Å; H2017-D2019 IonicContact CD2-OD1 3.22Å; H2017-D2019 IonicContact CD2-OD2 3.4Å; H2017-D2019 PolarHBondContact CD2-OD2 2.98Å; H2017-D2019 IonicContact CE1-OD1 3.55Å; H2017-D2019 PolarHBondContact CE1-OD1 3.39Å; H2017-D2019 IonicContact CE1-OD2 3.1Å; H2017-D2019 IonicContact CG-OD2 3.63Å; H2017-D2019 IonicContact ND1-OD1 3.59Å; H2017-D2019 IonicContact ND1-OD2 3.24Å; H2017-D2019 IonicContact NE2-OD1 2.99Å; H2017-D2019 PolarHBondContact NE2-OD1 3.07Å; H2017-D2019 VanDerWaalsContact NE2-OD1 3.1Å; H2017-D2019 IonicContact NE2-OD2 3.23Å; H2017-D2019 PolarHBondContact NE2-OD2 2.95Å; H2017-L2021 PolarHBondContact CE1-O 2.99Å; H2017-L2245 HydrophobicContact CB-CD1 4.14Å; H2017-L2245 HydrophobicContact CB-CD2 3.39Å; H2017-L2245 HydrophobicContact CB-CG 4.37Å; H2017-L2245 WeakPolarHBondContact CD2-CD2 3.41Å
2018	R	66.7	Low	71.8	Confident	72.4 Å²	72.4	57.4 Å²	57.4	27%	0.273	30%	0.299	S	S	.	.			trans	-116.1	106.3	174	-78.9	-178.5	176.9	175.9	1	109.2	R1904 N2020 L2021 D2063 E2066	R1904-R2018 HydrophobicContact CB-CB 4.03Å; R1904-R2018 WeakPolarHBondContact CG-O 3.23Å; R1904-R2018 PolarHBondContact O-N 3.12Å; R2018-N2020 PolarHBondContact O-N 2.83Å; R2018-L2021 HydrophobicContact CB-CB 3.88Å; R2018-L2021 HydrophobicContact CB-CD2 4.25Å; R2018-L2021 HydrophobicContact CB-CG 4.44Å; R2018-L2021 PolarHBondContact O-N 3.12Å; R2018-D2063 IonicContact CZ-OD1 2.66Å; R2018-D2063 IonicContact CZ-OD2 2.65Å; R2018-D2063 IonicContact NH1-OD1 3.06Å; R2018-D2063 IonicContact NH1-OD2 3.11Å; R2018-D2063 PolarHBondContact NH1-OD2 3.4Å; R2018-D2063 IonicContact NH2-OD1 3.91Å; R2018-D2063 PolarHBondContact NH2-OD1 2.85Å; R2018-D2063 IonicContact NH2-OD2 2.96Å; R2018-D2063 PolarHBondContact NH2-OD2 3.25Å; R2018-E2066 WeakPolarHBondContact CD-OE1 3.26Å; R2018-E2066 WeakPolarHBondContact CG-OE1 3.39Å; R2018-E2066 IonicContact CZ-OE1 2.72Å; R2018-E2066 IonicContact CZ-OE2 2.76Å; R2018-E2066 VanDerWaalsContact NE-CD 3.28Å; R2018-E2066 IonicContact NE-OE1 3.89Å; R2018-E2066 PolarHBondContact NE-OE1 2.75Å; R2018-E2066 VanDerWaalsContact NE-OE1 3.08Å; R2018-E2066 IonicContact NE-OE2 3.68Å; R2018-E2066 PolarHBondContact NE-OE2 2.75Å; R2018-E2066 IonicContact NH2-OE1 3.83Å; R2018-E2066 IonicContact NH2-OE2 3.76Å; R2018-E2066 PolarHBondContact NH2-OE2 2.93Å
2019	D	58	Low	69.9	Low	120.2 Å²	120.2	57.9 Å²	57.9	64%	0.643	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-26.2	-177.9	-74.4	-42.8	0	0	0	112.9	H2017 L2021	H2017-D2019 IonicContact CD2-OD1 3.22Å; H2017-D2019 IonicContact CD2-OD2 3.4Å; H2017-D2019 PolarHBondContact CD2-OD2 2.98Å; H2017-D2019 IonicContact CE1-OD1 3.55Å; H2017-D2019 PolarHBondContact CE1-OD1 3.39Å; H2017-D2019 IonicContact CE1-OD2 3.1Å; H2017-D2019 IonicContact CG-OD2 3.63Å; H2017-D2019 IonicContact ND1-OD1 3.59Å; H2017-D2019 IonicContact ND1-OD2 3.24Å; H2017-D2019 IonicContact NE2-OD1 2.99Å; H2017-D2019 PolarHBondContact NE2-OD1 3.07Å; H2017-D2019 VanDerWaalsContact NE2-OD1 3.1Å; H2017-D2019 IonicContact NE2-OD2 3.23Å; H2017-D2019 PolarHBondContact NE2-OD2 2.95Å; D2019-L2021 VanDerWaalsContact C-N 3.32Å; D2019-L2021 PolarHBondContact O-N 3.09Å
2020	N	54.4	Low	68.2	Low	150.4 Å²	150.4	57 Å²	57	80%	0.804	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	9.8	-170.7	-68.4	-25.8	0	0	0	116.1	R2018 P2022	R2018-N2020 PolarHBondContact O-N 2.83Å; N2020-P2022 VanDerWaalsContact O-CD 3.31Å; N2020-P2022 WeakPolarHBondContact O-CD 3.3Å
2021	L	55.2	Low	66.3	Low	47.2 Å²	47.2	57.3 Å²	57.3	25%	0.247	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-90	110.1	178.5	-128.4	105	0	0	0	111	K1903 R1904 H2017 R2018 D2019 G2023 L2025 I2026 L2062	K1903-L2021 HydrophobicContact CB-CD2 4.42Å; R1904-L2021 HydrophobicContact CG-CB 4.28Å; R1904-L2021 PolarHBondContact NE-O 2.97Å; R1904-L2021 PolarHBondContact NH2-O 3.45Å; H2017-L2021 PolarHBondContact CE1-O 2.99Å; R2018-L2021 HydrophobicContact CB-CB 3.88Å; R2018-L2021 HydrophobicContact CB-CD2 4.25Å; R2018-L2021 HydrophobicContact CB-CG 4.44Å; R2018-L2021 PolarHBondContact O-N 3.12Å; D2019-L2021 VanDerWaalsContact C-N 3.32Å; D2019-L2021 PolarHBondContact O-N 3.09Å; L2021-G2023 PolarHBondContact O-N 3.11Å; L2021-G2023 VanDerWaalsContact O-N 3.14Å; L2021-L2025 HydrophobicContact CD2-CD2 4.36Å; L2021-L2025 HydrophobicContact CG-CD2 4.28Å; L2021-I2026 HydrophobicContact CB-CD1 3.88Å; L2021-I2026 HydrophobicContact CB-CG1 4Å; L2021-I2026 HydrophobicContact CD2-CD1 3.87Å; L2021-I2026 HydrophobicContact CD2-CG1 3.22Å; L2021-I2026 HydrophobicContact CG-CG1 4.15Å; L2021-L2062 HydrophobicContact CD1-CD2 4.35Å
2022	P	53.9	Low	64.4	Low	52.2 Å²	52.2	58.8 Å²	58.8	34%	0.339	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-57.1	133.7	172.5	8.6	-9.4	0	0	0	108.8	N2020 P2024 L2025 I2026 L2030	N2020-P2022 VanDerWaalsContact O-CD 3.31Å; N2020-P2022 WeakPolarHBondContact O-CD 3.3Å; P2022-P2024 WeakPolarHBondContact O-CD 3.22Å; P2022-L2025 PolarHBondContact O-N 2.96Å; P2022-I2026 HydrophobicContact CB-CB 3.87Å; P2022-I2026 HydrophobicContact CB-CD1 3.88Å; P2022-I2026 VanDerWaalsContact CB-CD1 3.5Å; P2022-I2026 HydrophobicContact CB-CG1 4.16Å; P2022-I2026 HydrophobicContact CB-CG2 3.7Å; P2022-I2026 HydrophobicContact CG-CB 4.3Å; P2022-I2026 HydrophobicContact CG-CG2 4.18Å; P2022-L2030 HydrophobicContact CB-CD1 4.43Å; P2022-L2030 HydrophobicContact CG-CD1 3.97Å
2023	G	55.8	Low	62.4	Low	17.6 Å²	17.6	61.6 Å²	61.6	18%	0.181	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-56	165.4	-179.9	0	0	0	0	0	112.6	L2021 L2025 I2026 Q2027 E2898	L2021-G2023 PolarHBondContact O-N 3.11Å; L2021-G2023 VanDerWaalsContact O-N 3.14Å; G2023-L2025 PolarHBondContact O-N 3.24Å; G2023-I2026 WeakPolarHBondContact O-CA 3.47Å; G2023-I2026 WeakPolarHBondContact O-CB 3.48Å; G2023-I2026 PolarHBondContact O-N 3.18Å; G2023-Q2027 WeakPolarHBondContact O-CB 3.21Å; G2023-Q2027 PolarHBondContact O-N 3.15Å; G2023-Q2027 VanDerWaalsContact O-N 3.09Å; G2023-E2898 WeakPolarHBondContact CA-OE1 3.46Å; G2023-E2898 PolarHBondContact N-OE1 3.02Å; G2023-E2898 VanDerWaalsContact N-OE1 3.16Å; G2023-E2898 PolarHBondContact N-OE2 2.99Å
2024	P	56.4	Low	60.3	Low	65 Å²	65	63.1 Å²	63.1	42%	0.422	33%	0.328	S	S	.	.	H	α-helix	trans	-58.5	-28	-169.7	-17.5	23	0	0	0	114.5	Y1901 A1902 P2022 Q2027 M2028	Y1901-P2024 HydrophobicContact CD1-CB 3.93Å; Y1901-P2024 HydrophobicContact CD1-CG 3.68Å; Y1901-P2024 HydrophobicContact CE1-CB 4.13Å; Y1901-P2024 HydrophobicContact CE1-CG 4.27Å; A1902-P2024 HydrophobicContact CB-CG 4.35Å; P2022-P2024 WeakPolarHBondContact O-CD 3.22Å; P2024-Q2027 WeakPolarHBondContact O-CB 3.46Å; P2024-Q2027 PolarHBondContact O-N 3.01Å; P2024-M2028 VanDerWaalsContact O-CB 3.26Å; P2024-M2028 WeakPolarHBondContact O-CB 3.21Å; P2024-M2028 PolarHBondContact O-N 2.98Å
2025	L	54.9	Low	58.2	Low	67.4 Å²	67.4	65.7 Å²	65.7	35%	0.353	35%	0.346	S	S	.	.	H	α-helix	trans	-71.8	-36.3	177.3	-127.8	133.7	0	0	0	112.2	L2021 P2022 G2023 Q2027 M2028 L2029 L2836 W2837 V2840	L2021-L2025 HydrophobicContact CD2-CD2 4.36Å; L2021-L2025 HydrophobicContact CG-CD2 4.28Å; P2022-L2025 PolarHBondContact O-N 2.96Å; G2023-L2025 PolarHBondContact O-N 3.24Å; L2025-Q2027 VanDerWaalsContact C-N 3.31Å; L2025-Q2027 PolarHBondContact O-N 2.82Å; L2025-M2028 HydrophobicContact CD1-CE 3.9Å; L2025-M2028 HydrophobicContact CD2-CE 3.81Å; L2025-M2028 PolarHBondContact O-N 2.67Å; L2025-L2029 HydrophobicContact CD2-CD1 3.89Å; L2025-L2029 HydrophobicContact CG-CD1 4.39Å; L2025-L2029 WeakPolarHBondContact O-CB 3.24Å; L2025-L2029 VanDerWaalsContact O-CG 3.28Å; L2025-L2029 WeakPolarHBondContact O-CG 3.31Å; L2025-L2029 PolarHBondContact O-N 3.15Å; L2025-L2029 VanDerWaalsContact O-N 3.12Å; L2025-L2836 HydrophobicContact CD1-CB 4.37Å; L2025-L2836 HydrophobicContact CD1-CD2 4Å; L2025-L2836 HydrophobicContact CD1-CG 3.72Å; L2025-W2837 HydrophobicContact CD1-CB 4.02Å; L2025-V2840 HydrophobicContact CB-CB 4.19Å; L2025-V2840 HydrophobicContact CB-CG1 4.1Å; L2025-V2840 HydrophobicContact CB-CG2 3.89Å
2026	I	58.2	Low	56.2	Low	33 Å²	33	71.7 Å²	71.7	17%	0.169	37%	0.368	C	S	.	.	H	α-helix	trans	-71.5	-40.1	173	-60.6	171.9	0	0	0	109.9	Y1901 L2021 P2022 G2023 M2028 L2029 L2030 I2891 A2894 R2895 E2898	Y1901-I2026 WeakPolarHBondContact OH-CG2 3.42Å; L2021-I2026 HydrophobicContact CB-CD1 3.88Å; L2021-I2026 HydrophobicContact CB-CG1 4Å; L2021-I2026 HydrophobicContact CD2-CD1 3.87Å; L2021-I2026 HydrophobicContact CD2-CG1 3.22Å; L2021-I2026 HydrophobicContact CG-CG1 4.15Å; P2022-I2026 HydrophobicContact CB-CB 3.87Å; P2022-I2026 HydrophobicContact CB-CD1 3.88Å; P2022-I2026 VanDerWaalsContact CB-CD1 3.5Å; P2022-I2026 HydrophobicContact CB-CG1 4.16Å; P2022-I2026 HydrophobicContact CB-CG2 3.7Å; P2022-I2026 HydrophobicContact CG-CB 4.3Å; P2022-I2026 HydrophobicContact CG-CG2 4.18Å; G2023-I2026 WeakPolarHBondContact O-CA 3.47Å; G2023-I2026 WeakPolarHBondContact O-CB 3.48Å; G2023-I2026 PolarHBondContact O-N 3.18Å; I2026-M2028 VanDerWaalsContact C-N 3.32Å; I2026-M2028 PolarHBondContact O-N 3.06Å; I2026-L2029 CarbonylContact O-C 3.6Å; I2026-L2029 WeakPolarHBondContact O-CB 3.39Å; I2026-L2029 PolarHBondContact O-N 3.19Å; I2026-L2030 HydrophobicContact CG2-CD1 4.16Å; I2026-L2030 HydrophobicContact CG2-CG 4.43Å; I2026-L2030 WeakPolarHBondContact O-CD1 3.37Å; I2026-L2030 VanDerWaalsContact O-CG 3.3Å; I2026-L2030 WeakPolarHBondContact O-CG 3.3Å; I2026-L2030 PolarHBondContact O-N 3.21Å; I2026-I2891 HydrophobicContact CG2-CG2 4.23Å; I2026-A2894 HydrophobicContact CD1-CB 3.99Å; I2026-A2894 HydrophobicContact CG1-CB 3.61Å; I2026-R2895 HydrophobicContact CD1-CB 4.31Å; I2026-R2895 HydrophobicContact CD1-CG 3.74Å; I2026-E2898 HydrophobicContact CD1-CG 3.97Å; I2026-E2898 VanDerWaalsContact CD1-OE1 3.24Å; I2026-E2898 WeakPolarHBondContact CD1-OE1 3.41Å; I2026-E2898 WeakPolarHBondContact CG1-OE1 3.38Å
2027	Q	55.9	Low	54.4	Low	62.2 Å²	62.2	74.7 Å²	74.7	29%	0.291	39%	0.385	S	S	.	.	H	α-helix	trans	-62	-40.9	175.3	-166.3	176.8	10.1	0	0	111.6	Y1901 G2023 P2024 L2025 L2029 L2030 Q2031 I2056	Y1901-Q2027 PolarHBondContact OH-NE2 2.83Å; Y1901-Q2027 PolarHBondContact OH-OE1 3.14Å; G2023-Q2027 WeakPolarHBondContact O-CB 3.21Å; G2023-Q2027 PolarHBondContact O-N 3.15Å; G2023-Q2027 VanDerWaalsContact O-N 3.09Å; P2024-Q2027 WeakPolarHBondContact O-CB 3.46Å; P2024-Q2027 PolarHBondContact O-N 3.01Å; L2025-Q2027 VanDerWaalsContact C-N 3.31Å; L2025-Q2027 PolarHBondContact O-N 2.82Å; Q2027-L2029 PolarHBondContact O-N 2.93Å; Q2027-L2030 WeakPolarHBondContact O-CB 3.29Å; Q2027-L2030 PolarHBondContact O-N 3.15Å; Q2027-L2030 VanDerWaalsContact O-N 3.15Å; Q2027-Q2031 WeakPolarHBondContact O-CB 3.31Å; Q2027-Q2031 WeakPolarHBondContact O-CG 3.28Å; Q2027-Q2031 PolarHBondContact O-N 3.02Å; Q2027-I2056 VanDerWaalsContact NE2-CG2 3.33Å
2028	M	54.6	Low	52.5	Low	82.8 Å²	82.8	77.3 Å²	77.3	41%	0.408	40%	0.401	S	S	.	.	H	α-helix	trans	-62.8	-42.5	172.7	-173.6	-179.5	69.9	0	0	111.9	P2024 L2025 I2026 L2030 Q2031 C2032 V2840 M2844	P2024-M2028 VanDerWaalsContact O-CB 3.26Å; P2024-M2028 WeakPolarHBondContact O-CB 3.21Å; P2024-M2028 PolarHBondContact O-N 2.98Å; L2025-M2028 HydrophobicContact CD1-CE 3.9Å; L2025-M2028 HydrophobicContact CD2-CE 3.81Å; L2025-M2028 PolarHBondContact O-N 2.67Å; I2026-M2028 VanDerWaalsContact C-N 3.32Å; I2026-M2028 PolarHBondContact O-N 3.06Å; M2028-L2030 VanDerWaalsContact C-N 3.33Å; M2028-L2030 PolarHBondContact O-N 3.36Å; M2028-Q2031 PolarHBondContact O-N 3.08Å; M2028-C2032 WeakPolarHBondContact O-CB 3.31Å; M2028-C2032 PolarHBondContact O-N 3.19Å; M2028-C2032 VanDerWaalsContact O-N 3.08Å; M2028-C2032 PolarHBondContact O-SG 2.98Å; M2028-C2032 VanDerWaalsContact O-SG 3.39Å; M2028-V2840 HydrophobicContact CE-CG1 3.57Å; M2028-M2844 HydrophobicContact CE-CE 4.34Å; M2028-M2844 HydrophobicContact CE-SD 3.34Å; M2028-M2844 WeakPolarHBondContact CE-SD 3.43Å; M2028-M2844 HydrophobicContact CG-CE 3.86Å; M2028-M2844 HydrophobicContact CG-SD 3.98Å; M2028-M2844 HydrophobicContact SD-CE 3.83Å; M2028-M2844 HydrophobicContact SD-SD 3.65Å; M2028-M2844 VanDerWaalsContact SD-SD 3.65Å
2029	L	55	Low	51	Low	48.6 Å²	48.6	78.8 Å²	78.8	25%	0.254	42%	0.421	S	S	.	.	H	α-helix	trans	-64.1	-38.5	174.9	-75	167	0	0	0	112.6	L2025 I2026 Q2027 C2032 M2033 I2059 V2840 M2844 L2887 C2890 I2891 A2894	L2025-L2029 HydrophobicContact CD2-CD1 3.89Å; L2025-L2029 HydrophobicContact CG-CD1 4.39Å; L2025-L2029 WeakPolarHBondContact O-CB 3.24Å; L2025-L2029 VanDerWaalsContact O-CG 3.28Å; L2025-L2029 WeakPolarHBondContact O-CG 3.31Å; L2025-L2029 PolarHBondContact O-N 3.15Å; L2025-L2029 VanDerWaalsContact O-N 3.12Å; I2026-L2029 CarbonylContact O-C 3.6Å; I2026-L2029 WeakPolarHBondContact O-CB 3.39Å; I2026-L2029 PolarHBondContact O-N 3.19Å; Q2027-L2029 PolarHBondContact O-N 2.93Å; L2029-C2032 WeakPolarHBondContact O-CB 3.33Å; L2029-C2032 PolarHBondContact O-N 3.15Å; L2029-M2033 WeakPolarHBondContact O-CB 3.48Å; L2029-M2033 WeakPolarHBondContact O-CG 3.38Å; L2029-M2033 PolarHBondContact O-N 3.1Å; L2029-I2059 HydrophobicContact CB-CD1 3.79Å; L2029-I2059 HydrophobicContact CD1-CD1 4.41Å; L2029-I2059 HydrophobicContact CD1-CG2 4.38Å; L2029-V2840 HydrophobicContact CD1-CB 4.32Å; L2029-V2840 HydrophobicContact CD1-CG1 3.87Å; L2029-V2840 HydrophobicContact CD1-CG2 3.73Å; L2029-V2840 HydrophobicContact CD2-CG1 4.05Å; L2029-V2840 HydrophobicContact CG-CG1 3.75Å; L2029-M2844 HydrophobicContact CD2-CG 4.18Å; L2029-L2887 HydrophobicContact CB-CD1 4.17Å; L2029-L2887 HydrophobicContact CD2-CD1 3.77Å; L2029-C2890 WeakPolarHBondContact CD1-SG 3.46Å; L2029-I2891 HydrophobicContact CB-CG1 3.95Å; L2029-I2891 HydrophobicContact CD1-CG1 4.32Å; L2029-A2894 HydrophobicContact CD1-CB 4.5Å
2030	L	56.4	Low	49.9	Very low	49.8 Å²	49.8	77.4 Å²	77.4	26%	0.261	42%	0.417	S	S	.	.	H	α-helix	trans	-66.6	-39.3	174.7	-98.2	107.7	0	0	0	111.9	D1755 P2022 I2026 Q2027 M2028 C2032 M2033 N2034 F2054 I2056 I2059 I2891	D1755-L2030 HydrophobicContact CB-CD2 4.19Å; D1755-L2030 WeakPolarHBondContact OD2-CD2 3.1Å; P2022-L2030 HydrophobicContact CB-CD1 4.43Å; P2022-L2030 HydrophobicContact CG-CD1 3.97Å; I2026-L2030 HydrophobicContact CG2-CD1 4.16Å; I2026-L2030 HydrophobicContact CG2-CG 4.43Å; I2026-L2030 WeakPolarHBondContact O-CD1 3.37Å; I2026-L2030 VanDerWaalsContact O-CG 3.3Å; I2026-L2030 WeakPolarHBondContact O-CG 3.3Å; I2026-L2030 PolarHBondContact O-N 3.21Å; Q2027-L2030 WeakPolarHBondContact O-CB 3.29Å; Q2027-L2030 PolarHBondContact O-N 3.15Å; Q2027-L2030 VanDerWaalsContact O-N 3.15Å; M2028-L2030 VanDerWaalsContact C-N 3.33Å; M2028-L2030 PolarHBondContact O-N 3.36Å; L2030-C2032 VanDerWaalsContact C-N 3.34Å; L2030-C2032 PolarHBondContact O-N 3.13Å; L2030-M2033 WeakPolarHBondContact O-CA 3.26Å; L2030-M2033 VanDerWaalsContact O-CB 3.24Å; L2030-M2033 WeakPolarHBondContact O-CB 3.38Å; L2030-M2033 PolarHBondContact O-N 3.05Å; L2030-M2033 VanDerWaalsContact O-N 3.1Å; L2030-N2034 PolarHBondContact O-N 3Å; L2030-N2034 VanDerWaalsContact O-N 3.13Å; L2030-N2034 PolarHBondContact O-OD1 2.91Å; L2030-F2054 HydrophobicContact CD2-CB 4.34Å; L2030-I2056 VanDerWaalsContact C-CD1 3.46Å; L2030-I2056 HydrophobicContact CB-CD1 4.18Å; L2030-I2056 HydrophobicContact CD1-CG1 4.47Å; L2030-I2059 HydrophobicContact CD1-CD1 4.48Å; L2030-I2059 HydrophobicContact CD2-CD1 4.18Å; L2030-I2891 HydrophobicContact CD1-CD1 3.86Å; L2030-I2891 HydrophobicContact CD1-CG1 4.42Å; L2030-I2891 HydrophobicContact CD1-CG2 4.4Å
2031	Q	53	Low	48.9	Very low	106.8 Å²	106.8	76.9 Å²	76.9	50%	0.499	41%	0.414	S	S	.	.	H	α-helix	trans	-64.1	-41.1	174.2	-110.7	176.7	-3.1	0	0	112	Q2027 M2028 M2033 N2034 T2035 I2056 E2060	Q2027-Q2031 WeakPolarHBondContact O-CB 3.31Å; Q2027-Q2031 WeakPolarHBondContact O-CG 3.28Å; Q2027-Q2031 PolarHBondContact O-N 3.02Å; M2028-Q2031 PolarHBondContact O-N 3.08Å; Q2031-M2033 VanDerWaalsContact C-N 3.28Å; Q2031-M2033 PolarHBondContact O-N 2.98Å; Q2031-N2034 PolarHBondContact O-N 3.06Å; Q2031-T2035 PolarHBondContact O-N 3.04Å; Q2031-T2035 VanDerWaalsContact O-N 3.09Å; Q2031-T2035 PolarHBondContact O-OG1 2.93Å; Q2031-T2035 VanDerWaalsContact O-OG1 3.14Å; Q2031-I2056 HydrophobicContact CB-CD1 3.72Å; Q2031-I2056 HydrophobicContact CG-CD1 4.14Å; Q2031-I2056 VanDerWaalsContact N-CD1 3.25Å; Q2031-E2060 VanDerWaalsContact NE2-CD 3.3Å; Q2031-E2060 PolarHBondContact NE2-OE1 3.13Å; Q2031-E2060 PolarHBondContact NE2-OE2 3.36Å
2032	C	51.1	Low	47.9	Very low	44.6 Å²	44.6	82.1 Å²	82.1	30%	0.301	44%	0.442	S	S	.	.	H	α-helix	trans	-62.4	-34.2	172.6	-70.4	0	0	0	0	112.8	M2028 L2029 L2030 T2035 Y2036 L2849	M2028-C2032 WeakPolarHBondContact O-CB 3.31Å; M2028-C2032 PolarHBondContact O-N 3.19Å; M2028-C2032 VanDerWaalsContact O-N 3.08Å; M2028-C2032 PolarHBondContact O-SG 2.98Å; M2028-C2032 VanDerWaalsContact O-SG 3.39Å; L2029-C2032 WeakPolarHBondContact O-CB 3.33Å; L2029-C2032 PolarHBondContact O-N 3.15Å; L2030-C2032 VanDerWaalsContact C-N 3.34Å; L2030-C2032 PolarHBondContact O-N 3.13Å; C2032-T2035 WeakPolarHBondContact CA-OG1 3.44Å; C2032-T2035 PolarHBondContact O-N 2.84Å; C2032-T2035 PolarHBondContact O-OG1 2.98Å; C2032-T2035 VanDerWaalsContact O-OG1 3.1Å; C2032-Y2036 WeakPolarHBondContact O-CB 3.28Å; C2032-Y2036 WeakPolarHBondContact O-CD2 3.43Å; C2032-Y2036 PolarHBondContact O-N 3.16Å; C2032-L2849 HydrophobicContact CB-CD1 3.52Å
2033	M	49.8	Very low	47	Very low	74.2 Å²	74.2	86.6 Å²	86.6	37%	0.366	46%	0.462	S	S	.	.	H	α-helix	trans	-69.8	-45.2	176.7	-111.1	-110.2	139.6	0	0	112	L2029 L2030 Q2031 T2035 Y2036 Q2037 F2054 L2887 I2891	L2029-M2033 WeakPolarHBondContact O-CB 3.48Å; L2029-M2033 WeakPolarHBondContact O-CG 3.38Å; L2029-M2033 PolarHBondContact O-N 3.1Å; L2030-M2033 WeakPolarHBondContact O-CA 3.26Å; L2030-M2033 VanDerWaalsContact O-CB 3.24Å; L2030-M2033 WeakPolarHBondContact O-CB 3.38Å; L2030-M2033 PolarHBondContact O-N 3.05Å; L2030-M2033 VanDerWaalsContact O-N 3.1Å; Q2031-M2033 VanDerWaalsContact C-N 3.28Å; Q2031-M2033 PolarHBondContact O-N 2.98Å; M2033-T2035 VanDerWaalsContact C-N 3.29Å; M2033-T2035 PolarHBondContact O-N 2.97Å; M2033-T2035 VanDerWaalsContact O-N 3.17Å; M2033-Y2036 WeakPolarHBondContact O-CB 3.47Å; M2033-Y2036 PolarHBondContact O-N 3.06Å; M2033-Y2036 VanDerWaalsContact O-N 3.17Å; M2033-Q2037 WeakPolarHBondContact O-CB 3.29Å; M2033-Q2037 PolarHBondContact O-N 3.08Å; M2033-F2054 HydrophobicContact CE-CB 3.54Å; M2033-F2054 HydrophobicContact CE-CD1 4.2Å; M2033-F2054 HydrophobicContact CE-CD2 3.56Å; M2033-F2054 HydrophobicContact CE-CE2 4.28Å; M2033-F2054 HydrophobicContact CE-CG 3.51Å; M2033-F2054 HydrophobicContact CG-CB 4.33Å; M2033-F2054 HydrophobicContact SD-CB 3.29Å; M2033-F2054 WeakPolarHBondContact SD-CB 3.48Å; M2033-F2054 HydrophobicContact SD-CD2 4.34Å; M2033-F2054 HydrophobicContact SD-CG 4Å; M2033-L2887 HydrophobicContact CB-CD2 3.67Å; M2033-L2887 HydrophobicContact CB-CG 4.45Å; M2033-L2887 HydrophobicContact CG-CD2 3.8Å; M2033-L2887 HydrophobicContact CG-CG 4.45Å; M2033-I2891 HydrophobicContact SD-CD1 4.03Å
2034	N	47.5	Very low	45.8	Very low	70 Å²	70	90.3 Å²	90.3	37%	0.374	49%	0.485	S	S	.	.	H	α-helix	trans	-65.4	-29.9	178.7	-74.2	-8.8	0	0	0	112.9	L2030 Q2031 Y2036 Q2037 N2038 F2054 I2056	L2030-N2034 PolarHBondContact O-N 3Å; L2030-N2034 VanDerWaalsContact O-N 3.13Å; L2030-N2034 PolarHBondContact O-OD1 2.91Å; Q2031-N2034 PolarHBondContact O-N 3.06Å; N2034-Y2036 VanDerWaalsContact C-N 3.34Å; N2034-Q2037 PolarHBondContact O-N 3.17Å; N2034-N2038 WeakPolarHBondContact O-CB 3.23Å; N2034-N2038 VanDerWaalsContact O-CG 3.3Å; N2034-N2038 PolarHBondContact O-N 2.8Å; N2034-F2054 PolarHBondContact ND2-O 2.93Å; N2034-I2056 WeakPolarHBondContact ND2-CG1 3.34Å; N2034-I2056 PolarHBondContact ND2-N 3.37Å; N2034-I2056 VanDerWaalsContact ND2-N 3.16Å
2035	T	44.9	Very low	44.6	Very low	79.8 Å²	79.8	94.3 Å²	94.3	49%	0.49	50%	0.503	S	S	.	.	H	α-helix	trans	-72.3	-28.7	173.4	40.1	0	0	0	0	113.4	Q2031 C2032 M2033 Q2037 N2038 C2039	Q2031-T2035 PolarHBondContact O-N 3.04Å; Q2031-T2035 VanDerWaalsContact O-N 3.09Å; Q2031-T2035 PolarHBondContact O-OG1 2.93Å; Q2031-T2035 VanDerWaalsContact O-OG1 3.14Å; C2032-T2035 WeakPolarHBondContact CA-OG1 3.44Å; C2032-T2035 PolarHBondContact O-N 2.84Å; C2032-T2035 PolarHBondContact O-OG1 2.98Å; C2032-T2035 VanDerWaalsContact O-OG1 3.1Å; M2033-T2035 VanDerWaalsContact C-N 3.29Å; M2033-T2035 PolarHBondContact O-N 2.97Å; M2033-T2035 VanDerWaalsContact O-N 3.17Å; T2035-Q2037 VanDerWaalsContact C-N 3.33Å; T2035-Q2037 PolarHBondContact O-N 2.95Å; T2035-N2038 PolarHBondContact O-N 3.44Å; T2035-C2039 PolarHBondContact O-N 3.01Å; T2035-C2039 PolarHBondContact O-SG 3.3Å; T2035-C2039 VanDerWaalsContact O-SG 3.38Å
2036	Y	42.5	Very low	43.3	Very low	145 Å²	145	98.1 Å²	98.1	57%	0.569	52%	0.524	S	S	*	.	H	α-helix	trans	-75.1	-28.5	177.6	-110.9	-80.9	0	0	0	113.6	C2032 M2033 N2034 N2038 C2039 T2040 L2849 L2883	C2032-Y2036 WeakPolarHBondContact O-CB 3.28Å; C2032-Y2036 WeakPolarHBondContact O-CD2 3.43Å; C2032-Y2036 PolarHBondContact O-N 3.16Å; M2033-Y2036 WeakPolarHBondContact O-CB 3.47Å; M2033-Y2036 PolarHBondContact O-N 3.06Å; M2033-Y2036 VanDerWaalsContact O-N 3.17Å; N2034-Y2036 VanDerWaalsContact C-N 3.34Å; Y2036-N2038 PolarHBondContact O-N 3.44Å; Y2036-C2039 PolarHBondContact O-N 3.12Å; Y2036-T2040 PolarHBondContact O-N 3.22Å; Y2036-L2849 HydrophobicContact CD2-CD2 4.42Å; Y2036-L2883 VanDerWaalsContact OH-CD1 3.23Å; Y2036-L2883 WeakPolarHBondContact OH-CD1 3.44Å
2037	Q	41.7	Very low	42.1	Very low	115.4 Å²	115.4	104.7 Å²	104.7	54%	0.539	55%	0.553	S	S	.	*	H	α-helix	trans	-76.7	-19.7	-179.7	-113.5	171	-27.5	0	0	113.7	M2033 N2034 T2035 C2039 T2040 N2041 N2053 I2056	M2033-Q2037 WeakPolarHBondContact O-CB 3.29Å; M2033-Q2037 PolarHBondContact O-N 3.08Å; N2034-Q2037 PolarHBondContact O-N 3.17Å; T2035-Q2037 VanDerWaalsContact C-N 3.33Å; T2035-Q2037 PolarHBondContact O-N 2.95Å; Q2037-C2039 VanDerWaalsContact C-N 3.33Å; Q2037-C2039 PolarHBondContact O-N 3.24Å; Q2037-T2040 WeakPolarHBondContact CA-OG1 3.32Å; Q2037-T2040 PolarHBondContact O-N 3.13Å; Q2037-T2040 VanDerWaalsContact O-N 3.15Å; Q2037-T2040 PolarHBondContact O-OG1 2.81Å; Q2037-N2041 PolarHBondContact O-N 2.96Å; Q2037-N2053 PolarHBondContact NE2-OD1 2.98Å; Q2037-N2053 VanDerWaalsContact NE2-OD1 3.14Å; Q2037-I2056 VanDerWaalsContact NE2-CD1 3.32Å
2038	N	37.2	Very low	40.7	Very low	119.4 Å²	119.4	110.3 Å²	110.3	64%	0.639	58%	0.58	S	S	*	*	H	α-helix	trans	-83.8	-12.7	176.4	-74.7	-18	0	0	0	113.5	N2034 T2035 Y2036 T2040 N2041	N2034-N2038 WeakPolarHBondContact O-CB 3.23Å; N2034-N2038 VanDerWaalsContact O-CG 3.3Å; N2034-N2038 PolarHBondContact O-N 2.8Å; T2035-N2038 PolarHBondContact O-N 3.44Å; Y2036-N2038 PolarHBondContact O-N 3.44Å; N2038-T2040 PolarHBondContact O-N 3.12Å; N2038-T2040 VanDerWaalsContact O-N 3.08Å; N2038-N2041 PolarHBondContact O-N 3.33Å; N2038-N2041 VanDerWaalsContact O-N 3.09Å
2039	C	34	Very low	39.5	Very low	102.6 Å²	102.6	113.1 Å²	113.1	69%	0.693	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	11.7	-179.2	-65.4	0	0	0	0	114.5	T2035 Y2036 Q2037	T2035-C2039 PolarHBondContact O-N 3.01Å; T2035-C2039 PolarHBondContact O-SG 3.3Å; T2035-C2039 VanDerWaalsContact O-SG 3.38Å; Y2036-C2039 PolarHBondContact O-N 3.12Å; Q2037-C2039 VanDerWaalsContact C-N 3.33Å; Q2037-C2039 PolarHBondContact O-N 3.24Å
2040	T	35.3	Very low	38.2	Very low	91.2 Å²	91.2	117.8 Å²	117.8	56%	0.56	62%	0.621	S	S	*	*			trans	-119.9	36.7	173.3	55	0	0	0	0	112.3	Y2036 Q2037 N2038 D2042 I2043	Y2036-T2040 PolarHBondContact O-N 3.22Å; Q2037-T2040 WeakPolarHBondContact CA-OG1 3.32Å; Q2037-T2040 PolarHBondContact O-N 3.13Å; Q2037-T2040 VanDerWaalsContact O-N 3.15Å; Q2037-T2040 PolarHBondContact O-OG1 2.81Å; N2038-T2040 PolarHBondContact O-N 3.12Å; N2038-T2040 VanDerWaalsContact O-N 3.08Å; T2040-D2042 VanDerWaalsContact C-N 3.28Å; T2040-D2042 PolarHBondContact O-N 3.27Å; T2040-I2043 PolarHBondContact O-N 3.19Å; T2040-I2043 VanDerWaalsContact O-N 3.1Å
2041	N	34.2	Very low	36.9	Very low	139.6 Å²	139.6	123.1 Å²	123.1	75%	0.747	64%	0.644	S	S	*	*			trans	-118.7	41.7	170	-82	-22.3	0	0	0	110.1	Q2037 N2038 I2043	Q2037-N2041 PolarHBondContact O-N 2.96Å; N2038-N2041 PolarHBondContact O-N 3.33Å; N2038-N2041 VanDerWaalsContact O-N 3.09Å; N2041-I2043 PolarHBondContact O-N 3.08Å; N2041-I2043 VanDerWaalsContact O-N 3.1Å
2042	D	33	Very low	35.7	Very low	156 Å²	156	126.2 Å²	126.2	83%	0.834	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.1	94.6	160.1	-84.8	-29.8	0	0	0	111.7	T2040	T2040-D2042 VanDerWaalsContact C-N 3.28Å; T2040-D2042 PolarHBondContact O-N 3.27Å
2043	I	34.8	Very low	34.7	Very low	148.6 Å²	148.6	130 Å²	130	76%	0.762	68%	0.676	S	S	*	*	S	Bend	trans	123.2	79.9	172.5	-52.8	173.9	0	0	0	115	T2040 N2041 N2045	T2040-I2043 PolarHBondContact O-N 3.19Å; T2040-I2043 VanDerWaalsContact O-N 3.1Å; N2041-I2043 PolarHBondContact O-N 3.08Å; N2041-I2043 VanDerWaalsContact O-N 3.1Å; I2043-N2045 PolarHBondContact O-N 3.07Å
2044	S	30.8	Very low	33.7	Very low	94.4 Å²	94.4	134.2 Å²	134.2	66%	0.66	69%	0.692	S	S	*	*			trans	47.1	118.5	154.2	68.5	0	0	0	0	117.8	N2046	S2044-N2046 PolarHBondContact O-N 2.78Å
2045	N	31.1	Very low	33	Very low	149.2 Å²	149.2	133.9 Å²	133.9	80%	0.798	70%	0.695	S	S	*	*			trans	131	118.4	146.4	-70	-31.9	0	0	0	112.5	I2043 H2047	I2043-N2045 PolarHBondContact O-N 3.07Å; N2045-H2047 PolarHBondContact O-N 2.75Å; N2045-H2047 VanDerWaalsContact O-N 3.1Å
2046	N	28.7	Very low	32.6	Very low	146.6 Å²	146.6	133.6 Å²	133.6	78%	0.784	69%	0.69	S	S	*	*			trans	81.6	100.3	147.4	-79.8	-25.5	0	0	0	115.3	S2044	S2044-N2046 PolarHBondContact O-N 2.78Å
2047	H	32.7	Very low	32.2	Very low	171.2 Å²	171.2	131.3 Å²	131.3	79%	0.793	68%	0.684	S	S	*	*			trans	-174.2	132.6	132.5	-101.1	-69.8	0	0	0	112.5	N2045 L2049	N2045-H2047 PolarHBondContact O-N 2.75Å; N2045-H2047 VanDerWaalsContact O-N 3.1Å; H2047-L2049 VanDerWaalsContact C-N 3.27Å; H2047-L2049 PolarHBondContact O-N 2.97Å
2048	Q	27.1	Very low	31.9	Very low	180.4 Å²	180.4	130.4 Å²	130.4	84%	0.843	68%	0.683	S	S	*	*			trans	-82.2	106.2	177.7	-80.8	175.1	-17.9	0	0	109.8
2049	L	28.8	Very low	31.9	Very low	140.8 Å²	140.8	127.7 Å²	127.7	74%	0.737	67%	0.668	S	S	*	*			trans	-117.9	118.1	161	-84	162.4	0	0	0	109.9	H2047 H2051	H2047-L2049 VanDerWaalsContact C-N 3.27Å; H2047-L2049 PolarHBondContact O-N 2.97Å; L2049-H2051 PolarHBondContact O-N 3.06Å; L2049-H2051 VanDerWaalsContact O-N 3.12Å
2050	N	27.5	Very low	32	Very low	148.2 Å²	148.2	127.3 Å²	127.3	79%	0.793	66%	0.656	S	S	*	*			trans	-79.1	113.9	175.9	-83.7	-26.8	0	0	0	111.2	H2052	N2050-H2052 VanDerWaalsContact C-N 3.26Å; N2050-H2052 PolarHBondContact O-N 2.93Å
2051	H	28.3	Very low	32	Very low	161.8 Å²	161.8	128.2 Å²	128.2	75%	0.749	65%	0.654	S	S	*	*			trans	-72.1	124	168.1	-75.2	-70.9	0	0	0	112.3	L2049 N2053	L2049-H2051 PolarHBondContact O-N 3.06Å; L2049-H2051 VanDerWaalsContact O-N 3.12Å; H2051-N2053 PolarHBondContact ND1-OD1 3.1Å; H2051-N2053 PolarHBondContact O-N 3.11Å
2052	H	28.7	Very low	32	Very low	171 Å²	171	127 Å²	127	79%	0.792	65%	0.647	S	S	*	*			trans	-80.4	114.7	158.1	-100.3	-62.1	0	0	0	110.2	N2050 F2054	N2050-H2052 VanDerWaalsContact C-N 3.26Å; N2050-H2052 PolarHBondContact O-N 2.93Å; H2052-F2054 PolarHBondContact O-N 3.18Å
2053	N	29.6	Very low	32.1	Very low	125.2 Å²	125.2	123.9 Å²	123.9	67%	0.67	63%	0.63	S	S	*	*			trans	-51.2	109.1	152.8	-77	-5.8	0	0	0	109.3	Q2037 H2051 S2055	Q2037-N2053 PolarHBondContact NE2-OD1 2.98Å; Q2037-N2053 VanDerWaalsContact NE2-OD1 3.14Å; H2051-N2053 PolarHBondContact ND1-OD1 3.1Å; H2051-N2053 PolarHBondContact O-N 3.11Å; N2053-S2055 VanDerWaalsContact C-N 3.3Å; N2053-S2055 PolarHBondContact O-N 3.17Å; N2053-S2055 VanDerWaalsContact O-N 3.14Å
2054	F	29.2	Very low	32.1	Very low	162.8 Å²	162.8	121.5 Å²	121.5	71%	0.714	62%	0.622	S	S	*	*			trans	-76.8	124.3	157.9	-95.1	-84.4	0	0	0	108.4	L2030 M2033 N2034 H2052 I2056 D2058	L2030-F2054 HydrophobicContact CD2-CB 4.34Å; M2033-F2054 HydrophobicContact CE-CB 3.54Å; M2033-F2054 HydrophobicContact CE-CD1 4.2Å; M2033-F2054 HydrophobicContact CE-CD2 3.56Å; M2033-F2054 HydrophobicContact CE-CE2 4.28Å; M2033-F2054 HydrophobicContact CE-CG 3.51Å; M2033-F2054 HydrophobicContact CG-CB 4.33Å; M2033-F2054 HydrophobicContact SD-CB 3.29Å; M2033-F2054 WeakPolarHBondContact SD-CB 3.48Å; M2033-F2054 HydrophobicContact SD-CD2 4.34Å; M2033-F2054 HydrophobicContact SD-CG 4Å; N2034-F2054 PolarHBondContact ND2-O 2.93Å; H2052-F2054 PolarHBondContact O-N 3.18Å; F2054-I2056 PolarHBondContact O-N 2.83Å; F2054-D2058 HydrophobicContact CD1-CB 3.95Å; F2054-D2058 HydrophobicContact CE1-CB 4.33Å
2055	S	32.4	Very low	32.3	Very low	61.8 Å²	61.8	124.7 Å²	124.7	43%	0.432	63%	0.627	S	S	.	*			trans	-85.6	152.9	175.1	-170.1	0	0	0	0	110.3	N2053 H2057 D2058	N2053-S2055 VanDerWaalsContact C-N 3.3Å; N2053-S2055 PolarHBondContact O-N 3.17Å; N2053-S2055 VanDerWaalsContact O-N 3.14Å; S2055-H2057 VanDerWaalsContact C-N 3.28Å; S2055-H2057 PolarHBondContact O-N 3.17Å; S2055-H2057 PolarHBondContact OG-N 2.9Å; S2055-D2058 PolarHBondContact N-OD2 2.95Å; S2055-D2058 VanDerWaalsContact N-OD2 3.11Å; S2055-D2058 WeakPolarHBondContact O-CB 3.43Å; S2055-D2058 PolarHBondContact O-N 3Å
2056	I	36.7	Very low	32.7	Very low	73.8 Å²	73.8	123.3 Å²	123.3	38%	0.378	62%	0.616	S	S	.	*	H	α-helix	trans	-83.5	-15.3	175.5	-68	171.9	0	0	0	111.6	Q2027 L2030 Q2031 N2034 Q2037 F2054 D2058 I2059 E2060	Q2027-I2056 VanDerWaalsContact NE2-CG2 3.33Å; L2030-I2056 VanDerWaalsContact C-CD1 3.46Å; L2030-I2056 HydrophobicContact CB-CD1 4.18Å; L2030-I2056 HydrophobicContact CD1-CG1 4.47Å; Q2031-I2056 HydrophobicContact CB-CD1 3.72Å; Q2031-I2056 HydrophobicContact CG-CD1 4.14Å; Q2031-I2056 VanDerWaalsContact N-CD1 3.25Å; N2034-I2056 WeakPolarHBondContact ND2-CG1 3.34Å; N2034-I2056 PolarHBondContact ND2-N 3.37Å; N2034-I2056 VanDerWaalsContact ND2-N 3.16Å; Q2037-I2056 VanDerWaalsContact NE2-CD1 3.32Å; F2054-I2056 PolarHBondContact O-N 2.83Å; I2056-D2058 VanDerWaalsContact C-N 3.33Å; I2056-D2058 PolarHBondContact O-N 2.61Å; I2056-I2059 HydrophobicContact CG1-CB 4.48Å; I2056-I2059 HydrophobicContact CG1-CD1 4.06Å; I2056-I2059 WeakPolarHBondContact O-CB 3.49Å; I2056-I2059 PolarHBondContact O-N 2.96Å; I2056-E2060 PolarHBondContact O-N 3.05Å
2057	H	34.7	Very low	33.1	Very low	97.2 Å²	97.2	121.5 Å²	121.5	45%	0.45	60%	0.604	S	S	.	*	H	α-helix	trans	-58.6	-18.4	171	-77.7	-72.6	0	0	0	114.7	Q1759 W1836 S2055 I2059 E2060 Q2061	Q1759-H2057 PolarHBondContact OE1-CD2 2.89Å; W1836-H2057 AromaticContact CD2-NE2 3.94Å; W1836-H2057 AromaticContact CE2-NE2 3.6Å; W1836-H2057 AromaticContact CH2-NE2 3.7Å; W1836-H2057 AromaticContact CZ2-NE2 3.99Å; W1836-H2057 AromaticContact NE1-NE2 3.65Å; S2055-H2057 VanDerWaalsContact C-N 3.28Å; S2055-H2057 PolarHBondContact O-N 3.17Å; S2055-H2057 PolarHBondContact OG-N 2.9Å; H2057-I2059 VanDerWaalsContact C-N 3.29Å; H2057-I2059 PolarHBondContact O-N 2.97Å; H2057-I2059 VanDerWaalsContact O-N 3.15Å; H2057-E2060 IonicContact CE1-OE2 3.81Å; H2057-E2060 PolarHBondContact CE1-OE2 2.95Å; H2057-E2060 IonicContact ND1-OE2 3.8Å; H2057-E2060 PolarHBondContact ND1-OE2 3.27Å; H2057-E2060 CarbonylContact O-C 3.54Å; H2057-E2060 WeakPolarHBondContact O-CA 3.28Å; H2057-E2060 WeakPolarHBondContact O-CB 3.33Å; H2057-E2060 PolarHBondContact O-N 3.38Å; H2057-Q2061 WeakPolarHBondContact O-CB 3.35Å; H2057-Q2061 PolarHBondContact O-N 3.1Å; H2057-Q2061 VanDerWaalsContact O-N 3.07Å
2058	D	34.5	Very low	33.3	Very low	95.6 Å²	95.6	119.4 Å²	119.4	51%	0.511	60%	0.598	S	S	.	*	H	α-helix	trans	-82.4	-7.2	165.5	-63.6	-21.6	0	0	0	111.4	F2054 S2055 I2056 E2060 Q2061 L2062	F2054-D2058 HydrophobicContact CD1-CB 3.95Å; F2054-D2058 HydrophobicContact CE1-CB 4.33Å; S2055-D2058 PolarHBondContact N-OD2 2.95Å; S2055-D2058 VanDerWaalsContact N-OD2 3.11Å; S2055-D2058 WeakPolarHBondContact O-CB 3.43Å; S2055-D2058 PolarHBondContact O-N 3Å; I2056-D2058 VanDerWaalsContact C-N 3.33Å; I2056-D2058 PolarHBondContact O-N 2.61Å; D2058-E2060 VanDerWaalsContact C-N 3.28Å; D2058-E2060 PolarHBondContact O-N 3.01Å; D2058-Q2061 PolarHBondContact O-N 3.06Å; D2058-L2062 WeakPolarHBondContact O-CB 3.49Å; D2058-L2062 PolarHBondContact O-N 2.84Å
2059	I	37.2	Very low	34	Very low	64.6 Å²	64.6	116.6 Å²	116.6	33%	0.331	59%	0.589	S	S	.	*	H	α-helix	trans	-96.1	-24.1	164.7	-60.3	177	0	0	0	111.7	L2029 L2030 I2056 H2057 Q2061 L2062 D2063	L2029-I2059 HydrophobicContact CB-CD1 3.79Å; L2029-I2059 HydrophobicContact CD1-CD1 4.41Å; L2029-I2059 HydrophobicContact CD1-CG2 4.38Å; L2030-I2059 HydrophobicContact CD1-CD1 4.48Å; L2030-I2059 HydrophobicContact CD2-CD1 4.18Å; I2056-I2059 HydrophobicContact CG1-CB 4.48Å; I2056-I2059 HydrophobicContact CG1-CD1 4.06Å; I2056-I2059 WeakPolarHBondContact O-CB 3.49Å; I2056-I2059 PolarHBondContact O-N 2.96Å; H2057-I2059 VanDerWaalsContact C-N 3.29Å; H2057-I2059 PolarHBondContact O-N 2.97Å; H2057-I2059 VanDerWaalsContact O-N 3.15Å; I2059-Q2061 VanDerWaalsContact C-N 3.27Å; I2059-L2062 VanDerWaalsContact O-CB 3.25Å; I2059-L2062 WeakPolarHBondContact O-CB 3.44Å; I2059-L2062 PolarHBondContact O-N 3.06Å; I2059-D2063 PolarHBondContact O-N 2.87Å
2060	E	36.5	Very low	34.9	Very low	93.6 Å²	93.6	114.2 Å²	114.2	44%	0.437	58%	0.577	S	S	.	*	H	α-helix	trans	-67.6	-27.7	168.3	-66.2	-172.6	160.2	0	0	114.9	R1904 Q2031 I2056 H2057 D2058 L2062 D2063 T2064	R1904-E2060 IonicContact CZ-OE1 2.86Å; R1904-E2060 IonicContact NH1-OE1 3.78Å; R1904-E2060 PolarHBondContact NH1-OE1 3.07Å; R1904-E2060 IonicContact NH2-OE1 3.39Å; R1904-E2060 PolarHBondContact NH2-OE1 3.18Å; Q2031-E2060 VanDerWaalsContact NE2-CD 3.3Å; Q2031-E2060 PolarHBondContact NE2-OE1 3.13Å; Q2031-E2060 PolarHBondContact NE2-OE2 3.36Å; I2056-E2060 PolarHBondContact O-N 3.05Å; H2057-E2060 IonicContact CE1-OE2 3.81Å; H2057-E2060 PolarHBondContact CE1-OE2 2.95Å; H2057-E2060 IonicContact ND1-OE2 3.8Å; H2057-E2060 PolarHBondContact ND1-OE2 3.27Å; H2057-E2060 CarbonylContact O-C 3.54Å; H2057-E2060 WeakPolarHBondContact O-CA 3.28Å; H2057-E2060 WeakPolarHBondContact O-CB 3.33Å; H2057-E2060 PolarHBondContact O-N 3.38Å; D2058-E2060 VanDerWaalsContact C-N 3.28Å; D2058-E2060 PolarHBondContact O-N 3.01Å; E2060-L2062 PolarHBondContact O-N 3.05Å; E2060-D2063 WeakPolarHBondContact O-CB 3.35Å; E2060-D2063 PolarHBondContact O-N 2.88Å; E2060-T2064 PolarHBondContact O-N 2.94Å; E2060-T2064 PolarHBondContact O-OG1 3.01Å
2061	Q	35	Very low	36.1	Very low	110 Å²	110	112 Å²	112	51%	0.514	57%	0.565	S	S	.	*	H	α-helix	trans	-64.6	-21	172.9	-109.9	174.8	6.4	0	0	113.6	D1832 H2057 D2058 I2059 D2063 T2064 E2065	D1832-Q2061 PolarHBondContact OD1-NE2 3.22Å; H2057-Q2061 WeakPolarHBondContact O-CB 3.35Å; H2057-Q2061 PolarHBondContact O-N 3.1Å; H2057-Q2061 VanDerWaalsContact O-N 3.07Å; D2058-Q2061 PolarHBondContact O-N 3.06Å; I2059-Q2061 VanDerWaalsContact C-N 3.27Å; Q2061-D2063 PolarHBondContact O-N 3Å; Q2061-D2063 VanDerWaalsContact O-N 3.11Å; Q2061-T2064 VanDerWaalsContact CA-OG1 3.3Å; Q2061-T2064 WeakPolarHBondContact CA-OG1 3.43Å; Q2061-T2064 WeakPolarHBondContact O-CA 3.49Å; Q2061-T2064 WeakPolarHBondContact O-CB 3.28Å; Q2061-T2064 PolarHBondContact O-N 3.16Å; Q2061-T2064 PolarHBondContact O-OG1 3.18Å; Q2061-E2065 HydrophobicContact CG-CG 4.2Å; Q2061-E2065 WeakPolarHBondContact CG-OE1 3.47Å; Q2061-E2065 PolarHBondContact NE2-OE1 2.82Å; Q2061-E2065 WeakPolarHBondContact O-CB 3.3Å; Q2061-E2065 WeakPolarHBondContact O-CG 3.43Å; Q2061-E2065 PolarHBondContact O-N 3.2Å
2062	L	34.2	Very low	38	Very low	114.2 Å²	114.2	108.7 Å²	108.7	60%	0.598	55%	0.549	S	S	*	.	H	α-helix	trans	-79.8	-32.5	167.1	-147.6	78.1	0	0	0	112.8	L2021 D2058 I2059 E2060 T2064 E2065 E2066	L2021-L2062 HydrophobicContact CD1-CD2 4.35Å; D2058-L2062 WeakPolarHBondContact O-CB 3.49Å; D2058-L2062 PolarHBondContact O-N 2.84Å; I2059-L2062 VanDerWaalsContact O-CB 3.25Å; I2059-L2062 WeakPolarHBondContact O-CB 3.44Å; I2059-L2062 PolarHBondContact O-N 3.06Å; E2060-L2062 PolarHBondContact O-N 3.05Å; L2062-T2064 VanDerWaalsContact C-N 3.27Å; L2062-T2064 PolarHBondContact O-N 3.17Å; L2062-E2065 PolarHBondContact O-N 2.81Å; L2062-E2066 HydrophobicContact CD1-CG 4.38Å; L2062-E2066 HydrophobicContact CG-CG 4.06Å; L2062-E2066 VanDerWaalsContact O-CB 3.26Å; L2062-E2066 WeakPolarHBondContact O-CB 3.39Å; L2062-E2066 VanDerWaalsContact O-CG 3.3Å; L2062-E2066 WeakPolarHBondContact O-CG 3.25Å; L2062-E2066 PolarHBondContact O-N 2.85Å; L2062-E2066 VanDerWaalsContact O-N 3.14Å
2063	D	35	Very low	40.2	Very low	91.8 Å²	91.8	101.1 Å²	101.1	49%	0.491	52%	0.516	S	S	.	.	H	α-helix	trans	-68.7	11.3	173.4	-76.2	-24.9	0	0	0	115	R2016 R2018 I2059 E2060 Q2061 E2065 E2066 M2067	R2016-D2063 IonicContact CZ-OD1 2.66Å; R2016-D2063 IonicContact NH1-OD1 2.73Å; R2016-D2063 PolarHBondContact NH1-OD1 2.74Å; R2018-D2063 IonicContact CZ-OD1 2.66Å; R2018-D2063 IonicContact CZ-OD2 2.65Å; R2018-D2063 IonicContact NH1-OD1 3.06Å; R2018-D2063 IonicContact NH1-OD2 3.11Å; R2018-D2063 PolarHBondContact NH1-OD2 3.4Å; R2018-D2063 IonicContact NH2-OD1 3.91Å; R2018-D2063 PolarHBondContact NH2-OD1 2.85Å; R2018-D2063 IonicContact NH2-OD2 2.96Å; R2018-D2063 PolarHBondContact NH2-OD2 3.25Å; I2059-D2063 PolarHBondContact O-N 2.87Å; E2060-D2063 WeakPolarHBondContact O-CB 3.35Å; E2060-D2063 PolarHBondContact O-N 2.88Å; Q2061-D2063 PolarHBondContact O-N 3Å; Q2061-D2063 VanDerWaalsContact O-N 3.11Å; D2063-E2065 PolarHBondContact O-N 2.85Å; D2063-E2066 PolarHBondContact O-N 3.13Å; D2063-M2067 VanDerWaalsContact O-CB 3.25Å; D2063-M2067 WeakPolarHBondContact O-CB 3.27Å; D2063-M2067 WeakPolarHBondContact O-CG 3.29Å
2064	T	35.3	Very low	42.7	Very low	97.4 Å²	97.4	96.7 Å²	96.7	60%	0.598	49%	0.491	S	S	*	.	H	α-helix	trans	-91.9	-31.6	162.5	13.7	0	0	0	0	113.4	E2060 Q2061 L2062 E2066 M2067 N2068	E2060-T2064 PolarHBondContact O-N 2.94Å; E2060-T2064 PolarHBondContact O-OG1 3.01Å; Q2061-T2064 VanDerWaalsContact CA-OG1 3.3Å; Q2061-T2064 WeakPolarHBondContact CA-OG1 3.43Å; Q2061-T2064 WeakPolarHBondContact O-CA 3.49Å; Q2061-T2064 WeakPolarHBondContact O-CB 3.28Å; Q2061-T2064 PolarHBondContact O-N 3.16Å; Q2061-T2064 PolarHBondContact O-OG1 3.18Å; L2062-T2064 VanDerWaalsContact C-N 3.27Å; L2062-T2064 PolarHBondContact O-N 3.17Å; T2064-E2066 PolarHBondContact O-N 3.39Å; T2064-M2067 CarbonylContact O-C 3.5Å; T2064-M2067 VanDerWaalsContact O-CB 3.23Å; T2064-M2067 WeakPolarHBondContact O-CB 3.23Å; T2064-M2067 PolarHBondContact O-N 3.17Å; T2064-M2067 VanDerWaalsContact O-N 3.12Å; T2064-N2068 PolarHBondContact O-N 3.35Å; T2064-N2068 VanDerWaalsContact O-N 3.14Å
2065	E	36.1	Very low	45.6	Very low	162.2 Å²	162.2	90 Å²	90	76%	0.758	46%	0.462	S	S	*	.	H	α-helix	trans	-75.8	-19	177.2	-68.1	-139.2	159.5	0	0	112.3	Q2061 L2062 D2063 M2067 N2068 N2069	Q2061-E2065 HydrophobicContact CG-CG 4.2Å; Q2061-E2065 WeakPolarHBondContact CG-OE1 3.47Å; Q2061-E2065 PolarHBondContact NE2-OE1 2.82Å; Q2061-E2065 WeakPolarHBondContact O-CB 3.3Å; Q2061-E2065 WeakPolarHBondContact O-CG 3.43Å; Q2061-E2065 PolarHBondContact O-N 3.2Å; L2062-E2065 PolarHBondContact O-N 2.81Å; D2063-E2065 PolarHBondContact O-N 2.85Å; E2065-M2067 VanDerWaalsContact C-N 3.27Å; E2065-M2067 PolarHBondContact O-N 2.94Å; E2065-N2068 WeakPolarHBondContact O-CB 3.41Å; E2065-N2068 PolarHBondContact O-N 3.09Å; E2065-N2068 VanDerWaalsContact O-N 3.09Å; E2065-N2069 PolarHBondContact O-ND2 2.83Å
2066	E	37.8	Very low	48.2	Very low	119 Å²	119	89.5 Å²	89.5	56%	0.556	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	2.2	170.5	-76.1	-164.7	169.1	0	0	112.9	R2016 R2018 L2062 D2063 T2064 N2068 N2069 D2070	R2016-E2066 PolarHBondContact NH2-O 3.14Å; R2018-E2066 WeakPolarHBondContact CD-OE1 3.26Å; R2018-E2066 WeakPolarHBondContact CG-OE1 3.39Å; R2018-E2066 IonicContact CZ-OE1 2.72Å; R2018-E2066 IonicContact CZ-OE2 2.76Å; R2018-E2066 VanDerWaalsContact NE-CD 3.28Å; R2018-E2066 IonicContact NE-OE1 3.89Å; R2018-E2066 PolarHBondContact NE-OE1 2.75Å; R2018-E2066 VanDerWaalsContact NE-OE1 3.08Å; R2018-E2066 IonicContact NE-OE2 3.68Å; R2018-E2066 PolarHBondContact NE-OE2 2.75Å; R2018-E2066 IonicContact NH2-OE1 3.83Å; R2018-E2066 IonicContact NH2-OE2 3.76Å; R2018-E2066 PolarHBondContact NH2-OE2 2.93Å; L2062-E2066 HydrophobicContact CD1-CG 4.38Å; L2062-E2066 HydrophobicContact CG-CG 4.06Å; L2062-E2066 VanDerWaalsContact O-CB 3.26Å; L2062-E2066 WeakPolarHBondContact O-CB 3.39Å; L2062-E2066 VanDerWaalsContact O-CG 3.3Å; L2062-E2066 WeakPolarHBondContact O-CG 3.25Å; L2062-E2066 PolarHBondContact O-N 2.85Å; L2062-E2066 VanDerWaalsContact O-N 3.14Å; D2063-E2066 PolarHBondContact O-N 3.13Å; T2064-E2066 PolarHBondContact O-N 3.39Å; E2066-N2068 PolarHBondContact O-N 2.96Å; E2066-N2069 PolarHBondContact O-N 2.81Å; E2066-D2070 PolarHBondContact O-N 2.8Å
2067	M	37.7	Very low	50.8	Low	109 Å²	109	86.3 Å²	86.3	54%	0.537	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	0.4	-177.5	-109.7	-169.4	104.5	0	0	113.5	D2063 T2064 E2065 N2069 D2070 I2071	D2063-M2067 VanDerWaalsContact O-CB 3.25Å; D2063-M2067 WeakPolarHBondContact O-CB 3.27Å; D2063-M2067 WeakPolarHBondContact O-CG 3.29Å; T2064-M2067 CarbonylContact O-C 3.5Å; T2064-M2067 VanDerWaalsContact O-CB 3.23Å; T2064-M2067 WeakPolarHBondContact O-CB 3.23Å; T2064-M2067 PolarHBondContact O-N 3.17Å; T2064-M2067 VanDerWaalsContact O-N 3.12Å; E2065-M2067 VanDerWaalsContact C-N 3.27Å; E2065-M2067 PolarHBondContact O-N 2.94Å; M2067-N2069 VanDerWaalsContact C-N 3.31Å; M2067-N2069 PolarHBondContact O-N 3.03Å; M2067-D2070 HydrophobicContact CG-CB 4.24Å; M2067-D2070 PolarHBondContact O-N 2.79Å; M2067-I2071 HydrophobicContact CE-CD1 4.04Å; M2067-I2071 WeakPolarHBondContact O-CG1 3.35Å; M2067-I2071 HydrophobicContact SD-CD1 4.13Å
2068	N	37.4	Very low	53.3	Low	126 Å²	126	83.9 Å²	83.9	67%	0.674	43%	0.431	S	S	*	.			trans	-77.7	4.1	-180	-119.2	17.4	0	0	0	113.2	T2064 E2065 E2066 D2070 I2071	T2064-N2068 PolarHBondContact O-N 3.35Å; T2064-N2068 VanDerWaalsContact O-N 3.14Å; E2065-N2068 WeakPolarHBondContact O-CB 3.41Å; E2065-N2068 PolarHBondContact O-N 3.09Å; E2065-N2068 VanDerWaalsContact O-N 3.09Å; E2066-N2068 PolarHBondContact O-N 2.96Å; N2068-D2070 VanDerWaalsContact C-N 3.32Å; N2068-D2070 PolarHBondContact O-N 3.04Å; N2068-I2071 HydrophobicContact CB-CD1 4.36Å; N2068-I2071 WeakPolarHBondContact O-CG1 3.46Å; N2068-I2071 PolarHBondContact O-N 3.35Å; N2068-I2071 VanDerWaalsContact OD1-CD1 3.29Å; N2068-I2071 WeakPolarHBondContact OD1-CD1 3.1Å
2069	N	41.3	Very low	56	Low	122.6 Å²	122.6	80.6 Å²	80.6	66%	0.656	41%	0.414	S	S	*	.			trans	-76.8	54.5	170.9	-76.7	-39.2	0	0	0	111	E2065 E2066 M2067 I2071 E2072	E2065-N2069 PolarHBondContact O-ND2 2.83Å; E2066-N2069 PolarHBondContact O-N 2.81Å; M2067-N2069 VanDerWaalsContact C-N 3.31Å; M2067-N2069 PolarHBondContact O-N 3.03Å; N2069-I2071 HydrophobicContact CB-CB 4.28Å; N2069-I2071 HydrophobicContact CB-CD1 4.27Å; N2069-I2071 HydrophobicContact CB-CG1 4.21Å; N2069-I2071 PolarHBondContact O-N 2.98Å; N2069-E2072 PolarHBondContact O-N 3.2Å
2070	D	47.2	Very low	58.6	Low	90.4 Å²	90.4	79.4 Å²	79.4	48%	0.483	41%	0.408	S	S	.	.			trans	-72.3	23.1	177.7	-83.1	-35.2	0	0	0	113	H2014 R2016 E2066 M2067 N2068 E2072 A2073	H2014-D2070 PolarHBondContact CE1-O 2.8Å; H2014-D2070 PolarHBondContact ND1-O 3.36Å; R2016-D2070 IonicContact CZ-OD1 2.71Å; R2016-D2070 IonicContact CZ-OD2 3.56Å; R2016-D2070 VanDerWaalsContact CZ-OD2 3.26Å; R2016-D2070 IonicContact NE-OD1 2.71Å; R2016-D2070 PolarHBondContact NE-OD1 3.07Å; R2016-D2070 IonicContact NE-OD2 3.79Å; R2016-D2070 PolarHBondContact NE-OD2 2.98Å; R2016-D2070 VanDerWaalsContact NE-OD2 3.09Å; R2016-D2070 IonicContact NH2-OD1 3.12Å; R2016-D2070 IonicContact NH2-OD2 3.68Å; R2016-D2070 PolarHBondContact NH2-OD2 2.95Å; E2066-D2070 PolarHBondContact O-N 2.8Å; M2067-D2070 HydrophobicContact CG-CB 4.24Å; M2067-D2070 PolarHBondContact O-N 2.79Å; N2068-D2070 VanDerWaalsContact C-N 3.32Å; N2068-D2070 PolarHBondContact O-N 3.04Å; D2070-E2072 VanDerWaalsContact C-N 3.3Å; D2070-E2072 PolarHBondContact O-N 2.99Å; D2070-A2073 WeakPolarHBondContact O-CB 3.31Å; D2070-A2073 PolarHBondContact O-N 3.33Å
2071	I	54.3	Low	61.3	Low	103 Å²	103	79.2 Å²	79.2	53%	0.528	40%	0.403	S	S	.	.			trans	-47.1	-2.6	172.5	-53.8	178.7	0	0	0	111	H2014 M2067 N2068 N2069 A2073 R2237	H2014-I2071 PolarHBondContact CD2-O 3.1Å; H2014-I2071 VanDerWaalsContact CD2-O 3.26Å; M2067-I2071 HydrophobicContact CE-CD1 4.04Å; M2067-I2071 WeakPolarHBondContact O-CG1 3.35Å; M2067-I2071 HydrophobicContact SD-CD1 4.13Å; N2068-I2071 HydrophobicContact CB-CD1 4.36Å; N2068-I2071 WeakPolarHBondContact O-CG1 3.46Å; N2068-I2071 PolarHBondContact O-N 3.35Å; N2068-I2071 VanDerWaalsContact OD1-CD1 3.29Å; N2068-I2071 WeakPolarHBondContact OD1-CD1 3.1Å; N2069-I2071 HydrophobicContact CB-CB 4.28Å; N2069-I2071 HydrophobicContact CB-CD1 4.27Å; N2069-I2071 HydrophobicContact CB-CG1 4.21Å; N2069-I2071 PolarHBondContact O-N 2.98Å; I2071-A2073 PolarHBondContact O-N 3.33Å; I2071-R2237 PolarHBondContact O-NH1 3.4Å
2072	E	66.2	Low	64.1	Low	91 Å²	91	76.1 Å²	76.1	43%	0.425	39%	0.387	S	S	.	.			trans	-80.6	113.6	-175.8	-68.3	-158	163.4	0	0	112.7	H2014 R2016 N2069 D2070 F2074 R2237	H2014-E2072 IonicContact CE1-OE2 3.84Å; H2014-E2072 IonicContact CG-OE2 3.69Å; H2014-E2072 IonicContact ND1-OE2 2.81Å; H2014-E2072 PolarHBondContact ND1-OE2 3.1Å; R2016-E2072 IonicContact NE-OE1 3.27Å; R2016-E2072 IonicContact NH2-OE1 2.75Å; R2016-E2072 PolarHBondContact NH2-OE1 2.85Å; N2069-E2072 PolarHBondContact O-N 3.2Å; D2070-E2072 VanDerWaalsContact C-N 3.3Å; D2070-E2072 PolarHBondContact O-N 2.99Å; E2072-F2074 WeakPolarHBondContact O-CD1 3.37Å; E2072-F2074 PolarHBondContact O-N 3.31Å; E2072-R2237 VanDerWaalsContact CD-NE 3.29Å; E2072-R2237 IonicContact OE1-CZ 2.71Å; E2072-R2237 VanDerWaalsContact OE1-CZ 3.31Å; E2072-R2237 IonicContact OE1-NE 3.81Å; E2072-R2237 PolarHBondContact OE1-NE 3.31Å; E2072-R2237 IonicContact OE1-NH2 3.64Å; E2072-R2237 PolarHBondContact OE1-NH2 3.34Å; E2072-R2237 WeakPolarHBondContact OE2-CD 3.34Å; E2072-R2237 IonicContact OE2-CZ 2.67Å; E2072-R2237 IonicContact OE2-NE 3.46Å; E2072-R2237 PolarHBondContact OE2-NE 2.71Å; E2072-R2237 IonicContact OE2-NH2 3.35Å
2073	A	75.3	Confident	66.8	Low	11 Å²	11	73.7 Å²	73.7	9%	0.091	37%	0.372	C	S	.	.			trans	-69.9	127.5	177.4	0	0	0	0	0	111.7	A2012 H2014 D2070 I2071 L2076 R2237	A2012-A2073 HydrophobicContact CB-CB 4.34Å; H2014-A2073 VanDerWaalsContact CD2-CA 3.49Å; H2014-A2073 WeakPolarHBondContact CD2-CA 3.5Å; H2014-A2073 WeakPolarHBondContact NE2-CA 3.41Å; H2014-A2073 WeakPolarHBondContact NE2-CB 3.41Å; D2070-A2073 WeakPolarHBondContact O-CB 3.31Å; D2070-A2073 PolarHBondContact O-N 3.33Å; I2071-A2073 PolarHBondContact O-N 3.33Å; A2073-L2076 HydrophobicContact CB-CD1 4.08Å; A2073-L2076 HydrophobicContact CB-CD2 3.62Å; A2073-L2076 HydrophobicContact CB-CG 3.8Å; A2073-R2237 WeakPolarHBondContact O-CD 3.42Å; A2073-R2237 VanDerWaalsContact O-CG 3.27Å; A2073-R2237 WeakPolarHBondContact O-CG 3.48Å; A2073-R2237 PolarHBondContact O-NH1 3.08Å
2074	F	83.6	Confident	69.3	Low	32.8 Å²	32.8	70.9 Å²	70.9	14%	0.144	36%	0.357	C	S	.	.	S	Bend	trans	-79.3	-54.2	177.3	153.4	-115.9	0	0	0	112.1	I2013 L2015 E2072 L2076 M2236 R2237 W2238 H2242 V2246	I2013-F2074 HydrophobicContact CG2-CD1 4.39Å; I2013-F2074 CarbonylContact O-C 3.59Å; I2013-F2074 VanDerWaalsContact O-CA 3.27Å; I2013-F2074 WeakPolarHBondContact O-CA 3.41Å; I2013-F2074 WeakPolarHBondContact O-CB 3.38Å; I2013-F2074 PolarHBondContact O-N 3.01Å; L2015-F2074 HydrophobicContact CD1-CB 4.33Å; L2015-F2074 HydrophobicContact CD1-CD1 3.69Å; L2015-F2074 HydrophobicContact CD1-CD2 4.02Å; L2015-F2074 HydrophobicContact CD1-CE1 3.92Å; L2015-F2074 HydrophobicContact CD1-CE2 4.24Å; L2015-F2074 HydrophobicContact CD1-CG 3.74Å; L2015-F2074 HydrophobicContact CD1-CZ 4.19Å; L2015-F2074 HydrophobicContact CD2-CD1 4.03Å; L2015-F2074 HydrophobicContact CD2-CE1 4.38Å; L2015-F2074 HydrophobicContact CG-CB 4.01Å; L2015-F2074 HydrophobicContact CG-CD1 3.67Å; L2015-F2074 HydrophobicContact CG-CE1 4.29Å; L2015-F2074 HydrophobicContact CG-CG 3.84Å; E2072-F2074 WeakPolarHBondContact O-CD1 3.37Å; E2072-F2074 PolarHBondContact O-N 3.31Å; F2074-L2076 HydrophobicContact CD2-CB 4.38Å; F2074-L2076 HydrophobicContact CE2-CB 4.31Å; F2074-M2236 HydrophobicContact CE2-CE 3.9Å; F2074-M2236 HydrophobicContact CE2-CG 4.22Å; F2074-M2236 HydrophobicContact CE2-SD 4.4Å; F2074-M2236 HydrophobicContact CZ-CE 3.73Å; F2074-M2236 HydrophobicContact CZ-CG 4.43Å; F2074-M2236 HydrophobicContact CZ-SD 4.38Å; F2074-M2236 CarbonylContact O-C 3.59Å; F2074-M2236 WeakPolarHBondContact O-CA 3.39Å; F2074-R2237 VanDerWaalsContact CD2-O 3.29Å; F2074-R2237 WeakPolarHBondContact CD2-O 3.3Å; F2074-R2237 VanDerWaalsContact CE2-O 3.3Å; F2074-R2237 WeakPolarHBondContact CE2-O 3.38Å; F2074-R2237 PolarHBondContact O-N 3.18Å; F2074-W2238 AromaticContact CE2-CE3 3.99Å; F2074-W2238 HydrophobicContact CE2-CE3 4.07Å; F2074-W2238 HydrophobicContact CE2-CZ3 4.29Å; F2074-W2238 HydrophobicContact CZ-CE3 4.35Å; F2074-W2238 HydrophobicContact CZ-CZ3 4.25Å; F2074-H2242 HydrophobicContact CD2-CB 3.71Å; F2074-H2242 AromaticContact CD2-CG 3.58Å; F2074-H2242 AromaticContact CD2-ND1 3.53Å; F2074-H2242 WeakPolarHBondContact CD2-ND1 3.31Å; F2074-H2242 HydrophobicContact CE2-CB 3.87Å; F2074-V2246 HydrophobicContact CE1-CG2 4.43Å; F2074-V2246 HydrophobicContact CZ-CG2 4.12Å
2075	I	88.2	Confident	71.3	Confident	23.2 Å²	23.2	69.5 Å²	69.5	12%	0.119	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	133.6	173.5	-63.6	167.5	0	0	0	108.8	A2012 I2013 V2077 F2234 K2235 M2236	A2012-I2075 WeakPolarHBondContact CA-O 3.39Å; I2013-I2075 HydrophobicContact CB-CB 4.11Å; I2013-I2075 HydrophobicContact CD1-CB 4.17Å; I2013-I2075 HydrophobicContact CD1-CD1 4.39Å; I2013-I2075 HydrophobicContact CD1-CG2 4.2Å; I2013-I2075 HydrophobicContact CG1-CB 4.3Å; I2013-I2075 PolarHBondContact N-O 3.23Å; I2013-I2075 PolarHBondContact O-N 3.11Å; I2013-I2075 VanDerWaalsContact O-N 3.16Å; I2075-V2077 HydrophobicContact CG2-CG2 3.82Å; I2075-F2234 HydrophobicContact CD1-CE2 4.4Å; I2075-F2234 HydrophobicContact CD1-CZ 4.46Å; I2075-F2234 HydrophobicContact CG1-CE2 4.41Å; I2075-F2234 HydrophobicContact CG1-CZ 4.42Å; I2075-F2234 HydrophobicContact CG2-CD2 4.18Å; I2075-F2234 HydrophobicContact CG2-CE2 3.68Å; I2075-F2234 HydrophobicContact CG2-CZ 4.4Å; I2075-K2235 CarbonylContact C-O 3.51Å; I2075-K2235 VanDerWaalsContact CA-O 3.29Å; I2075-K2235 WeakPolarHBondContact CA-O 3.39Å; I2075-M2236 HydrophobicContact CD1-CG 4.42Å; I2075-M2236 HydrophobicContact CD1-SD 4.27Å; I2075-M2236 HydrophobicContact CG1-CB 4.15Å; I2075-M2236 HydrophobicContact CG1-CG 3.95Å; I2075-M2236 HydrophobicContact CG1-SD 4.33Å
2076	L	88.5	Confident	72.9	Confident	50.4 Å²	50.4	64.6 Å²	64.6	26%	0.264	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	131.9	171.8	-82.3	132.4	0	0	0	109.4	I2011 A2012 A2073 F2074 P2078 K2235	I2011-L2076 CarbonylContact O-C 3.54Å; I2011-L2076 WeakPolarHBondContact O-CA 3.42Å; A2012-L2076 HydrophobicContact CB-CD1 4.29Å; A2012-L2076 HydrophobicContact CB-CD2 3.75Å; A2073-L2076 HydrophobicContact CB-CD1 4.08Å; A2073-L2076 HydrophobicContact CB-CD2 3.62Å; A2073-L2076 HydrophobicContact CB-CG 3.8Å; F2074-L2076 HydrophobicContact CD2-CB 4.38Å; F2074-L2076 HydrophobicContact CE2-CB 4.31Å; L2076-P2078 HydrophobicContact CD2-CG 4.3Å; L2076-P2078 HydrophobicContact CG-CG 4.4Å; L2076-K2235 HydrophobicContact CB-CB 4.17Å; L2076-K2235 PolarHBondContact N-O 3.14Å; L2076-K2235 PolarHBondContact O-N 3.01Å
2077	V	89.8	Confident	73.9	Confident	8 Å²	8	62.5 Å²	62.5	5%	0.048	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	101.4	177.5	173.7	0	0	0	0	109.1	I2011 I2075 L2079 L2080 I2231 F2234	I2011-V2077 HydrophobicContact CB-CB 4.12Å; I2011-V2077 WeakPolarHBondContact CB-O 3.45Å; I2011-V2077 HydrophobicContact CD1-CB 4.3Å; I2011-V2077 HydrophobicContact CD1-CG1 4.07Å; I2011-V2077 PolarHBondContact N-O 3.11Å; I2011-V2077 PolarHBondContact O-N 3.24Å; I2075-V2077 HydrophobicContact CG2-CG2 3.82Å; V2077-L2079 VanDerWaalsContact C-N 3.29Å; V2077-L2079 WeakPolarHBondContact CG1-O 3.2Å; V2077-L2079 PolarHBondContact O-N 3.1Å; V2077-L2080 HydrophobicContact CG1-CB 4.09Å; V2077-I2231 HydrophobicContact CB-CG2 4.3Å; V2077-I2231 HydrophobicContact CG1-CG2 3.48Å; V2077-I2231 VanDerWaalsContact CG1-CG2 3.45Å; V2077-I2231 HydrophobicContact CG2-CG2 3.78Å; V2077-F2234 HydrophobicContact CG2-CB 4.42Å; V2077-F2234 HydrophobicContact CG2-CD2 3.64Å; V2077-F2234 HydrophobicContact CG2-CE2 4.36Å; V2077-F2234 HydrophobicContact CG2-CG 4.43Å
2078	P	88.5	Confident	74.8	Confident	45.8 Å²	45.8	61.4 Å²	61.4	30%	0.297	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	-32.8	177.6	-30.1	38.9	0	0	0	114.6	H2009 D2010 L2076 H2232 E2233	H2009-P2078 CarbonylContact C-O 3.57Å; H2009-P2078 WeakPolarHBondContact CA-O 3.28Å; D2010-P2078 PolarHBondContact N-O 2.98Å; L2076-P2078 HydrophobicContact CD2-CG 4.3Å; L2076-P2078 HydrophobicContact CG-CG 4.4Å; P2078-H2232 WeakPolarHBondContact CD-O 3.42Å; P2078-E2233 HydrophobicContact CB-CB 4.42Å; P2078-E2233 WeakPolarHBondContact CD-O 3.32Å; P2078-E2233 HydrophobicContact CG-CB 3.78Å
2079	L	90.6	Very high	75.7	Confident	27.6 Å²	27.6	61.7 Å²	61.7	15%	0.145	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	126.8	175.6	175.4	61.2	0	0	0	111.8	I2008 H2009 V2077 R2081 I2231 H2232	I2008-L2079 WeakPolarHBondContact O-CA 3.41Å; H2009-L2079 WeakPolarHBondContact CE1-CD1 3.42Å; V2077-L2079 VanDerWaalsContact C-N 3.29Å; V2077-L2079 WeakPolarHBondContact CG1-O 3.2Å; V2077-L2079 PolarHBondContact O-N 3.1Å; L2079-R2081 HydrophobicContact CD1-CG 4.08Å; L2079-R2081 HydrophobicContact CD2-CG 4.4Å; L2079-R2081 HydrophobicContact CG-CG 4.29Å; L2079-I2231 WeakPolarHBondContact O-CA 3.08Å; L2079-H2232 HydrophobicContact CB-CB 4.26Å; L2079-H2232 PolarHBondContact O-N 2.8Å
2080	L	92.7	Very high	76.4	Confident	38.2 Å²	38.2	58.9 Å²	58.9	20%	0.2	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	125.4	169.1	-177.7	139.1	0	0	0	109.1	S2007 I2008 I2011 V2077 L2229 I2231	S2007-L2080 CarbonylContact C-O 3.55Å; S2007-L2080 WeakPolarHBondContact CA-O 3.39Å; I2008-L2080 HydrophobicContact CB-CB 4.47Å; I2008-L2080 HydrophobicContact CD1-CD2 4.41Å; I2008-L2080 PolarHBondContact N-O 3.11Å; I2008-L2080 PolarHBondContact O-N 3Å; I2011-L2080 HydrophobicContact CD1-CB 3.68Å; I2011-L2080 HydrophobicContact CD1-CD1 4.06Å; I2011-L2080 HydrophobicContact CD1-CD2 3.85Å; I2011-L2080 HydrophobicContact CD1-CG 4.45Å; V2077-L2080 HydrophobicContact CG1-CB 4.09Å; L2080-L2229 HydrophobicContact CD1-CD1 4.14Å; L2080-L2229 HydrophobicContact CD2-CD1 3.71Å; L2080-L2229 HydrophobicContact CG-CD1 3.73Å; L2080-I2231 HydrophobicContact CD1-CD1 4.33Å; L2080-I2231 HydrophobicContact CD1-CG1 4.47Å; L2080-I2231 HydrophobicContact CG-CG1 4.39Å
2081	R	92.6	Very high	76.8	Confident	89.8 Å²	89.8	58.7 Å²	58.7	34%	0.339	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	128.1	173	-82.1	176.3	177.3	169.1	3.6	110.5	Y2005 A2006 L2079 L2229 E2230	Y2005-R2081 HydrophobicContact CE2-CG 4.32Å; A2006-R2081 CarbonylContact O-C 3.54Å; A2006-R2081 VanDerWaalsContact O-CA 3.32Å; A2006-R2081 WeakPolarHBondContact O-CA 3.41Å; L2079-R2081 HydrophobicContact CD1-CG 4.08Å; L2079-R2081 HydrophobicContact CD2-CG 4.4Å; L2079-R2081 HydrophobicContact CG-CG 4.29Å; R2081-L2229 CarbonylContact O-C 3.54Å; R2081-L2229 WeakPolarHBondContact O-CA 3.39Å; R2081-L2229 WeakPolarHBondContact O-CD1 3.39Å; R2081-E2230 HydrophobicContact CB-CB 4.31Å; R2081-E2230 WeakPolarHBondContact CD-OE2 3.32Å; R2081-E2230 IonicContact CZ-OE2 3.22Å; R2081-E2230 PolarHBondContact N-O 3.25Å; R2081-E2230 IonicContact NE-OE2 3.15Å; R2081-E2230 VanDerWaalsContact NH1-CD 3.32Å; R2081-E2230 IonicContact NH1-OE1 3.87Å; R2081-E2230 PolarHBondContact NH1-OE1 2.8Å; R2081-E2230 IonicContact NH1-OE2 2.86Å; R2081-E2230 PolarHBondContact NH1-OE2 2.99Å; R2081-E2230 PolarHBondContact O-N 3.17Å
2082	Y	93.5	Very high	76.7	Confident	44.4 Å²	44.4	59.5 Å²	59.5	17%	0.174	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	136.6	175.4	168.6	-94.6	0	0	0	109.7	L2004 Y2005 A2006 Q2084 H2227 H2228 W2498	L2004-Y2082 HydrophobicContact CB-CE1 4.3Å; L2004-Y2082 HydrophobicContact CD2-CE1 3.94Å; L2004-Y2082 HydrophobicContact CG-CD1 4.47Å; L2004-Y2082 HydrophobicContact CG-CE1 4.02Å; Y2005-Y2082 CarbonylContact C-O 3.5Å; Y2005-Y2082 VanDerWaalsContact CA-O 3.3Å; Y2005-Y2082 WeakPolarHBondContact CA-O 3.31Å; Y2005-Y2082 WeakPolarHBondContact CD2-O 3.32Å; A2006-Y2082 HydrophobicContact CB-CD1 4.44Å; A2006-Y2082 PolarHBondContact N-O 3.14Å; A2006-Y2082 PolarHBondContact O-N 3.15Å; Y2082-Q2084 HydrophobicContact CE1-CB 4.04Å; Y2082-Q2084 WeakPolarHBondContact OH-CB 3.46Å; Y2082-Q2084 PolarHBondContact OH-OE1 3.13Å; Y2082-Q2084 VanDerWaalsContact OH-OE1 3.14Å; Y2082-H2227 HydrophobicContact CE2-CB 4.15Å; Y2082-H2227 AromaticContact CE2-ND1 3.77Å; Y2082-H2227 AromaticContact CZ-ND1 3.68Å; Y2082-H2227 PolarHBondContact OH-CE1 2.87Å; Y2082-H2227 PolarHBondContact OH-ND1 3.22Å; Y2082-H2228 CarbonylContact C-O 3.49Å; Y2082-H2228 WeakPolarHBondContact CA-O 3.36Å; Y2082-W2498 HydrophobicContact CD2-CZ3 4.26Å; Y2082-W2498 AromaticContact CE2-CH2 3.98Å; Y2082-W2498 HydrophobicContact CE2-CH2 4.04Å; Y2082-W2498 AromaticContact CE2-CZ3 3.86Å; Y2082-W2498 HydrophobicContact CE2-CZ3 3.94Å
2083	Q	91.2	Very high	76.1	Confident	63.2 Å²	63.2	62.4 Å²	62.4	30%	0.295	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	129.9	173.5	-171.8	173	-39.6	0	0	110.6	L2004 Y2005 L2085 H2228	L2004-Q2083 CarbonylContact O-C 3.56Å; L2004-Q2083 VanDerWaalsContact O-CA 3.28Å; L2004-Q2083 WeakPolarHBondContact O-CA 3.32Å; Y2005-Q2083 HydrophobicContact CD2-CB 4.43Å; Y2005-Q2083 HydrophobicContact CD2-CG 4.5Å; Q2083-L2085 HydrophobicContact CG-CD2 4.28Å; Q2083-L2085 HydrophobicContact CG-CG 4.37Å; Q2083-H2228 HydrophobicContact CB-CB 4.42Å; Q2083-H2228 PolarHBondContact N-O 2.92Å; Q2083-H2228 PolarHBondContact O-N 3.14Å
2084	Q	88.2	Confident	75.5	Confident	34.8 Å²	34.8	64.4 Å²	64.4	16%	0.163	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	123.9	170.4	-170.6	-178.3	-0.4	0	0	110.2	V2001 N2003 L2004 Y2082 V2226 H2227	V2001-Q2084 HydrophobicContact CG1-CB 4.45Å; N2003-Q2084 CarbonylContact C-O 3.55Å; N2003-Q2084 VanDerWaalsContact CA-O 3.31Å; N2003-Q2084 WeakPolarHBondContact CA-O 3.18Å; N2003-Q2084 PolarHBondContact OD1-O 3.1Å; L2004-Q2084 HydrophobicContact CB-CB 4.12Å; L2004-Q2084 PolarHBondContact N-O 3.02Å; L2004-Q2084 VanDerWaalsContact N-O 3.14Å; L2004-Q2084 PolarHBondContact O-N 3.06Å; Y2082-Q2084 HydrophobicContact CE1-CB 4.04Å; Y2082-Q2084 WeakPolarHBondContact OH-CB 3.46Å; Y2082-Q2084 PolarHBondContact OH-OE1 3.13Å; Y2082-Q2084 VanDerWaalsContact OH-OE1 3.14Å; Q2084-V2226 CarbonylContact C-O 3.53Å; Q2084-V2226 VanDerWaalsContact CA-O 3.23Å; Q2084-V2226 WeakPolarHBondContact CA-O 3.37Å; Q2084-V2226 HydrophobicContact CG-CG1 4.46Å; Q2084-V2226 VanDerWaalsContact CG-O 3.28Å; Q2084-V2226 WeakPolarHBondContact CG-O 3.34Å; Q2084-H2227 VanDerWaalsContact CD-CE1 3.44Å; Q2084-H2227 PolarHBondContact NE2-CE1 2.86Å
2085	L	76.8	Confident	74.4	Confident	67.8 Å²	67.8	67.4 Å²	67.4	36%	0.355	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	168	179.9	-67	173.1	0	0	0	111.5	N2003 Q2083 P2225 V2226 H2228	N2003-L2085 HydrophobicContact CB-CD2 4.41Å; Q2083-L2085 HydrophobicContact CG-CD2 4.28Å; Q2083-L2085 HydrophobicContact CG-CG 4.37Å; L2085-P2225 HydrophobicContact CD1-CG 4.22Å; L2085-V2226 PolarHBondContact N-O 3.33Å; L2085-V2226 VanDerWaalsContact N-O 3.14Å; L2085-H2228 HydrophobicContact CD1-CB 3.54Å; L2085-H2228 HydrophobicContact CG-CB 4.3Å
2086	C	68.3	Low	73.4	Confident	58 Å²	58	67.1 Å²	67.1	39%	0.392	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-94.5	147.9	173.5	-156.1	0	0	0	0	110.6	V2001 L2002 T2088	V2001-C2086 WeakPolarHBondContact O-CB 3.41Å; V2001-C2086 PolarHBondContact O-SG 3.1Å; L2002-C2086 VanDerWaalsContact O-CB 3.26Å; L2002-C2086 WeakPolarHBondContact O-CB 3.19Å; C2086-T2088 PolarHBondContact O-N 3.03Å
2087	P	59.7	Low	72.5	Confident	75.4 Å²	75.4	70 Å²	70	49%	0.49	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-70.4	110.9	-172	-0.9	10.7	0	0	0	111.2	V2089 V2226	P2087-V2089 PolarHBondContact O-N 2.87Å; P2087-V2226 HydrophobicContact CB-CG2 4.14Å; P2087-V2226 HydrophobicContact CG-CG1 4.12Å; P2087-V2226 HydrophobicContact CG-CG2 3.98Å
2088	T	56.8	Low	71.4	Confident	86.6 Å²	86.6	70.7 Å²	70.7	53%	0.531	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-85.8	123.4	175.1	-55.5	0	0	0	0	109.5	C2086 L2090 T2224	C2086-T2088 PolarHBondContact O-N 3.03Å; T2088-L2090 HydrophobicContact CG2-CD1 4.4Å; T2088-L2090 PolarHBondContact O-N 3.05Å; T2088-T2224 WeakPolarHBondContact CB-OG1 3.39Å; T2088-T2224 PolarHBondContact OG1-OG1 3.04Å
2089	V	55.8	Low	70.3	Confident	130.8 Å²	130.8	72.7 Å²	72.7	79%	0.793	40%	0.4	S	S	*	.			trans	-82.1	113.2	179	-180	0	0	0	0	108.9	P2087	P2087-V2089 PolarHBondContact O-N 2.87Å
2090	L	55.6	Low	68.9	Low	64 Å²	64	74.8 Å²	74.8	34%	0.335	41%	0.411	S	S	.	.			trans	-66	139.6	172.5	-134	81.9	0	0	0	110.4	T2088 S2092 T2094 V2096 L2223	T2088-L2090 HydrophobicContact CG2-CD1 4.4Å; T2088-L2090 PolarHBondContact O-N 3.05Å; L2090-S2092 PolarHBondContact O-N 3.48Å; L2090-T2094 HydrophobicContact CD1-CG2 4.12Å; L2090-T2094 HydrophobicContact CD2-CG2 4.13Å; L2090-T2094 VanDerWaalsContact CD2-O 3.28Å; L2090-T2094 WeakPolarHBondContact CD2-O 3.35Å; L2090-T2094 HydrophobicContact CG-CG2 4.28Å; L2090-V2096 HydrophobicContact CD1-CG2 4.21Å; L2090-V2096 HydrophobicContact CD2-CB 4.37Å; L2090-V2096 HydrophobicContact CD2-CG2 3.73Å; L2090-L2223 HydrophobicContact CD1-CD2 3.7Å; L2090-L2223 VanDerWaalsContact CD1-CD2 3.48Å; L2090-L2223 HydrophobicContact CD2-CD2 4.12Å; L2090-L2223 HydrophobicContact CG-CD2 4.47Å
2091	P	55.7	Low	67	Low	87.6 Å²	87.6	75.9 Å²	75.9	57%	0.569	42%	0.42	S	S	*	.			trans	-61	146	172.6	-2.3	7	0	0	0	111.2	N2093 T2094	P2091-N2093 PolarHBondContact O-N 2.96Å; P2091-T2094 WeakPolarHBondContact O-CB 3.32Å; P2091-T2094 PolarHBondContact O-N 3.06Å; P2091-T2094 VanDerWaalsContact O-N 3.13Å; P2091-T2094 PolarHBondContact O-OG1 3.45Å
2092	S	52.5	Low	64.8	Low	119.6 Å²	119.6	74 Å²	74	84%	0.836	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-11.6	-169.1	54	0	0	0	0	116.3	L2090	L2090-S2092 PolarHBondContact O-N 3.48Å
2093	N	55.2	Low	62.2	Low	151.6 Å²	151.6	78.1 Å²	78.1	81%	0.811	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.8	1.5	-178.2	-70.5	8.4	0	0	0	113.4	P2091 T2095	P2091-N2093 PolarHBondContact O-N 2.96Å; N2093-T2095 PolarHBondContact O-N 3.4Å
2094	T	60.9	Low	59.3	Low	53.6 Å²	53.6	86 Å²	86	33%	0.329	49%	0.488	S	S	.	.			trans	-99.5	118.1	-176.2	-44	0	0	0	0	110.4	L2090 P2091 V2096 L2218	L2090-T2094 HydrophobicContact CD1-CG2 4.12Å; L2090-T2094 HydrophobicContact CD2-CG2 4.13Å; L2090-T2094 VanDerWaalsContact CD2-O 3.28Å; L2090-T2094 WeakPolarHBondContact CD2-O 3.35Å; L2090-T2094 HydrophobicContact CG-CG2 4.28Å; P2091-T2094 WeakPolarHBondContact O-CB 3.32Å; P2091-T2094 PolarHBondContact O-N 3.06Å; P2091-T2094 VanDerWaalsContact O-N 3.13Å; P2091-T2094 PolarHBondContact O-OG1 3.45Å; T2094-V2096 HydrophobicContact CG2-CG2 4.33Å; T2094-V2096 PolarHBondContact O-N 3.06Å; T2094-L2218 HydrophobicContact CG2-CD1 3.39Å; T2094-L2218 VanDerWaalsContact CG2-CD1 3.46Å; T2094-L2218 HydrophobicContact CG2-CG 4.48Å
2095	T	62.2	Low	56.4	Low	94 Å²	94	90.2 Å²	90.2	58%	0.577	52%	0.518	S	S	*	.			trans	-101.2	124.8	173.7	54.9	0	0	0	0	110.4	N2093 R2097 L2492	N2093-T2095 PolarHBondContact O-N 3.4Å; T2095-R2097 PolarHBondContact O-N 2.93Å; T2095-L2492 HydrophobicContact CG2-CD2 4.32Å
2096	V	67.3	Low	54.1	Low	18.4 Å²	18.4	92.8 Å²	92.8	11%	0.112	54%	0.537	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	128.6	177.9	-179	0	0	0	0	109.5	L2090 T2094 V2098 L2218 T2219 H2220 L2223 L2492 V2493	L2090-V2096 HydrophobicContact CD1-CG2 4.21Å; L2090-V2096 HydrophobicContact CD2-CB 4.37Å; L2090-V2096 HydrophobicContact CD2-CG2 3.73Å; T2094-V2096 HydrophobicContact CG2-CG2 4.33Å; T2094-V2096 PolarHBondContact O-N 3.06Å; V2096-V2098 PolarHBondContact O-N 2.85Å; V2096-L2218 WeakPolarHBondContact CA-O 3.35Å; V2096-L2218 HydrophobicContact CG2-CB 4.23Å; V2096-T2219 VanDerWaalsContact CG1-O 3.25Å; V2096-T2219 WeakPolarHBondContact CG1-O 3.42Å; V2096-H2220 VanDerWaalsContact CG1-CA 3.46Å; V2096-H2220 HydrophobicContact CG1-CB 4.37Å; V2096-L2223 HydrophobicContact CB-CD1 4.37Å; V2096-L2223 HydrophobicContact CG1-CD1 3.93Å; V2096-L2223 HydrophobicContact CG1-CG 4.13Å; V2096-L2223 HydrophobicContact CG2-CD1 4.39Å; V2096-L2223 HydrophobicContact CG2-CD2 4.15Å; V2096-L2223 HydrophobicContact CG2-CG 4.39Å; V2096-L2492 WeakPolarHBondContact O-CA 3.27Å; V2096-V2493 HydrophobicContact CB-CB 4.41Å; V2096-V2493 HydrophobicContact CG1-CB 4.16Å; V2096-V2493 PolarHBondContact O-N 3.02Å
2097	R	68.1	Low	52.1	Low	109.8 Å²	109.8	94.5 Å²	94.5	41%	0.414	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.9	153.2	174.2	-72.4	-166	-165.8	-105.4	2.3	111.6	T2095 H2099 Q2217 L2218 T2219 H2220 A2489 S2490 S2491 L2492	T2095-R2097 PolarHBondContact O-N 2.93Å; R2097-H2099 VanDerWaalsContact C-N 3.28Å; R2097-H2099 PolarHBondContact O-N 3.06Å; R2097-Q2217 VanDerWaalsContact NE-NE2 3.15Å; R2097-Q2217 VanDerWaalsContact NH2-NE2 3.15Å; R2097-Q2217 VanDerWaalsContact NH2-OE1 3.09Å; R2097-L2218 PolarHBondContact N-O 3.2Å; R2097-L2218 VanDerWaalsContact N-O 3.13Å; R2097-T2219 CarbonylContact O-C 3.51Å; R2097-T2219 VanDerWaalsContact O-CA 3.28Å; R2097-T2219 WeakPolarHBondContact O-CA 3.42Å; R2097-H2220 PolarHBondContact O-N 3.03Å; R2097-A2489 PolarHBondContact NH1-O 2.83Å; R2097-S2490 VanDerWaalsContact NH1-C 3.26Å; R2097-S2490 PolarHBondContact NH1-O 3.06Å; R2097-S2491 PolarHBondContact NH1-O 2.67Å; R2097-L2492 HydrophobicContact CG-CD2 4.22Å
2098	V	66.5	Low	50.6	Low	22.8 Å²	22.8	96.9 Å²	96.9	14%	0.138	57%	0.568	C	S	.	*			trans	-66.3	124.6	167.7	-177.5	0	0	0	0	108.4	V2096 I2100 C2488 V2493 L2530 V2548 F2719	V2096-V2098 PolarHBondContact O-N 2.85Å; V2098-I2100 HydrophobicContact CG1-CG1 4.06Å; V2098-I2100 PolarHBondContact O-N 3.01Å; V2098-I2100 VanDerWaalsContact O-N 3.11Å; V2098-C2488 WeakPolarHBondContact CB-O 3.44Å; V2098-C2488 HydrophobicContact CG1-CB 4.35Å; V2098-C2488 HydrophobicContact CG2-CB 4.4Å; V2098-C2488 VanDerWaalsContact CG2-O 3.24Å; V2098-C2488 WeakPolarHBondContact CG2-O 3.45Å; V2098-V2493 HydrophobicContact CG2-CG2 3.74Å; V2098-L2530 HydrophobicContact CG1-CD1 4.44Å; V2098-L2530 HydrophobicContact CG2-CD1 3.88Å; V2098-V2548 HydrophobicContact CG1-CG1 4.3Å; V2098-V2548 HydrophobicContact CG1-CG2 3.74Å; V2098-F2719 HydrophobicContact CG1-CE1 4.5Å
2099	H	66.3	Low	49.1	Very low	88.2 Å²	88.2	98.6 Å²	98.6	41%	0.408	58%	0.579	S	S	.	*			trans	-81.7	123	172.7	176.8	-113.3	0	0	0	108.4	R2097 P2101 T2219 H2220 E2221	R2097-H2099 VanDerWaalsContact C-N 3.28Å; R2097-H2099 PolarHBondContact O-N 3.06Å; H2099-P2101 VanDerWaalsContact O-CD 3.27Å; H2099-P2101 WeakPolarHBondContact O-CD 3.36Å; H2099-T2219 HydrophobicContact CB-CG2 3.89Å; H2099-H2220 PolarHBondContact N-ND1 3Å; H2099-H2220 PolarHBondContact O-CE1 3.5Å; H2099-E2221 IonicContact CE1-OE1 2.95Å; H2099-E2221 IonicContact CG-OE1 3.83Å; H2099-E2221 IonicContact ND1-OE1 3.06Å; H2099-E2221 PolarHBondContact ND1-OE1 3.15Å
2100	I	60.2	Low	47.7	Very low	71.4 Å²	71.4	97.2 Å²	97.2	37%	0.366	58%	0.575	S	S	.	*			trans	-105.9	119	167.4	-62	170.7	0	0	0	105.8	V2098 G2102 L2485 A2489 F2719	V2098-I2100 HydrophobicContact CG1-CG1 4.06Å; V2098-I2100 PolarHBondContact O-N 3.01Å; V2098-I2100 VanDerWaalsContact O-N 3.11Å; I2100-G2102 VanDerWaalsContact C-N 3.28Å; I2100-G2102 PolarHBondContact O-N 3.19Å; I2100-L2485 HydrophobicContact CB-CD1 4.49Å; I2100-L2485 HydrophobicContact CD1-CD1 3.61Å; I2100-L2485 HydrophobicContact CD1-CD2 3.54Å; I2100-L2485 HydrophobicContact CD1-CG 4.18Å; I2100-L2485 HydrophobicContact CG1-CD1 3.87Å; I2100-L2485 HydrophobicContact CG1-CD2 4.23Å; I2100-L2485 HydrophobicContact CG1-CG 4.32Å; I2100-L2485 HydrophobicContact CG2-CD1 4.1Å; I2100-A2489 HydrophobicContact CD1-CB 3.34Å; I2100-A2489 VanDerWaalsContact CD1-CB 3.47Å; I2100-A2489 HydrophobicContact CG1-CB 4.17Å; I2100-F2719 HydrophobicContact CG1-CE1 4.49Å
2101	P	52.9	Low	46.4	Very low	61.6 Å²	61.6	100 Å²	100	40%	0.4	59%	0.594	S	S	.	*			trans	-63.7	97.3	171.8	-10.4	21.1	0	0	0	109.6	H2099 E2717	H2099-P2101 VanDerWaalsContact O-CD 3.27Å; H2099-P2101 WeakPolarHBondContact O-CD 3.36Å; P2101-E2717 WeakPolarHBondContact CB-OE1 3.36Å; P2101-E2717 VanDerWaalsContact CG-OE1 3.24Å; P2101-E2717 WeakPolarHBondContact CG-OE1 3.37Å
2102	G	46.4	Very low	45	Very low	49.6 Å²	49.6	101.6 Å²	101.6	51%	0.511	60%	0.602	S	S	.	*			trans	-78.2	156.6	166.2	0	0	0	0	0	110.1	I2100 R2104	I2100-G2102 VanDerWaalsContact C-N 3.28Å; I2100-G2102 PolarHBondContact O-N 3.19Å; G2102-R2104 PolarHBondContact O-N 3.11Å
2103	P	40.2	Very low	43.8	Very low	131.2 Å²	131.2	102 Å²	102	85%	0.852	60%	0.6	S	S	*	*			trans	-57.4	110.8	171.6	24.2	-32	0	0	0	108.5	P2105	P2103-P2105 WeakPolarHBondContact O-CD 3.14Å; P2103-P2105 VanDerWaalsContact O-N 3.09Å
2104	R	28.9	Very low	42.4	Very low	230 Å²	230	99.9 Å²	99.9	87%	0.868	60%	0.597	S	S	*	*			trans	-55.5	120.8	178.3	-132.4	-179.3	-169.7	167.5	3.5	107.5	G2102 T2106	G2102-R2104 PolarHBondContact O-N 3.11Å; R2104-T2106 VanDerWaalsContact C-N 3.34Å; R2104-T2106 PolarHBondContact O-N 3.15Å
2105	P	28.9	Very low	40.7	Very low	121.2 Å²	121.2	103.3 Å²	103.3	79%	0.787	62%	0.618	S	S	*	*			trans	-61.2	111.4	178.2	23.1	-31	0	0	0	107.7	P2103 A2107	P2103-P2105 WeakPolarHBondContact O-CD 3.14Å; P2103-P2105 VanDerWaalsContact O-N 3.09Å; P2105-A2107 VanDerWaalsContact C-N 3.32Å; P2105-A2107 PolarHBondContact O-N 3.33Å; P2105-A2107 VanDerWaalsContact O-N 3.13Å
2106	T	27.6	Very low	39.1	Very low	124 Å²	124	104.7 Å²	104.7	76%	0.761	63%	0.627	S	S	*	*			trans	-59.8	109.6	171.1	32.5	0	0	0	0	107.1	R2104 V2108	R2104-T2106 VanDerWaalsContact C-N 3.34Å; R2104-T2106 PolarHBondContact O-N 3.15Å; T2106-V2108 VanDerWaalsContact C-N 3.27Å; T2106-V2108 WeakPolarHBondContact O-CG2 3.32Å; T2106-V2108 PolarHBondContact O-N 3.17Å
2107	A	26.3	Very low	37.1	Very low	94 Å²	94	110.9 Å²	110.9	78%	0.777	66%	0.659	S	S	*	*			trans	-59.8	105.7	173.4	0	0	0	0	0	107.8	P2105 T2109	P2105-A2107 VanDerWaalsContact C-N 3.32Å; P2105-A2107 PolarHBondContact O-N 3.33Å; P2105-A2107 VanDerWaalsContact O-N 3.13Å; A2107-T2109 VanDerWaalsContact C-N 3.25Å; A2107-T2109 PolarHBondContact O-N 3.03Å
2108	V	28.1	Very low	35.1	Very low	124.4 Å²	124.4	111.2 Å²	111.2	75%	0.754	67%	0.673	S	S	*	*			trans	-75.9	109.3	-179.3	-179.6	0	0	0	0	106.8	T2106 S2110	T2106-V2108 VanDerWaalsContact C-N 3.27Å; T2106-V2108 WeakPolarHBondContact O-CG2 3.32Å; T2106-V2108 PolarHBondContact O-N 3.17Å; V2108-S2110 VanDerWaalsContact C-N 3.25Å; V2108-S2110 PolarHBondContact O-N 3.02Å; V2108-S2110 VanDerWaalsContact O-N 3.12Å
2109	T	26.3	Very low	33.3	Very low	123.8 Å²	123.8	117 Å²	117	76%	0.76	70%	0.704	S	S	*	*			trans	-49.3	111.1	172.8	-45.7	0	0	0	0	108.8	A2107 V2111	A2107-T2109 VanDerWaalsContact C-N 3.25Å; A2107-T2109 PolarHBondContact O-N 3.03Å; T2109-V2111 HydrophobicContact CG2-CG2 4.06Å; T2109-V2111 PolarHBondContact O-N 3.05Å
2110	S	26	Very low	31.4	Very low	101.2 Å²	101.2	118.7 Å²	118.7	71%	0.708	72%	0.72	S	S	*	*			trans	-82.9	107.5	179.4	44.2	0	0	0	0	109.2	V2108 T2112	V2108-S2110 VanDerWaalsContact C-N 3.25Å; V2108-S2110 PolarHBondContact O-N 3.02Å; V2108-S2110 VanDerWaalsContact O-N 3.12Å; S2110-T2112 PolarHBondContact O-N 3.42Å; S2110-T2112 VanDerWaalsContact O-N 3.12Å; S2110-T2112 PolarHBondContact O-OG1 3.22Å
2111	V	28.3	Very low	29.9	Very low	121.4 Å²	121.4	122.1 Å²	122.1	74%	0.736	74%	0.739	S	S	*	*			trans	-74	106	158.3	177.8	0	0	0	0	109	T2109 T2113	T2109-V2111 HydrophobicContact CG2-CG2 4.06Å; T2109-V2111 PolarHBondContact O-N 3.05Å; V2111-T2113 VanDerWaalsContact C-N 3.31Å; V2111-T2113 PolarHBondContact O-N 3.09Å
2112	T	26	Very low	28.7	Very low	122 Å²	122	127.7 Å²	127.7	75%	0.748	76%	0.76	S	S	*	*			trans	-29.4	118.8	171.3	-8.2	0	0	0	0	113.4	S2110 S2114	S2110-T2112 PolarHBondContact O-N 3.42Å; S2110-T2112 VanDerWaalsContact O-N 3.12Å; S2110-T2112 PolarHBondContact O-OG1 3.22Å; T2112-S2114 PolarHBondContact O-N 3.3Å; T2112-S2114 VanDerWaalsContact O-N 3.07Å
2113	T	26.6	Very low	27.8	Very low	128.4 Å²	128.4	132.3 Å²	132.3	79%	0.788	77%	0.773	S	S	*	*			trans	-114.8	115.5	163	31	0	0	0	0	109.9	V2111 T2115	V2111-T2113 VanDerWaalsContact C-N 3.31Å; V2111-T2113 PolarHBondContact O-N 3.09Å; T2113-T2115 VanDerWaalsContact C-N 3.34Å; T2113-T2115 PolarHBondContact O-N 3Å; T2113-T2115 PolarHBondContact O-OG1 3.43Å
2114	S	25.9	Very low	27.2	Very low	106 Å²	106	130.8 Å²	130.8	74%	0.741	77%	0.766	S	S	*	*			trans	-86.1	119.3	170.8	50.2	0	0	0	0	112.1	T2112 T2116	T2112-S2114 PolarHBondContact O-N 3.3Å; T2112-S2114 VanDerWaalsContact O-N 3.07Å; S2114-T2116 PolarHBondContact O-N 3.14Å
2115	T	26.3	Very low	27.1	Very low	126.8 Å²	126.8	126.4 Å²	126.4	78%	0.778	76%	0.759	S	S	*	*			trans	-49.1	124.5	152.4	11.7	0	0	0	0	113.1	T2113 N2117	T2113-T2115 VanDerWaalsContact C-N 3.34Å; T2113-T2115 PolarHBondContact O-N 3Å; T2113-T2115 PolarHBondContact O-OG1 3.43Å; T2115-N2117 PolarHBondContact O-N 3.07Å
2116	T	26.9	Very low	27.1	Very low	123.2 Å²	123.2	127.8 Å²	127.8	76%	0.756	76%	0.759	S	S	*	*			trans	-128.4	138.8	159.6	32.9	0	0	0	0	112.1	S2114 T2118	S2114-T2116 PolarHBondContact O-N 3.14Å; T2116-T2118 PolarHBondContact O-N 3.37Å
2117	N	26.3	Very low	26.9	Very low	148.2 Å²	148.2	126.8 Å²	126.8	79%	0.793	76%	0.755	S	S	*	*			trans	-149.7	134.5	157.5	-77.3	-12	0	0	0	114.5	T2115 N2119	T2115-N2117 PolarHBondContact O-N 3.07Å; N2117-N2119 PolarHBondContact O-N 3.36Å
2118	T	26.4	Very low	26.9	Very low	115.2 Å²	115.2	129.2 Å²	129.2	71%	0.707	76%	0.755	S	S	*	*			trans	-58.4	118.3	157	50.6	0	0	0	0	113.7	T2116	T2116-T2118 PolarHBondContact O-N 3.37Å
2119	N	27.3	Very low	26.9	Very low	145.6 Å²	145.6	129.8 Å²	129.8	78%	0.779	75%	0.754	S	S	*	*				163.4	135.9	128.5	-79.3	-7.3	0	0	0	113.9	N2117	N2117-N2119 PolarHBondContact O-N 3.36Å
2120	T	27.3	Very low	27	Very low	123 Å²	123	131.1 Å²	131.1	76%	0.755	76%	0.756	S	S	*	*			trans	60.1	129.4	147.8	53.4	0	0	0	0	116.1
2121	N	27.7	Very low	27.2	Very low	142.4 Å²	142.4	131.9 Å²	131.9	76%	0.761	76%	0.762	S	S	*	*			trans	48.9	122.5	132.1	-64.5	-1.9	0	0	0	115.7
2122	E	28.1	Very low	27.2	Very low	179.6 Å²	179.6	129.6 Å²	129.6	84%	0.839	76%	0.763	S	S	*	*				-175.6	126.1	100.8	-105.9	170	-153.2	0	0	111.3
2123	N	27.4	Very low	27.2	Very low	145.8 Å²	145.8	130.9 Å²	130.9	78%	0.78	77%	0.765	S	S	*	*			trans	-24.4	135.2	137.5	-73.1	-33.5	0	0	0	115.8
2124	S	28.5	Very low	27.3	Very low	101 Å²	101	130 Å²	130	71%	0.706	76%	0.76	S	S	*	*			trans	-177.3	134.8	137.5	57.5	0	0	0	0	112.3
2125	N	27	Very low	27.3	Very low	136.4 Å²	136.4	132.1 Å²	132.1	73%	0.729	76%	0.763	S	S	*	*				112.2	136.6	108.8	-75.7	-30	0	0	0	114
2126	I	27.8	Very low	27.4	Very low	152.2 Å²	152.2	133.6 Å²	133.6	78%	0.781	77%	0.765	S	S	*	*			trans	158.7	125.6	133	-81.8	164.1	0	0	0	112.1
2127	C	25.1	Very low	27.4	Very low	102.2 Å²	102.2	132.8 Å²	132.8	69%	0.691	77%	0.765	S	S	*	*			trans	67.1	121.8	145.5	-23.1	0	0	0	0	118.9
2128	N	25.7	Very low	27.6	Very low	144 Å²	144	131.9 Å²	131.9	77%	0.77	77%	0.766	S	S	*	*				151.1	132.4	116.1	-91.6	-12.6	0	0	0	115.2
2129	N	28.7	Very low	27.5	Very low	136.8 Å²	136.8	131.3 Å²	131.3	73%	0.732	77%	0.767	S	S	*	*			trans	113.2	118.9	131	-71.5	-23.9	0	0	0	114.2	S2131	N2129-S2131 PolarHBondContact O-N 3.4Å
2130	N	27.3	Very low	27.4	Very low	151 Å²	151	129.6 Å²	129.6	81%	0.807	77%	0.767	S	S	*	*				-145.8	138.6	112.1	-96.3	-14.9	0	0	0	112.1
2131	S	30.3	Very low	27.4	Very low	118.8 Å²	118.8	131 Å²	131	83%	0.831	77%	0.768	S	S	*	*			trans	177.5	134.4	146.2	61.9	0	0	0	0	111.7	N2129	N2129-S2131 PolarHBondContact O-N 3.4Å
2132	G	27.9	Very low	27.1	Very low	72.2 Å²	72.2	133.1 Å²	133.1	74%	0.744	77%	0.77	S	S	*	*			cis	128.7	116.2	38.7	0	0	0	0	0	111.8
2133	N	27	Very low	26.8	Very low	149.6 Å²	149.6	129.9 Å²	129.9	80%	0.8	77%	0.767	S	S	*	*			trans	-137.8	124.6	148.3	-120.7	7.5	0	0	0	115.9
2134	T	28.7	Very low	26.6	Very low	110.4 Å²	110.4	131.2 Å²	131.2	68%	0.677	77%	0.767	S	S	*	*			trans	38.8	111	151.2	50.5	0	0	0	0	117.4	L2136	T2134-L2136 PolarHBondContact O-N 2.85Å
2135	N	25.7	Very low	26.5	Very low	150 Å²	150	131.8 Å²	131.8	80%	0.802	77%	0.769	S	S	*	*			trans	-44.5	115.6	142.6	-68.8	-31.1	0	0	0	113.4
2136	L	27.6	Very low	26.4	Very low	159 Å²	159	132.8 Å²	132.8	83%	0.832	77%	0.773	S	S	*	*			trans	-112.3	118	143.2	-83.1	150	0	0	0	112.2	T2134	T2134-L2136 PolarHBondContact O-N 2.85Å
2137	S	26.7	Very low	26.2	Very low	105.8 Å²	105.8	134.3 Å²	134.3	74%	0.74	78%	0.776	S	S	*	*			trans	-80.9	146.3	170.2	50.7	0	0	0	0	111.7	S2139	S2137-S2139 PolarHBondContact O-N 3.13Å
2138	P	31	Very low	26.1	Very low	128.2 Å²	128.2	134.4 Å²	134.4	83%	0.832	78%	0.778	S	S	*	*			trans	-99	132.3	167.6	24	-14.7	0	0	0	113.3
2139	S	25.8	Very low	26.2	Very low	104 Å²	104	135 Å²	135	73%	0.727	78%	0.78	S	S	*	*			trans	-65.7	137	162.6	54.2	0	0	0	0	113.4	S2137 I2141	S2137-S2139 PolarHBondContact O-N 3.13Å; S2139-I2141 PolarHBondContact O-N 2.7Å
2140	S	24.7	Very low	26	Very low	109 Å²	109	137.4 Å²	137.4	76%	0.762	78%	0.784	S	S	*	*				-67.7	119.6	119	64.5	0	0	0	0	113.5	K2142	S2140-K2142 PolarHBondContact O-N 3.04Å
2141	I	26	Very low	25.9	Very low	151.6 Å²	151.6	137 Å²	137	78%	0.777	78%	0.782	S	S	*	*				-109.6	109.1	123.2	-63.5	176.4	0	0	0	111.2	S2139 C2143	S2139-I2141 PolarHBondContact O-N 2.7Å; I2141-C2143 PolarHBondContact O-N 3Å
2142	K	22.3	Very low	25.7	Very low	188 Å²	188	139 Å²	139	82%	0.817	78%	0.783	S	S	*	*			trans	-76.1	124.5	161.5	-101.7	174.6	177.1	178.1	0	112	S2140	S2140-K2142 PolarHBondContact O-N 3.04Å
2143	C	22.1	Very low	25.5	Very low	112.8 Å²	112.8	141.6 Å²	141.6	76%	0.762	79%	0.785	S	S	*	*			trans	-125.5	129.3	177.3	-77.5	0	0	0	0	110.1	I2141	I2141-C2143 PolarHBondContact O-N 3Å
2144	H	23.2	Very low	25.4	Very low	171.2 Å²	171.2	139.4 Å²	139.4	79%	0.793	78%	0.781	S	S	*	*			trans	-71.9	148.9	172.2	-83	-87.1	0	0	0	112.8	I2146	H2144-I2146 PolarHBondContact O-N 2.89Å
2145	P	26.2	Very low	25.2	Very low	113.6 Å²	113.6	141.3 Å²	141.3	74%	0.738	79%	0.785	S	S	*	*			trans	-93.9	146.9	176.9	32.6	-26.1	0	0	0	112.6
2146	I	24.2	Very low	25.1	Very low	159.2 Å²	159.2	141.2 Å²	141.2	82%	0.816	79%	0.785	S	S	*	*			trans	-69.1	125.3	162.4	-55.9	175	0	0	0	111.2	H2144 S2148	H2144-I2146 PolarHBondContact O-N 2.89Å; I2146-S2148 PolarHBondContact O-N 3.1Å
2147	E	23.2	Very low	25	Very low	182.4 Å²	182.4	138.6 Å²	138.6	85%	0.852	78%	0.78	S	S	*	*			trans	-60	137.2	164.4	-67.5	171.5	154.3	0	0	114.9
2148	S	24.7	Very low	24.8	Very low	104.2 Å²	104.2	139.7 Å²	139.7	73%	0.729	78%	0.783	S	S	*	*			trans	-128.6	115.3	148.2	62.1	0	0	0	0	113.8	I2146 K2150	I2146-S2148 PolarHBondContact O-N 3.1Å; S2148-K2150 PolarHBondContact O-N 3.16Å
2149	I	26.6	Very low	24.4	Very low	156.6 Å²	156.6	138.4 Å²	138.4	80%	0.803	78%	0.776	S	S	*	*			trans	-88.8	111.2	155.2	-61.5	173.2	0	0	0	110	N2151	I2149-N2151 PolarHBondContact O-N 2.77Å
2150	K	25	Very low	24.3	Very low	187 Å²	187	139.4 Å²	139.4	81%	0.813	78%	0.778	S	S	*	*			trans	-99.9	124.8	153.1	-81.4	172.1	177.9	176.1	0	109.9	S2148 N2152	S2148-K2150 PolarHBondContact O-N 3.16Å; K2150-N2152 PolarHBondContact O-N 3.19Å
2151	N	24.9	Very low	24.3	Very low	144 Å²	144	141.5 Å²	141.5	77%	0.77	78%	0.779	S	S	*	*			trans	-139.4	89.8	156.1	-78.1	-14.5	0	0	0	111.2	I2149 T2153	I2149-N2151 PolarHBondContact O-N 2.77Å; N2151-T2153 VanDerWaalsContact C-N 3.31Å; N2151-T2153 PolarHBondContact O-N 2.91Å
2152	N	25.3	Very low	24.2	Very low	160.2 Å²	160.2	139.8 Å²	139.8	86%	0.857	78%	0.776	S	S	*	*			trans	-114.5	86.5	159.7	-89.9	-14.9	0	0	0	109.4	K2150 S2154	K2150-N2152 PolarHBondContact O-N 3.19Å; N2152-S2154 PolarHBondContact O-N 2.85Å
2153	T	24.7	Very low	24.3	Very low	126.6 Å²	126.6	138.2 Å²	138.2	78%	0.777	77%	0.772	S	S	*	*			trans	-93.5	99.5	164.7	19.6	0	0	0	0	108.9	N2151 I2155	N2151-T2153 VanDerWaalsContact C-N 3.31Å; N2151-T2153 PolarHBondContact O-N 2.91Å; T2153-I2155 PolarHBondContact O-N 2.96Å
2154	S	24.6	Very low	24.4	Very low	102.6 Å²	102.6	140 Å²	140	72%	0.717	77%	0.774	S	S	*	*			trans	-72.4	100	177.1	-7.9	0	0	0	0	111.2	N2152 N2156	N2152-S2154 PolarHBondContact O-N 2.85Å; S2154-N2156 PolarHBondContact O-N 3.05Å
2155	I	24.8	Very low	24.5	Very low	150.4 Å²	150.4	139 Å²	139	77%	0.771	77%	0.773	S	S	*	*			trans	-86.7	100.1	172.8	-58	175.7	0	0	0	108.2	T2153 S2157	T2153-I2155 PolarHBondContact O-N 2.96Å; I2155-S2157 VanDerWaalsContact CG2-OG 3.26Å; I2155-S2157 WeakPolarHBondContact CG2-OG 3.36Å; I2155-S2157 PolarHBondContact O-N 2.98Å
2156	N	24.5	Very low	24.4	Very low	149.6 Å²	149.6	138.9 Å²	138.9	80%	0.8	78%	0.775	S	S	*	*			trans	-71.7	81.9	170	-79.5	-23.3	0	0	0	110.9	S2154 T2158	S2154-N2156 PolarHBondContact O-N 3.05Å; N2156-T2158 VanDerWaalsContact C-N 3.33Å; N2156-T2158 PolarHBondContact O-N 3.09Å; N2156-T2158 PolarHBondContact O-OG1 3.27Å
2157	S	24.3	Very low	24.5	Very low	102.6 Å²	102.6	135.3 Å²	135.3	72%	0.717	77%	0.768	S	S	*	*			trans	-85.4	95	167.8	-68.6	0	0	0	0	108.8	I2155 S2159	I2155-S2157 VanDerWaalsContact CG2-OG 3.26Å; I2155-S2157 WeakPolarHBondContact CG2-OG 3.36Å; I2155-S2157 PolarHBondContact O-N 2.98Å; S2157-S2159 VanDerWaalsContact C-N 3.25Å; S2157-S2159 PolarHBondContact O-N 3.16Å
2158	T	22.6	Very low	24.5	Very low	130.6 Å²	130.6	134.1 Å²	134.1	80%	0.801	77%	0.768	S	S	*	*			trans	-54.4	85.1	151.3	26	0	0	0	0	109.9	N2156 T2160	N2156-T2158 VanDerWaalsContact C-N 3.33Å; N2156-T2158 PolarHBondContact O-N 3.09Å; N2156-T2158 PolarHBondContact O-OG1 3.27Å; T2158-T2160 PolarHBondContact O-N 3.07Å
2159	S	23.1	Very low	24.6	Very low	100.6 Å²	100.6	135 Å²	135	70%	0.703	77%	0.768	S	S	*	*			trans	-76.9	116.6	166.4	46.5	0	0	0	0	110.7	S2157 I2161	S2157-S2159 VanDerWaalsContact C-N 3.25Å; S2157-S2159 PolarHBondContact O-N 3.16Å; S2159-I2161 VanDerWaalsContact C-N 3.32Å; S2159-I2161 PolarHBondContact O-N 3.16Å; S2159-I2161 VanDerWaalsContact O-N 3.13Å
2160	T	22.4	Very low	24.4	Very low	123.6 Å²	123.6	133.5 Å²	133.5	76%	0.758	77%	0.767	S	S	*	*			trans	-50.9	110.3	163.8	43.3	0	0	0	0	111.2	T2158 T2162	T2158-T2160 PolarHBondContact O-N 3.07Å; T2160-T2162 VanDerWaalsContact C-N 3.29Å; T2160-T2162 PolarHBondContact O-N 3.3Å; T2160-T2162 PolarHBondContact O-OG1 3.04Å
2161	I	24.5	Very low	24.4	Very low	154.4 Å²	154.4	129.4 Å²	129.4	79%	0.792	76%	0.762	S	S	*	*			trans	-75.2	100.7	167.3	-60	174.3	0	0	0	107.7	S2159 E2163	S2159-I2161 VanDerWaalsContact C-N 3.32Å; S2159-I2161 PolarHBondContact O-N 3.16Å; S2159-I2161 VanDerWaalsContact O-N 3.13Å; I2161-E2163 HydrophobicContact CG2-CG 4.37Å; I2161-E2163 PolarHBondContact O-N 3.12Å
2162	T	23.9	Very low	24.3	Very low	116.6 Å²	116.6	128.9 Å²	128.9	72%	0.715	76%	0.764	S	S	*	*			trans	-103.8	102.2	161.6	25.2	0	0	0	0	107	T2160 N2164	T2160-T2162 VanDerWaalsContact C-N 3.29Å; T2160-T2162 PolarHBondContact O-N 3.3Å; T2160-T2162 PolarHBondContact O-OG1 3.04Å; T2162-N2164 VanDerWaalsContact C-N 3.29Å; T2162-N2164 PolarHBondContact O-N 3.15Å; T2162-N2164 VanDerWaalsContact O-N 3.12Å
2163	E	25.1	Very low	24.3	Very low	154.4 Å²	154.4	126.6 Å²	126.6	72%	0.721	76%	0.761	S	S	*	*			trans	-79	112.6	169.5	-69.9	-178.9	154.1	0	0	108.6	K1929 I2161 I2165	K1929-E2163 IonicContact NZ-OE1 2.74Å; K1929-E2163 PolarHBondContact NZ-OE1 2.64Å; K1929-E2163 IonicContact NZ-OE2 3.4Å; K1929-E2163 PolarHBondContact NZ-OE2 2.97Å; I2161-E2163 HydrophobicContact CG2-CG 4.37Å; I2161-E2163 PolarHBondContact O-N 3.12Å; E2163-I2165 VanDerWaalsContact C-N 3.29Å; E2163-I2165 HydrophobicContact CB-CG1 4.48Å; E2163-I2165 PolarHBondContact O-N 3.38Å
2164	N	24.1	Very low	24.2	Very low	150.6 Å²	150.6	129.1 Å²	129.1	81%	0.805	76%	0.764	S	S	*	*			trans	-62.1	107	157.5	-78.5	-18.5	0	0	0	109.8	T2162 S2166	T2162-N2164 VanDerWaalsContact C-N 3.29Å; T2162-N2164 PolarHBondContact O-N 3.15Å; T2162-N2164 VanDerWaalsContact O-N 3.12Å; N2164-S2166 VanDerWaalsContact C-N 3.29Å; N2164-S2166 PolarHBondContact O-N 3.07Å; N2164-S2166 VanDerWaalsContact O-N 3.12Å
2165	I	26.4	Very low	24.2	Very low	149.6 Å²	149.6	130.5 Å²	130.5	77%	0.767	77%	0.767	S	S	*	*			trans	-104.7	106.7	158.9	-70.1	173.1	0	0	0	108.1	E2163 A2167	E2163-I2165 VanDerWaalsContact C-N 3.29Å; E2163-I2165 HydrophobicContact CB-CG1 4.48Å; E2163-I2165 PolarHBondContact O-N 3.38Å; I2165-A2167 VanDerWaalsContact C-N 3.29Å; I2165-A2167 PolarHBondContact O-N 2.81Å
2166	S	24	Very low	24.2	Very low	111.4 Å²	111.4	129.1 Å²	129.1	78%	0.779	77%	0.765	S	S	*	*			trans	-77.3	112.9	163.4	43.6	0	0	0	0	110.4	N2164 D2168	N2164-S2166 VanDerWaalsContact C-N 3.29Å; N2164-S2166 PolarHBondContact O-N 3.07Å; N2164-S2166 VanDerWaalsContact O-N 3.12Å; S2166-D2168 PolarHBondContact O-N 3.34Å; S2166-D2168 VanDerWaalsContact O-N 3.16Å
2167	A	25.3	Very low	24.1	Very low	82.6 Å²	82.6	129.1 Å²	129.1	68%	0.683	77%	0.765	S	S	*	*			trans	-126	115.4	170	0	0	0	0	0	108.5	I2165 V2169	I2165-A2167 VanDerWaalsContact C-N 3.29Å; I2165-A2167 PolarHBondContact O-N 2.81Å; A2167-V2169 PolarHBondContact O-N 3.08Å
2168	D	23.1	Very low	24.1	Very low	157.4 Å²	157.4	133.1 Å²	133.1	84%	0.842	77%	0.773	S	S	*	*			trans	-86.4	116.7	160.4	-106.8	-36.7	0	0	0	109.8	S2166 T2170	S2166-D2168 PolarHBondContact O-N 3.34Å; S2166-D2168 VanDerWaalsContact O-N 3.16Å; D2168-T2170 PolarHBondContact O-N 3.06Å; D2168-T2170 VanDerWaalsContact O-N 3.08Å
2169	V	26.4	Very low	24.3	Very low	122.6 Å²	122.6	135.4 Å²	135.4	74%	0.743	77%	0.774	S	S	*	*			trans	-118.2	103.9	169.1	-178.1	0	0	0	0	109	A2167 S2171	A2167-V2169 PolarHBondContact O-N 3.08Å; V2169-S2171 PolarHBondContact O-N 3.25Å
2170	T	22.8	Very low	24.3	Very low	125.6 Å²	125.6	136.5 Å²	136.5	77%	0.771	78%	0.777	S	S	*	*			trans	-89.8	105.7	152.3	-51.3	0	0	0	0	110.1	D2168 T2172	D2168-T2170 PolarHBondContact O-N 3.06Å; D2168-T2170 VanDerWaalsContact O-N 3.08Å; T2170-T2172 PolarHBondContact O-N 2.81Å
2171	S	24.7	Very low	24.5	Very low	100.6 Å²	100.6	138.4 Å²	138.4	70%	0.703	78%	0.782	S	S	*	*			trans	-115.1	106.5	165.1	-49.9	0	0	0	0	111.3	V2169 S2173	V2169-S2171 PolarHBondContact O-N 3.25Å; S2171-S2173 PolarHBondContact O-N 3.25Å
2172	T	22.8	Very low	24.8	Very low	133.4 Å²	133.4	135.8 Å²	135.8	82%	0.818	78%	0.775	S	S	*	*			trans	-71.2	130.8	164.8	27.5	0	0	0	0	110.7	T2170 Q2174	T2170-T2172 PolarHBondContact O-N 2.81Å; T2172-Q2174 PolarHBondContact O-N 2.76Å
2173	S	25.2	Very low	24.9	Very low	112.6 Å²	112.6	139.3 Å²	139.3	79%	0.787	78%	0.781	S	S	*	*			trans	-124	134	148.9	-93.3	0	0	0	0	109.7	S2171 V2175	S2171-S2173 PolarHBondContact O-N 3.25Å; S2173-V2175 PolarHBondContact O-N 3.42Å; S2173-V2175 VanDerWaalsContact O-N 3.12Å
2174	Q	22.5	Very low	24.9	Very low	180 Å²	180	136.5 Å²	136.5	84%	0.841	78%	0.778	S	S	*	*			trans	-90.3	132.6	178.8	-82.3	168.4	-58.7	0	0	111.2	T2172 V2176	T2172-Q2174 PolarHBondContact O-N 2.76Å; Q2174-V2176 PolarHBondContact O-N 3.05Å
2175	V	24.7	Very low	25	Very low	131.2 Å²	131.2	135.8 Å²	135.8	80%	0.795	77%	0.774	S	S	*	*			trans	-101.4	117.7	159.1	174.1	0	0	0	0	106.7	S2173	S2173-V2175 PolarHBondContact O-N 3.42Å; S2173-V2175 VanDerWaalsContact O-N 3.12Å
2176	V	25.3	Very low	25.1	Very low	120.6 Å²	120.6	138.8 Å²	138.8	73%	0.731	78%	0.778	S	S	*	*			trans	-104.6	127.7	153.9	176.2	0	0	0	0	108.3	Q2174	Q2174-V2176 PolarHBondContact O-N 3.05Å
2177	D	23.1	Very low	25.2	Very low	149.6 Å²	149.6	140.1 Å²	140.1	80%	0.8	78%	0.776	S	S	*	*			trans	-78.5	153.6	-169.5	-66.3	-63.6	0	0	0	111.7
2178	E	25	Very low	25.3	Very low	187.4 Å²	187.4	141.9 Å²	141.9	88%	0.876	77%	0.774	S	S	*	*			trans	-115.4	133.4	165.7	-113.6	-177.4	-177.3	0	0	111
2179	E	25	Very low	25.6	Very low	177.6 Å²	177.6	140.3 Å²	140.3	83%	0.83	77%	0.766	S	S	*	*			trans	-120.7	127.7	162.9	-77.1	-164.9	147.8	0	0	116.2
2180	T	24.4	Very low	25.7	Very low	124.8 Å²	124.8	141.6 Å²	141.6	77%	0.766	77%	0.768	S	S	*	*			trans	66.9	117.9	139.2	0.1	0	0	0	0	118.3
2181	L	25.7	Very low	25.9	Very low	163.4 Å²	163.4	146.4 Å²	146.4	86%	0.855	77%	0.772	S	S	*	*			trans	-71.1	159.4	146.8	-67.3	168.9	0	0	0	114.2
2182	P	31.9	Very low	26	Very low	100.8 Å²	100.8	147 Å²	147	66%	0.655	77%	0.772	S	S	*	*				-135.9	179.5	80.9	40.1	-24.1	0	0	0	116.6
2183	F	26.2	Very low	26.2	Very low	188.2 Å²	188.2	146.4 Å²	146.4	83%	0.825	77%	0.768	S	S	*	*			trans	84.3	130.9	156.3	-79.9	-80.9	0	0	0	116.5
2184	S	25.2	Very low	26.3	Very low	95.8 Å²	95.8	151 Å²	151	67%	0.67	77%	0.77	S	S	*	*				84.2	128.5	111.8	74	0	0	0	0	115.6
2185	D	25.1	Very low	26.5	Very low	135.8 Å²	135.8	149.5 Å²	149.5	73%	0.726	77%	0.767	S	S	*	*				-116.1	137.8	109.5	-76.5	-52.4	0	0	0	113.6
2186	Y	27.8	Very low	26.7	Very low	214.4 Å²	214.4	150 Å²	150	84%	0.841	77%	0.766	S	S	*	*				164.2	117.2	127.3	-101.8	-80.3	0	0	0	116.1
2187	N	28	Very low	26.9	Very low	136.8 Å²	136.8	151.1 Å²	151.1	73%	0.732	77%	0.766	S	S	*	*			trans	-17.6	138.2	140.7	-125.3	-11.1	0	0	0	117.2
2188	N	26.9	Very low	27.1	Very low	120.8 Å²	120.8	150.8 Å²	150.8	65%	0.646	76%	0.764	S	S	*	*				166.4	145.2	122.8	-127.7	-13.9	0	0	0	115.9
2189	N	28.9	Very low	27.1	Very low	124.6 Å²	124.6	150.1 Å²	150.1	67%	0.666	76%	0.761	S	S	*	*			trans	76.3	123.8	146.3	-63.2	-38.7	0	0	0	118.3
2190	N	28.7	Very low	27.2	Very low	148.6 Å²	148.6	149 Å²	149	80%	0.795	76%	0.759	S	S	*	*			trans	102.3	105.8	134	-74.8	-24.6	0	0	0	117.3	T2192	N2190-T2192 PolarHBondContact O-N 2.78Å; N2190-T2192 VanDerWaalsContact O-N 3.15Å
2191	R	26.4	Very low	27.2	Very low	227.2 Å²	227.2	151.4 Å²	151.4	86%	0.857	76%	0.762	S	S	*	*				67.4	113.1	117.9	-161.5	173.9	-159.7	173.5	4.8	117.1
2192	T	28	Very low	27.1	Very low	113.8 Å²	113.8	149.5 Å²	149.5	70%	0.698	76%	0.757	S	S	*	*			trans	43.6	115.5	149.9	39.7	0	0	0	0	118.1	N2190 Y2194	N2190-T2192 PolarHBondContact O-N 2.78Å; N2190-T2192 VanDerWaalsContact O-N 3.15Å; T2192-Y2194 PolarHBondContact O-N 2.96Å; T2192-Y2194 VanDerWaalsContact O-N 3.13Å
2193	T	26.6	Very low	26.9	Very low	119.4 Å²	119.4	149.8 Å²	149.8	73%	0.733	76%	0.759	S	S	*	*			trans	27.5	108.5	142.5	-4.7	0	0	0	0	115.6
2194	Y	27.3	Very low	26.8	Very low	209.8 Å²	209.8	151.4 Å²	151.4	82%	0.823	76%	0.76	S	S	*	*			trans	-106.5	133.3	140.1	-89	-85.3	0	0	0	113.1	T2192 N2196	T2192-Y2194 PolarHBondContact O-N 2.96Å; T2192-Y2194 VanDerWaalsContact O-N 3.13Å; Y2194-N2196 PolarHBondContact O-N 3.11Å; Y2194-N2196 VanDerWaalsContact O-N 3.1Å
2195	N	27.3	Very low	26.8	Very low	148 Å²	148	156.8 Å²	156.8	79%	0.791	77%	0.766	S	S	*	*			trans	-73.8	123.4	154.1	-68	-27.1	0	0	0	112.3
2196	N	28.7	Very low	26.9	Very low	142.4 Å²	142.4	156.3 Å²	156.3	76%	0.761	76%	0.764	S	S	*	*			trans	-154.2	123.4	145.2	-124.4	-11.8	0	0	0	114.3	Y2194 N2198	Y2194-N2196 PolarHBondContact O-N 3.11Å; Y2194-N2196 VanDerWaalsContact O-N 3.1Å; N2196-N2198 PolarHBondContact O-N 3.1Å; N2196-N2198 VanDerWaalsContact O-N 3.13Å
2197	I	28.1	Very low	26.8	Very low	143.2 Å²	143.2	156.8 Å²	156.8	73%	0.734	77%	0.766	S	S	*	*			trans	-40.7	104.8	164	-62.6	163.8	0	0	0	112.5	H2199	I2197-H2199 PolarHBondContact O-N 3.14Å
2198	N	28.8	Very low	26.7	Very low	144.2 Å²	144.2	155.9 Å²	155.9	77%	0.771	77%	0.765	S	S	*	*			trans	-108.5	110.1	153.4	-78.9	-22	0	0	0	113.2	N2196 I2200	N2196-N2198 PolarHBondContact O-N 3.1Å; N2196-N2198 VanDerWaalsContact O-N 3.13Å; N2198-I2200 PolarHBondContact O-N 2.97Å; N2198-I2200 VanDerWaalsContact O-N 3.09Å
2199	H	25.3	Very low	26.7	Very low	172 Å²	172	154.6 Å²	154.6	80%	0.796	77%	0.772	S	S	*	*			trans	-59.8	107.4	159.9	-121.9	-62.1	0	0	0	112.1	I2197 Q2201	I2197-H2199 PolarHBondContact O-N 3.14Å; H2199-Q2201 PolarHBondContact O-N 3.06Å; H2199-Q2201 VanDerWaalsContact O-N 3.14Å
2200	I	25.7	Very low	26.5	Very low	155 Å²	155	154.2 Å²	154.2	80%	0.795	77%	0.774	S	S	*	*			trans	-107.3	128.4	154.3	-70	171.8	0	0	0	108.4	N2198 T2202	N2198-I2200 PolarHBondContact O-N 2.97Å; N2198-I2200 VanDerWaalsContact O-N 3.09Å; I2200-T2202 PolarHBondContact O-N 3.4Å
2201	Q	24.3	Very low	26.3	Very low	176 Å²	176	152.1 Å²	152.1	82%	0.822	77%	0.771	S	S	*	*			trans	-85.2	124	179.3	-77	168.8	-28	0	0	110.6	H2199	H2199-Q2201 PolarHBondContact O-N 3.06Å; H2199-Q2201 VanDerWaalsContact O-N 3.14Å
2202	T	24.5	Very low	26.3	Very low	123.2 Å²	123.2	146.3 Å²	146.3	76%	0.756	76%	0.764	S	S	*	*			trans	-79.3	138.6	163.2	48.2	0	0	0	0	110	I2200 R2204	I2200-T2202 PolarHBondContact O-N 3.4Å; T2202-R2204 VanDerWaalsContact C-N 3.29Å; T2202-R2204 PolarHBondContact O-N 2.95Å; T2202-R2204 VanDerWaalsContact O-N 3.17Å
2203	P	26.4	Very low	26.3	Very low	107.6 Å²	107.6	146.5 Å²	146.5	70%	0.699	77%	0.77	S	S	*	*			trans	-70.6	110.7	-175.5	10.7	-8.2	0	0	0	110.8	Y2205	P2203-Y2205 VanDerWaalsContact C-N 3.33Å; P2203-Y2205 HydrophobicContact CB-CD2 4.49Å; P2203-Y2205 HydrophobicContact CB-CE2 4.32Å; P2203-Y2205 HydrophobicContact CG-CE2 4.19Å; P2203-Y2205 PolarHBondContact O-N 2.99Å
2204	R	24.3	Very low	26.7	Very low	221.8 Å²	221.8	145 Å²	145	84%	0.837	76%	0.764	S	S	*	*			trans	-70.2	98.9	170.9	-140.6	-179.2	-169.6	154.9	1.5	108.6	T2202 N2206	T2202-R2204 VanDerWaalsContact C-N 3.29Å; T2202-R2204 PolarHBondContact O-N 2.95Å; T2202-R2204 VanDerWaalsContact O-N 3.17Å; R2204-N2206 WeakPolarHBondContact CG-OD1 3.47Å; R2204-N2206 PolarHBondContact NE-OD1 3.44Å; R2204-N2206 PolarHBondContact O-N 3.09Å; R2204-N2206 VanDerWaalsContact O-N 3.12Å
2205	Y	26.7	Very low	27.2	Very low	207.6 Å²	207.6	143.1 Å²	143.1	81%	0.814	77%	0.769	S	S	*	*			trans	-69	95.2	165.5	-83.3	-87.2	0	0	0	108.8	P2203 Y2207	P2203-Y2205 VanDerWaalsContact C-N 3.33Å; P2203-Y2205 HydrophobicContact CB-CD2 4.49Å; P2203-Y2205 HydrophobicContact CB-CE2 4.32Å; P2203-Y2205 HydrophobicContact CG-CE2 4.19Å; P2203-Y2205 PolarHBondContact O-N 2.99Å; Y2205-Y2207 VanDerWaalsContact C-N 3.25Å; Y2205-Y2207 PolarHBondContact O-N 2.97Å; Y2205-Y2207 VanDerWaalsContact O-N 3.1Å
2206	N	26.2	Very low	28.2	Very low	126.8 Å²	126.8	140.6 Å²	140.6	68%	0.678	76%	0.762	S	S	*	*			trans	-68.5	101.6	169.4	-76	-14.7	0	0	0	108.6	R2204 T2208	R2204-N2206 WeakPolarHBondContact CG-OD1 3.47Å; R2204-N2206 PolarHBondContact NE-OD1 3.44Å; R2204-N2206 PolarHBondContact O-N 3.09Å; R2204-N2206 VanDerWaalsContact O-N 3.12Å; N2206-T2208 VanDerWaalsContact C-N 3.31Å; N2206-T2208 HydrophobicContact CB-CG2 4.43Å; N2206-T2208 PolarHBondContact O-N 3.06Å; N2206-T2208 VanDerWaalsContact O-N 3.17Å
2207	Y	26.7	Very low	29.7	Very low	223.4 Å²	223.4	139.6 Å²	139.6	88%	0.876	75%	0.753	S	S	*	*			trans	-66.7	94.7	154.1	-88.5	-88.7	0	0	0	107.9	Y2205 A2209	Y2205-Y2207 VanDerWaalsContact C-N 3.25Å; Y2205-Y2207 PolarHBondContact O-N 2.97Å; Y2205-Y2207 VanDerWaalsContact O-N 3.1Å; Y2207-A2209 VanDerWaalsContact C-N 3.32Å; Y2207-A2209 PolarHBondContact O-N 3.15Å
2208	T	25.9	Very low	31.6	Very low	118 Å²	118	136.8 Å²	136.8	72%	0.724	74%	0.739	S	S	*	*			trans	-66.4	97	155.3	46.6	0	0	0	0	106.4	N2206 T2210	N2206-T2208 VanDerWaalsContact C-N 3.31Å; N2206-T2208 HydrophobicContact CB-CG2 4.43Å; N2206-T2208 PolarHBondContact O-N 3.06Å; N2206-T2208 VanDerWaalsContact O-N 3.17Å; T2208-T2210 VanDerWaalsContact C-N 3.25Å; T2208-T2210 PolarHBondContact O-N 3.12Å; T2208-T2210 VanDerWaalsContact O-N 3.1Å
2209	A	25.5	Very low	33.8	Very low	94.2 Å²	94.2	131.8 Å²	131.8	78%	0.779	71%	0.714	S	S	*	*			trans	-62.6	94.4	166.4	0	0	0	0	0	107.3	Y2207 S2211	Y2207-A2209 VanDerWaalsContact C-N 3.32Å; Y2207-A2209 PolarHBondContact O-N 3.15Å; A2209-S2211 VanDerWaalsContact C-N 3.34Å; A2209-S2211 PolarHBondContact O-N 2.93Å; A2209-S2211 VanDerWaalsContact O-N 3.11Å
2210	T	25.3	Very low	36.4	Very low	115.6 Å²	115.6	124.2 Å²	124.2	71%	0.709	68%	0.678	S	S	*	*			trans	-58.2	116.8	164.9	-51.8	0	0	0	0	105.8	T2208 C2212	T2208-T2210 VanDerWaalsContact C-N 3.25Å; T2208-T2210 PolarHBondContact O-N 3.12Å; T2208-T2210 VanDerWaalsContact O-N 3.1Å; T2210-C2212 VanDerWaalsContact C-N 3.33Å; T2210-C2212 PolarHBondContact O-N 2.93Å; T2210-C2212 PolarHBondContact O-SG 2.81Å
2211	S	24.4	Very low	39	Very low	104.4 Å²	104.4	121.5 Å²	121.5	73%	0.73	66%	0.663	S	S	*	*			trans	-66.9	89.5	177.4	56.1	0	0	0	0	108.6	A2209 S2213	A2209-S2211 VanDerWaalsContact C-N 3.34Å; A2209-S2211 PolarHBondContact O-N 2.93Å; A2209-S2211 VanDerWaalsContact O-N 3.11Å; S2211-S2213 PolarHBondContact O-N 3.01Å
2212	C	26.5	Very low	41.7	Very low	106.2 Å²	106.2	117.9 Å²	117.9	72%	0.718	65%	0.649	S	S	*	*			trans	-67.4	90	167	-59.6	0	0	0	0	107.2	T2210 S2214	T2210-C2212 VanDerWaalsContact C-N 3.33Å; T2210-C2212 PolarHBondContact O-N 2.93Å; T2210-C2212 PolarHBondContact O-SG 2.81Å; C2212-S2214 VanDerWaalsContact C-N 3.28Å; C2212-S2214 PolarHBondContact O-N 3.07Å
2213	S	28.2	Very low	44.4	Very low	117.2 Å²	117.2	113.2 Å²	113.2	82%	0.82	62%	0.619	S	S	*	*			trans	-73.5	70	179.7	55	0	0	0	0	110.9	S2211	S2211-S2213 PolarHBondContact O-N 3.01Å
2214	S	34.3	Very low	47.1	Very low	87.4 Å²	87.4	111.8 Å²	111.8	61%	0.611	61%	0.609	S	S	*	*			trans	-163.2	96.9	160.3	59.1	0	0	0	0	108.7	C2212 S2216	C2212-S2214 VanDerWaalsContact C-N 3.28Å; C2212-S2214 PolarHBondContact O-N 3.07Å; S2214-S2216 PolarHBondContact O-N 3.09Å
2215	N	38.4	Very low	50.1	Low	171.8 Å²	171.8	102.1 Å²	102.1	92%	0.919	58%	0.575	S	S	*	*			trans	-72.4	62.2	168.3	-85.4	-12	0	0	0	110	Q2217	N2215-Q2217 PolarHBondContact O-N 2.99Å; N2215-Q2217 VanDerWaalsContact O-N 3.09Å
2216	S	47.9	Very low	53	Low	94 Å²	94	93.4 Å²	93.4	66%	0.657	54%	0.543	S	S	*	.			trans	-73.4	94.9	169.1	56.4	0	0	0	0	108.2	S2214 L2218	S2214-S2216 PolarHBondContact O-N 3.09Å; S2216-L2218 PolarHBondContact O-N 3.09Å
2217	Q	60.4	Low	56.2	Low	122.4 Å²	122.4	89 Å²	89	57%	0.572	52%	0.518	S	S	*	.			trans	-62.8	120	171.5	-164.7	167.5	24.4	0	0	108.8	R2097 N2215 T2219 A2489	R2097-Q2217 VanDerWaalsContact NE-NE2 3.15Å; R2097-Q2217 VanDerWaalsContact NH2-NE2 3.15Å; R2097-Q2217 VanDerWaalsContact NH2-OE1 3.09Å; N2215-Q2217 PolarHBondContact O-N 2.99Å; N2215-Q2217 VanDerWaalsContact O-N 3.09Å; Q2217-T2219 WeakPolarHBondContact O-CG2 3.49Å; Q2217-T2219 PolarHBondContact O-N 3.19Å; Q2217-A2489 PolarHBondContact NE2-O 2.95Å
2218	L	67.2	Low	59.3	Low	84.4 Å²	84.4	80.7 Å²	80.7	44%	0.442	49%	0.487	S	S	.	.			trans	-62.8	136.2	179.5	-70.1	170.5	0	0	0	110.7	T2094 V2096 R2097 S2216 D2222	T2094-L2218 HydrophobicContact CG2-CD1 3.39Å; T2094-L2218 VanDerWaalsContact CG2-CD1 3.46Å; T2094-L2218 HydrophobicContact CG2-CG 4.48Å; V2096-L2218 WeakPolarHBondContact CA-O 3.35Å; V2096-L2218 HydrophobicContact CG2-CB 4.23Å; R2097-L2218 PolarHBondContact N-O 3.2Å; R2097-L2218 VanDerWaalsContact N-O 3.13Å; S2216-L2218 PolarHBondContact O-N 3.09Å; L2218-D2222 VanDerWaalsContact CA-OD2 3.31Å; L2218-D2222 WeakPolarHBondContact CA-OD2 3.36Å; L2218-D2222 HydrophobicContact CB-CB 4.42Å; L2218-D2222 HydrophobicContact CD2-CB 4.06Å; L2218-D2222 WeakPolarHBondContact CD2-OD2 3.43Å
2219	T	76.4	Confident	62.6	Low	38.8 Å²	38.8	76.6 Å²	76.6	24%	0.238	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	164.2	-178	70.4	0	0	0	0	110.9	V2096 R2097 H2099 Q2217 E2221 D2222	V2096-T2219 VanDerWaalsContact CG1-O 3.25Å; V2096-T2219 WeakPolarHBondContact CG1-O 3.42Å; R2097-T2219 CarbonylContact O-C 3.51Å; R2097-T2219 VanDerWaalsContact O-CA 3.28Å; R2097-T2219 WeakPolarHBondContact O-CA 3.42Å; H2099-T2219 HydrophobicContact CB-CG2 3.89Å; Q2217-T2219 WeakPolarHBondContact O-CG2 3.49Å; Q2217-T2219 PolarHBondContact O-N 3.19Å; T2219-E2221 PolarHBondContact O-N 2.9Å; T2219-E2221 VanDerWaalsContact O-N 3.11Å; T2219-E2221 PolarHBondContact OG1-N 3.19Å; T2219-D2222 WeakPolarHBondContact CA-OD2 3.15Å; T2219-D2222 WeakPolarHBondContact CB-OD2 3.38Å; T2219-D2222 PolarHBondContact N-OD2 3.24Å; T2219-D2222 WeakPolarHBondContact O-CB 3.38Å; T2219-D2222 PolarHBondContact O-N 2.89Å; T2219-D2222 VanDerWaalsContact O-N 3.15Å; T2219-D2222 PolarHBondContact OG1-N 2.83Å; T2219-D2222 PolarHBondContact OG1-OD2 3.06Å; T2219-D2222 VanDerWaalsContact OG1-OD2 3.08Å
2220	H	78.9	Confident	65.9	Low	11.4 Å²	11.4	73.8 Å²	73.8	5%	0.053	43%	0.431	C	S	.	.	G	3₁₀ helix	trans	-60.4	-21.6	174.8	76.6	-68.2	0	0	0	113.4	V2096 R2097 H2099 D2222 L2223 V2493 R2496 D2528 L2530	V2096-H2220 VanDerWaalsContact CG1-CA 3.46Å; V2096-H2220 HydrophobicContact CG1-CB 4.37Å; R2097-H2220 PolarHBondContact O-N 3.03Å; H2099-H2220 PolarHBondContact N-ND1 3Å; H2099-H2220 PolarHBondContact O-CE1 3.5Å; H2220-D2222 VanDerWaalsContact C-N 3.3Å; H2220-D2222 PolarHBondContact O-N 3.18Å; H2220-L2223 WeakPolarHBondContact O-CB 3.38Å; H2220-L2223 PolarHBondContact O-N 3.19Å; H2220-L2223 VanDerWaalsContact O-N 3.1Å; H2220-V2493 HydrophobicContact CB-CG1 4.19Å; H2220-V2493 HydrophobicContact CB-CG2 4.22Å; H2220-R2496 WeakPolarHBondContact O-CD 3.44Å; H2220-R2496 PolarHBondContact O-NH1 3.17Å; H2220-D2528 IonicContact NE2-OD2 3.12Å; H2220-L2530 HydrophobicContact CB-CD1 3.87Å; H2220-L2530 HydrophobicContact CB-CD2 4.07Å
2221	E	80.1	Confident	69.2	Low	99.4 Å²	99.4	69 Å²	69	46%	0.464	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-70.1	-28.9	177.1	-65.4	-161.1	-161.2	0	0	112.3	H2099 T2219 L2223 R2496	H2099-E2221 IonicContact CE1-OE1 2.95Å; H2099-E2221 IonicContact CG-OE1 3.83Å; H2099-E2221 IonicContact ND1-OE1 3.06Å; H2099-E2221 PolarHBondContact ND1-OE1 3.15Å; T2219-E2221 PolarHBondContact O-N 2.9Å; T2219-E2221 VanDerWaalsContact O-N 3.11Å; T2219-E2221 PolarHBondContact OG1-N 3.19Å; E2221-L2223 PolarHBondContact O-N 3.01Å; E2221-L2223 VanDerWaalsContact O-N 3.16Å; E2221-R2496 VanDerWaalsContact CD-NH2 3.32Å; E2221-R2496 PolarHBondContact O-NH1 3.13Å; E2221-R2496 IonicContact OE1-NH2 3.83Å; E2221-R2496 IonicContact OE2-CZ 3.72Å; E2221-R2496 VanDerWaalsContact OE2-CZ 3.31Å; E2221-R2496 IonicContact OE2-NH1 3.49Å; E2221-R2496 PolarHBondContact OE2-NH1 2.72Å; E2221-R2496 VanDerWaalsContact OE2-NH1 3.15Å; E2221-R2496 IonicContact OE2-NH2 2.82Å; E2221-R2496 PolarHBondContact OE2-NH2 3.35Å
2222	D	81.1	Confident	72.5	Confident	99.8 Å²	99.8	66.2 Å²	66.2	53%	0.534	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-70	-13	174.9	-57.5	-62.5	0	0	0	112.7	L2218 T2219 H2220	L2218-D2222 VanDerWaalsContact CA-OD2 3.31Å; L2218-D2222 WeakPolarHBondContact CA-OD2 3.36Å; L2218-D2222 HydrophobicContact CB-CB 4.42Å; L2218-D2222 HydrophobicContact CD2-CB 4.06Å; L2218-D2222 WeakPolarHBondContact CD2-OD2 3.43Å; T2219-D2222 WeakPolarHBondContact CA-OD2 3.15Å; T2219-D2222 WeakPolarHBondContact CB-OD2 3.38Å; T2219-D2222 PolarHBondContact N-OD2 3.24Å; T2219-D2222 WeakPolarHBondContact O-CB 3.38Å; T2219-D2222 PolarHBondContact O-N 2.89Å; T2219-D2222 VanDerWaalsContact O-N 3.15Å; T2219-D2222 PolarHBondContact OG1-N 2.83Å; T2219-D2222 PolarHBondContact OG1-OD2 3.06Å; T2219-D2222 VanDerWaalsContact OG1-OD2 3.08Å; H2220-D2222 VanDerWaalsContact C-N 3.3Å; H2220-D2222 PolarHBondContact O-N 3.18Å
2223	L	81.7	Confident	75.6	Confident	25.6 Å²	25.6	62.8 Å²	62.8	13%	0.134	35%	0.351	C	S	.	.	S	Bend	trans	-85.7	129.7	174.7	-62	176.3	0	0	0	110.6	L2090 V2096 H2220 E2221 P2225 V2493 R2496	L2090-L2223 HydrophobicContact CD1-CD2 3.7Å; L2090-L2223 VanDerWaalsContact CD1-CD2 3.48Å; L2090-L2223 HydrophobicContact CD2-CD2 4.12Å; L2090-L2223 HydrophobicContact CG-CD2 4.47Å; V2096-L2223 HydrophobicContact CB-CD1 4.37Å; V2096-L2223 HydrophobicContact CG1-CD1 3.93Å; V2096-L2223 HydrophobicContact CG1-CG 4.13Å; V2096-L2223 HydrophobicContact CG2-CD1 4.39Å; V2096-L2223 HydrophobicContact CG2-CD2 4.15Å; V2096-L2223 HydrophobicContact CG2-CG 4.39Å; H2220-L2223 WeakPolarHBondContact O-CB 3.38Å; H2220-L2223 PolarHBondContact O-N 3.19Å; H2220-L2223 VanDerWaalsContact O-N 3.1Å; E2221-L2223 PolarHBondContact O-N 3.01Å; E2221-L2223 VanDerWaalsContact O-N 3.16Å; L2223-P2225 WeakPolarHBondContact O-CD 3.28Å; L2223-V2493 HydrophobicContact CD1-CB 3.85Å; L2223-V2493 HydrophobicContact CD1-CG1 3.8Å; L2223-V2493 VanDerWaalsContact CD1-CG1 3.49Å; L2223-R2496 HydrophobicContact CB-CB 3.96Å; L2223-R2496 HydrophobicContact CD1-CB 4.29Å; L2223-R2496 VanDerWaalsContact O-CD 3.24Å; L2223-R2496 WeakPolarHBondContact O-CD 3.36Å; L2223-R2496 PolarHBondContact O-NH1 2.9Å; L2223-R2496 VanDerWaalsContact O-NH1 3.16Å
2224	T	83.1	Confident	78.7	Confident	77.4 Å²	77.4	59 Å²	59	48%	0.475	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-67.2	123.5	169.7	56.8	0	0	0	0	110	T2088	T2088-T2224 WeakPolarHBondContact CB-OG1 3.39Å; T2088-T2224 PolarHBondContact OG1-OG1 3.04Å
2225	P	87.4	Confident	81.4	Confident	18.4 Å²	18.4	56.9 Å²	56.9	12%	0.119	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-68.2	144.5	179.1	27.6	-33.9	0	0	0	111.7	L2085 L2223 H2227 H2228 R2496 H2499	L2085-P2225 HydrophobicContact CD1-CG 4.22Å; L2223-P2225 WeakPolarHBondContact O-CD 3.28Å; P2225-H2227 VanDerWaalsContact C-N 3.35Å; P2225-H2228 HydrophobicContact CG-CB 4.29Å; P2225-R2496 CarbonylContact C-O 3.51Å; P2225-R2496 VanDerWaalsContact CA-O 3.31Å; P2225-R2496 WeakPolarHBondContact CA-O 3.33Å; P2225-R2496 HydrophobicContact CB-CG 4.07Å; P2225-H2499 HydrophobicContact CB-CB 3.73Å; P2225-H2499 HydrophobicContact CG-CB 3.81Å
2226	V	87.7	Confident	84	Confident	24.6 Å²	24.6	50.7 Å²	50.7	15%	0.149	27%	0.265	C	S	.	.	S	Bend	trans	-67.7	-42.7	175.3	-178.3	0	0	0	0	110.7	Q2084 L2085 P2087 E2495 R2496 N2497	Q2084-V2226 CarbonylContact C-O 3.53Å; Q2084-V2226 VanDerWaalsContact CA-O 3.23Å; Q2084-V2226 WeakPolarHBondContact CA-O 3.37Å; Q2084-V2226 HydrophobicContact CG-CG1 4.46Å; Q2084-V2226 VanDerWaalsContact CG-O 3.28Å; Q2084-V2226 WeakPolarHBondContact CG-O 3.34Å; L2085-V2226 PolarHBondContact N-O 3.33Å; L2085-V2226 VanDerWaalsContact N-O 3.14Å; P2087-V2226 HydrophobicContact CB-CG2 4.14Å; P2087-V2226 HydrophobicContact CG-CG1 4.12Å; P2087-V2226 HydrophobicContact CG-CG2 3.98Å; V2226-E2495 HydrophobicContact CG2-CG 4.17Å; V2226-E2495 WeakPolarHBondContact CG2-OE1 3.3Å; V2226-R2496 PolarHBondContact N-O 3.27Å; V2226-N2497 WeakPolarHBondContact CB-O 3.01Å; V2226-N2497 PolarHBondContact N-O 2.79Å
2227	H	92.4	Very high	86	Confident	34 Å²	34	47.4 Å²	47.4	16%	0.157	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	125.6	176.3	-59.8	-76.5	0	0	0	109.9	Y2082 Q2084 P2225 N2497 W2498 H2499	Y2082-H2227 HydrophobicContact CE2-CB 4.15Å; Y2082-H2227 AromaticContact CE2-ND1 3.77Å; Y2082-H2227 AromaticContact CZ-ND1 3.68Å; Y2082-H2227 PolarHBondContact OH-CE1 2.87Å; Y2082-H2227 PolarHBondContact OH-ND1 3.22Å; Q2084-H2227 VanDerWaalsContact CD-CE1 3.44Å; Q2084-H2227 PolarHBondContact NE2-CE1 2.86Å; P2225-H2227 VanDerWaalsContact C-N 3.35Å; H2227-N2497 WeakPolarHBondContact CB-O 3.33Å; H2227-N2497 PolarHBondContact CD2-O 3.08Å; H2227-N2497 PolarHBondContact N-O 3.04Å; H2227-N2497 VanDerWaalsContact N-O 3.15Å; H2227-W2498 HydrophobicContact CB-CD2 3.58Å; H2227-W2498 VanDerWaalsContact CB-CD2 3.45Å; H2227-W2498 HydrophobicContact CB-CE3 3.47Å; H2227-W2498 VanDerWaalsContact CB-CE3 3.45Å; H2227-W2498 HydrophobicContact CB-CG 4.15Å; H2227-W2498 HydrophobicContact CB-CH2 4.15Å; H2227-W2498 HydrophobicContact CB-CZ2 4.12Å; H2227-W2498 HydrophobicContact CB-CZ3 3.77Å; H2227-W2498 AromaticContact CD2-CD2 3.96Å; H2227-W2498 AromaticContact CD2-CE2 3.73Å; H2227-W2498 AromaticContact CD2-CH2 3.7Å; H2227-W2498 AromaticContact CD2-CZ2 3.81Å; H2227-W2498 AromaticContact CD2-NE1 3.8Å; H2227-W2498 AromaticContact CG-CD2 3.93Å; H2227-W2498 AromaticContact CG-CE2 3.73Å; H2227-W2498 AromaticContact CG-CE3 3.99Å; H2227-W2498 AromaticContact CG-CH2 3.98Å; H2227-W2498 AromaticContact CG-CZ2 3.78Å; H2227-W2498 AromaticContact CG-CZ3 3.86Å; H2227-W2498 AromaticContact ND1-CH2 3.91Å; H2227-W2498 AromaticContact ND1-CZ2 3.83Å; H2227-W2498 CarbonylContact O-C 3.49Å; H2227-W2498 VanDerWaalsContact O-CA 3.29Å; H2227-W2498 WeakPolarHBondContact O-CA 3.33Å; H2227-H2499 PolarHBondContact O-N 3.18Å
2228	H	93.6	Very high	87.4	Confident	49.4 Å²	49.4	43.9 Å²	43.9	23%	0.229	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	130.5	172.9	-179.8	121	0	0	0	108.9	Y2082 Q2083 L2085 P2225 H2499	Y2082-H2228 CarbonylContact C-O 3.49Å; Y2082-H2228 WeakPolarHBondContact CA-O 3.36Å; Q2083-H2228 HydrophobicContact CB-CB 4.42Å; Q2083-H2228 PolarHBondContact N-O 2.92Å; Q2083-H2228 PolarHBondContact O-N 3.14Å; L2085-H2228 HydrophobicContact CD1-CB 3.54Å; L2085-H2228 HydrophobicContact CG-CB 4.3Å; P2225-H2228 HydrophobicContact CG-CB 4.29Å; H2228-H2499 CarbonylContact C-O 3.48Å; H2228-H2499 WeakPolarHBondContact CA-O 3.41Å; H2228-H2499 AromaticContact CD2-CD2 3.7Å; H2228-H2499 AromaticContact CE1-CD2 3.64Å; H2228-H2499 AromaticContact ND1-CD2 3.42Å; H2228-H2499 PolarHBondContact ND1-CD2 3.15Å; H2228-H2499 AromaticContact NE2-CD2 3.81Å
2229	L	94.8	Very high	88.3	Confident	31.2 Å²	31.2	40.7 Å²	40.7	16%	0.163	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	113.1	-179.9	179.2	57.2	0	0	0	109.3	L2080 R2081 I2231 W2498 H2499 L2500 E2501	L2080-L2229 HydrophobicContact CD1-CD1 4.14Å; L2080-L2229 HydrophobicContact CD2-CD1 3.71Å; L2080-L2229 HydrophobicContact CG-CD1 3.73Å; R2081-L2229 CarbonylContact O-C 3.54Å; R2081-L2229 WeakPolarHBondContact O-CA 3.39Å; R2081-L2229 WeakPolarHBondContact O-CD1 3.39Å; L2229-I2231 HydrophobicContact CD1-CD1 4.32Å; L2229-I2231 HydrophobicContact CD1-CG1 4.12Å; L2229-I2231 HydrophobicContact CD2-CD1 4.17Å; L2229-I2231 HydrophobicContact CD2-CG1 4.41Å; L2229-I2231 HydrophobicContact CG-CD1 4.14Å; L2229-I2231 HydrophobicContact CG-CG1 4.02Å; L2229-W2498 HydrophobicContact CD2-CZ3 4.36Å; L2229-H2499 PolarHBondContact N-O 3.08Å; L2229-L2500 HydrophobicContact CB-CD1 4.03Å; L2229-L2500 HydrophobicContact CD2-CD1 3.84Å; L2229-L2500 HydrophobicContact CG-CD1 3.71Å; L2229-L2500 CarbonylContact O-C 3.49Å; L2229-L2500 WeakPolarHBondContact O-CA 3.44Å; L2229-E2501 PolarHBondContact O-N 3.27Å
2230	E	94.4	Very high	88.6	Confident	35.6 Å²	35.6	41.7 Å²	41.7	17%	0.166	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	128.1	176.7	-178.4	-172.3	-160.8	0	0	108.4	R2081 H2232 E2501 I2503	R2081-E2230 HydrophobicContact CB-CB 4.31Å; R2081-E2230 WeakPolarHBondContact CD-OE2 3.32Å; R2081-E2230 IonicContact CZ-OE2 3.22Å; R2081-E2230 PolarHBondContact N-O 3.25Å; R2081-E2230 IonicContact NE-OE2 3.15Å; R2081-E2230 VanDerWaalsContact NH1-CD 3.32Å; R2081-E2230 IonicContact NH1-OE1 3.87Å; R2081-E2230 PolarHBondContact NH1-OE1 2.8Å; R2081-E2230 IonicContact NH1-OE2 2.86Å; R2081-E2230 PolarHBondContact NH1-OE2 2.99Å; R2081-E2230 PolarHBondContact O-N 3.17Å; E2230-H2232 WeakPolarHBondContact CG-NE2 3.49Å; E2230-H2232 IonicContact OE1-CD2 2.75Å; E2230-H2232 IonicContact OE1-CE1 3.33Å; E2230-H2232 PolarHBondContact OE1-CE1 2.95Å; E2230-H2232 VanDerWaalsContact OE1-CE1 3.26Å; E2230-H2232 IonicContact OE1-NE2 3.16Å; E2230-H2232 PolarHBondContact OE1-NE2 3.16Å; E2230-H2232 VanDerWaalsContact OE1-NE2 3.14Å; E2230-H2232 IonicContact OE2-NE2 3.11Å; E2230-E2501 CarbonylContact C-O 3.56Å; E2230-E2501 WeakPolarHBondContact CA-O 3.38Å; E2230-I2503 HydrophobicContact CG-CD1 4.08Å; E2230-I2503 VanDerWaalsContact OE1-CD1 3.25Å; E2230-I2503 WeakPolarHBondContact OE1-CD1 3.45Å
2231	I	94.7	Very high	88.8	Confident	14.8 Å²	14.8	46.3 Å²	46.3	8%	0.076	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	119.5	-177.7	-50.3	-172.5	0	0	0	109.1	V2077 L2079 L2080 L2229 F2234 L2500 E2501 L2502 I2503	V2077-I2231 HydrophobicContact CB-CG2 4.3Å; V2077-I2231 HydrophobicContact CG1-CG2 3.48Å; V2077-I2231 VanDerWaalsContact CG1-CG2 3.45Å; V2077-I2231 HydrophobicContact CG2-CG2 3.78Å; L2079-I2231 WeakPolarHBondContact O-CA 3.08Å; L2080-I2231 HydrophobicContact CD1-CD1 4.33Å; L2080-I2231 HydrophobicContact CD1-CG1 4.47Å; L2080-I2231 HydrophobicContact CG-CG1 4.39Å; L2229-I2231 HydrophobicContact CD1-CD1 4.32Å; L2229-I2231 HydrophobicContact CD1-CG1 4.12Å; L2229-I2231 HydrophobicContact CD2-CD1 4.17Å; L2229-I2231 HydrophobicContact CD2-CG1 4.41Å; L2229-I2231 HydrophobicContact CG-CD1 4.14Å; L2229-I2231 HydrophobicContact CG-CG1 4.02Å; I2231-F2234 HydrophobicContact CG2-CB 3.95Å; I2231-F2234 HydrophobicContact CG2-CD2 4.24Å; I2231-F2234 HydrophobicContact CG2-CG 4.44Å; I2231-L2500 HydrophobicContact CD1-CD1 3.86Å; I2231-L2500 HydrophobicContact CG1-CD1 4.13Å; I2231-E2501 PolarHBondContact N-O 3.27Å; I2231-L2502 HydrophobicContact CB-CD2 3.75Å; I2231-L2502 HydrophobicContact CD1-CD2 3.78Å; I2231-L2502 HydrophobicContact CG1-CD2 3.97Å; I2231-L2502 HydrophobicContact CG2-CD2 4.45Å; I2231-L2502 CarbonylContact O-C 3.51Å; I2231-L2502 WeakPolarHBondContact O-CA 3.33Å; I2231-I2503 PolarHBondContact O-N 3.07Å
2232	H	92.8	Very high	89	Confident	45.8 Å²	45.8	42.6 Å²	42.6	21%	0.212	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	141.9	178.4	-57.8	-103.2	0	0	0	111.3	P2078 L2079 E2230 F2234 I2503	P2078-H2232 WeakPolarHBondContact CD-O 3.42Å; L2079-H2232 HydrophobicContact CB-CB 4.26Å; L2079-H2232 PolarHBondContact O-N 2.8Å; E2230-H2232 WeakPolarHBondContact CG-NE2 3.49Å; E2230-H2232 IonicContact OE1-CD2 2.75Å; E2230-H2232 IonicContact OE1-CE1 3.33Å; E2230-H2232 PolarHBondContact OE1-CE1 2.95Å; E2230-H2232 VanDerWaalsContact OE1-CE1 3.26Å; E2230-H2232 IonicContact OE1-NE2 3.16Å; E2230-H2232 PolarHBondContact OE1-NE2 3.16Å; E2230-H2232 VanDerWaalsContact OE1-NE2 3.14Å; E2230-H2232 IonicContact OE2-NE2 3.11Å; H2232-F2234 PolarHBondContact O-N 3.13Å; H2232-I2503 VanDerWaalsContact CE1-CD1 3.43Å; H2232-I2503 WeakPolarHBondContact CE1-CD1 3.28Å; H2232-I2503 WeakPolarHBondContact ND1-CB 3.17Å; H2232-I2503 WeakPolarHBondContact ND1-CD1 3.43Å
2233	E	91.4	Very high	89.2	Confident	36.4 Å²	36.4	39.1 Å²	39.1	17%	0.17	19%	0.189	C	C	.	.	S	Bend	trans	54.3	36.8	174.7	-59	-78.8	146.3	0	0	113.3	P2078 K2235 I2503 N2504 T2593	P2078-E2233 HydrophobicContact CB-CB 4.42Å; P2078-E2233 WeakPolarHBondContact CD-O 3.32Å; P2078-E2233 HydrophobicContact CG-CB 3.78Å; E2233-K2235 PolarHBondContact O-N 3.03Å; E2233-K2235 IonicContact OE2-NZ 2.92Å; E2233-K2235 PolarHBondContact OE2-NZ 2.83Å; E2233-I2503 PolarHBondContact N-O 3.01Å; E2233-N2504 HydrophobicContact CG-CB 4.45Å; E2233-N2504 VanDerWaalsContact OE1-CB 3.27Å; E2233-N2504 WeakPolarHBondContact OE1-CB 3.38Å; E2233-N2504 PolarHBondContact OE1-ND2 3.39Å; E2233-T2593 VanDerWaalsContact CD-CG2 3.41Å; E2233-T2593 VanDerWaalsContact CD-OG1 3.31Å; E2233-T2593 WeakPolarHBondContact OE1-CB 3.44Å; E2233-T2593 VanDerWaalsContact OE1-CG2 3.22Å; E2233-T2593 WeakPolarHBondContact OE1-CG2 3.29Å; E2233-T2593 PolarHBondContact OE1-OG1 2.82Å; E2233-T2593 WeakPolarHBondContact OE2-CG2 3.31Å; E2233-T2593 PolarHBondContact OE2-OG1 2.84Å
2234	F	93.2	Very high	89.3	Confident	36.8 Å²	36.8	40.9 Å²	40.9	16%	0.161	20%	0.199	C	C	.	.			trans	-58.7	120.4	178.4	174.7	-94.5	0	0	0	110.7	I2075 V2077 I2231 H2232 M2236 L2502 P2505 Q2506	I2075-F2234 HydrophobicContact CD1-CE2 4.4Å; I2075-F2234 HydrophobicContact CD1-CZ 4.46Å; I2075-F2234 HydrophobicContact CG1-CE2 4.41Å; I2075-F2234 HydrophobicContact CG1-CZ 4.42Å; I2075-F2234 HydrophobicContact CG2-CD2 4.18Å; I2075-F2234 HydrophobicContact CG2-CE2 3.68Å; I2075-F2234 HydrophobicContact CG2-CZ 4.4Å; V2077-F2234 HydrophobicContact CG2-CB 4.42Å; V2077-F2234 HydrophobicContact CG2-CD2 3.64Å; V2077-F2234 HydrophobicContact CG2-CE2 4.36Å; V2077-F2234 HydrophobicContact CG2-CG 4.43Å; I2231-F2234 HydrophobicContact CG2-CB 3.95Å; I2231-F2234 HydrophobicContact CG2-CD2 4.24Å; I2231-F2234 HydrophobicContact CG2-CG 4.44Å; H2232-F2234 PolarHBondContact O-N 3.13Å; F2234-M2236 HydrophobicContact CD1-CB 4.39Å; F2234-M2236 HydrophobicContact CE1-CB 3.55Å; F2234-M2236 VanDerWaalsContact CE1-CB 3.45Å; F2234-M2236 HydrophobicContact CE1-CG 4.43Å; F2234-M2236 HydrophobicContact CE1-SD 4.26Å; F2234-M2236 HydrophobicContact CZ-CB 3.66Å; F2234-M2236 HydrophobicContact CZ-CG 4.34Å; F2234-M2236 HydrophobicContact CZ-SD 3.94Å; F2234-L2502 HydrophobicContact CD1-CD1 4.5Å; F2234-P2505 HydrophobicContact CB-CB 4.37Å; F2234-P2505 HydrophobicContact CD1-CB 4.23Å; F2234-P2505 CarbonylContact O-C 3.56Å; F2234-P2505 VanDerWaalsContact O-CA 3.28Å; F2234-P2505 WeakPolarHBondContact O-CA 3.35Å; F2234-Q2506 PolarHBondContact O-N 3.17Å
2235	K	92.9	Very high	89.4	Confident	42.4 Å²	42.4	38.5 Å²	38.5	18%	0.184	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	123.9	178.6	-73.8	165.8	-177.3	176.2	0	109.5	I2075 L2076 E2233 Q2506 W2590	I2075-K2235 CarbonylContact C-O 3.51Å; I2075-K2235 VanDerWaalsContact CA-O 3.29Å; I2075-K2235 WeakPolarHBondContact CA-O 3.39Å; L2076-K2235 HydrophobicContact CB-CB 4.17Å; L2076-K2235 PolarHBondContact N-O 3.14Å; L2076-K2235 PolarHBondContact O-N 3.01Å; E2233-K2235 PolarHBondContact O-N 3.03Å; E2233-K2235 IonicContact OE2-NZ 2.92Å; E2233-K2235 PolarHBondContact OE2-NZ 2.83Å; K2235-Q2506 CarbonylContact C-O 3.57Å; K2235-Q2506 VanDerWaalsContact CA-O 3.32Å; K2235-Q2506 WeakPolarHBondContact CA-O 3.31Å; K2235-Q2506 HydrophobicContact CG-CB 4.14Å; K2235-Q2506 HydrophobicContact CG-CG 4.42Å; K2235-W2590 HydrophobicContact CB-CD2 4.26Å; K2235-W2590 HydrophobicContact CB-CE3 4.1Å; K2235-W2590 HydrophobicContact CB-CH2 3.99Å; K2235-W2590 HydrophobicContact CB-CZ2 4.06Å; K2235-W2590 HydrophobicContact CB-CZ3 3.94Å; K2235-W2590 HydrophobicContact CD-CB 4.38Å; K2235-W2590 HydrophobicContact CD-CD2 4.04Å; K2235-W2590 HydrophobicContact CD-CE3 4.22Å; K2235-W2590 HydrophobicContact CD-CG 4.02Å; K2235-W2590 HydrophobicContact CG-CD2 4.12Å; K2235-W2590 HydrophobicContact CG-CE3 3.85Å; K2235-W2590 HydrophobicContact CG-CZ3 4.12Å
2236	M	92.8	Very high	89.4	Confident	41.4 Å²	41.4	39.8 Å²	39.8	20%	0.204	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	130	-179	177.7	171.6	138	0	0	111.9	F2074 I2075 F2234 W2238 Q2506 L2507 M2508 W2590	F2074-M2236 HydrophobicContact CE2-CE 3.9Å; F2074-M2236 HydrophobicContact CE2-CG 4.22Å; F2074-M2236 HydrophobicContact CE2-SD 4.4Å; F2074-M2236 HydrophobicContact CZ-CE 3.73Å; F2074-M2236 HydrophobicContact CZ-CG 4.43Å; F2074-M2236 HydrophobicContact CZ-SD 4.38Å; F2074-M2236 CarbonylContact O-C 3.59Å; F2074-M2236 WeakPolarHBondContact O-CA 3.39Å; I2075-M2236 HydrophobicContact CD1-CG 4.42Å; I2075-M2236 HydrophobicContact CD1-SD 4.27Å; I2075-M2236 HydrophobicContact CG1-CB 4.15Å; I2075-M2236 HydrophobicContact CG1-CG 3.95Å; I2075-M2236 HydrophobicContact CG1-SD 4.33Å; F2234-M2236 HydrophobicContact CD1-CB 4.39Å; F2234-M2236 HydrophobicContact CE1-CB 3.55Å; F2234-M2236 VanDerWaalsContact CE1-CB 3.45Å; F2234-M2236 HydrophobicContact CE1-CG 4.43Å; F2234-M2236 HydrophobicContact CE1-SD 4.26Å; F2234-M2236 HydrophobicContact CZ-CB 3.66Å; F2234-M2236 HydrophobicContact CZ-CG 4.34Å; F2234-M2236 HydrophobicContact CZ-SD 3.94Å; M2236-W2238 HydrophobicContact CE-CB 4.28Å; M2236-W2238 HydrophobicContact CE-CD2 4.28Å; M2236-W2238 HydrophobicContact CE-CE3 3.61Å; M2236-W2238 VanDerWaalsContact CE-CE3 3.43Å; M2236-W2238 HydrophobicContact CE-CG 4.47Å; M2236-W2238 HydrophobicContact CE-CZ3 3.93Å; M2236-W2238 HydrophobicContact SD-CE3 4.47Å; M2236-Q2506 PolarHBondContact N-O 3.09Å; M2236-L2507 HydrophobicContact CB-CD1 4.11Å; M2236-L2507 HydrophobicContact CE-CD1 3.98Å; M2236-L2507 HydrophobicContact CE-CD2 4.45Å; M2236-L2507 HydrophobicContact CG-CD1 4.01Å; M2236-L2507 CarbonylContact O-C 3.57Å; M2236-L2507 WeakPolarHBondContact O-CA 3.27Å; M2236-L2507 WeakPolarHBondContact O-CD1 3.48Å; M2236-L2507 HydrophobicContact SD-CD1 4.13Å; M2236-M2508 PolarHBondContact O-N 2.9Å; M2236-W2590 WeakPolarHBondContact O-CH2 3.49Å
2237	R	89.3	Confident	89.2	Confident	25.4 Å²	25.4	42.7 Å²	42.7	10%	0.096	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	109.2	174.2	-75.8	-170.9	161.4	88.3	3	110.2	I2071 E2072 A2073 F2074 T2239 H2242 M2508 D2588 W2590	I2071-R2237 PolarHBondContact O-NH1 3.4Å; E2072-R2237 VanDerWaalsContact CD-NE 3.29Å; E2072-R2237 IonicContact OE1-CZ 2.71Å; E2072-R2237 VanDerWaalsContact OE1-CZ 3.31Å; E2072-R2237 IonicContact OE1-NE 3.81Å; E2072-R2237 PolarHBondContact OE1-NE 3.31Å; E2072-R2237 IonicContact OE1-NH2 3.64Å; E2072-R2237 PolarHBondContact OE1-NH2 3.34Å; E2072-R2237 WeakPolarHBondContact OE2-CD 3.34Å; E2072-R2237 IonicContact OE2-CZ 2.67Å; E2072-R2237 IonicContact OE2-NE 3.46Å; E2072-R2237 PolarHBondContact OE2-NE 2.71Å; E2072-R2237 IonicContact OE2-NH2 3.35Å; A2073-R2237 WeakPolarHBondContact O-CD 3.42Å; A2073-R2237 VanDerWaalsContact O-CG 3.27Å; A2073-R2237 WeakPolarHBondContact O-CG 3.48Å; A2073-R2237 PolarHBondContact O-NH1 3.08Å; F2074-R2237 VanDerWaalsContact CD2-O 3.29Å; F2074-R2237 WeakPolarHBondContact CD2-O 3.3Å; F2074-R2237 VanDerWaalsContact CE2-O 3.3Å; F2074-R2237 WeakPolarHBondContact CE2-O 3.38Å; F2074-R2237 PolarHBondContact O-N 3.18Å; R2237-T2239 HydrophobicContact CB-CG2 4.41Å; R2237-T2239 HydrophobicContact CG-CG2 3.84Å; R2237-T2239 PolarHBondContact O-N 3.06Å; R2237-H2242 PolarHBondContact O-ND1 3.06Å; R2237-M2508 HydrophobicContact CB-CE 4.09Å; R2237-M2508 HydrophobicContact CG-CE 3.75Å; R2237-M2508 VanDerWaalsContact NE-CE 3.29Å; R2237-M2508 PolarHBondContact NH2-SD 3.09Å; R2237-D2588 IonicContact CZ-OD2 3.25Å; R2237-D2588 VanDerWaalsContact CZ-OD2 3.23Å; R2237-D2588 IonicContact NE-OD2 3.01Å; R2237-D2588 PolarHBondContact NE-OD2 2.88Å; R2237-D2588 VanDerWaalsContact NE-OD2 3.08Å; R2237-D2588 IonicContact NH2-OD2 3.1Å; R2237-D2588 PolarHBondContact NH2-OD2 3.07Å; R2237-D2588 VanDerWaalsContact NH2-OD2 3.09Å; R2237-W2590 HydrophobicContact CG-CH2 3.97Å; R2237-W2590 HydrophobicContact CG-CZ2 3.61Å
2238	W	90.1	Very high	88.7	Confident	49.4 Å²	49.4	44.8 Å²	44.8	19%	0.187	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	95.2	172.2	-164.6	-110	0	0	0	109.7	F2074 M2236 R2243 V2246 L2507 M2508 L2509 K2510 L2783	F2074-W2238 AromaticContact CE2-CE3 3.99Å; F2074-W2238 HydrophobicContact CE2-CE3 4.07Å; F2074-W2238 HydrophobicContact CE2-CZ3 4.29Å; F2074-W2238 HydrophobicContact CZ-CE3 4.35Å; F2074-W2238 HydrophobicContact CZ-CZ3 4.25Å; M2236-W2238 HydrophobicContact CE-CB 4.28Å; M2236-W2238 HydrophobicContact CE-CD2 4.28Å; M2236-W2238 HydrophobicContact CE-CE3 3.61Å; M2236-W2238 VanDerWaalsContact CE-CE3 3.43Å; M2236-W2238 HydrophobicContact CE-CG 4.47Å; M2236-W2238 HydrophobicContact CE-CZ3 3.93Å; M2236-W2238 HydrophobicContact SD-CE3 4.47Å; W2238-R2243 HydrophobicContact CH2-CB 4.33Å; W2238-R2243 HydrophobicContact CH2-CG 4.29Å; W2238-R2243 HydrophobicContact CZ2-CB 3.9Å; W2238-R2243 HydrophobicContact CZ2-CG 3.78Å; W2238-V2246 HydrophobicContact CH2-CB 4.26Å; W2238-V2246 HydrophobicContact CH2-CG1 4.3Å; W2238-V2246 HydrophobicContact CZ3-CB 4.33Å; W2238-V2246 HydrophobicContact CZ3-CG1 4.25Å; W2238-V2246 HydrophobicContact CZ3-CG2 4.16Å; W2238-L2507 HydrophobicContact CB-CD1 3.95Å; W2238-M2508 WeakPolarHBondContact CA-O 3.4Å; W2238-M2508 WeakPolarHBondContact CB-O 3.29Å; W2238-M2508 PolarHBondContact N-O 3.18Å; W2238-L2509 HydrophobicContact CB-CD2 3.9Å; W2238-L2509 HydrophobicContact CG-CD2 4.3Å; W2238-K2510 PolarHBondContact O-N 3.2Å; W2238-K2510 VanDerWaalsContact O-N 3.15Å; W2238-L2783 HydrophobicContact CG-CD2 4.38Å; W2238-L2783 HydrophobicContact CG-CG 4.49Å; W2238-L2783 VanDerWaalsContact NE1-CD2 3.33Å; W2238-L2783 PolarHBondContact NE1-O 3.08Å; W2238-L2783 WeakPolarHBondContact O-CD2 3.3Å
2239	T	85.9	Confident	88.3	Confident	16.8 Å²	16.8	44.3 Å²	44.3	10%	0.103	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	165.2	173.4	64.5	0	0	0	0	109.9	R2237 Q2241 H2242 R2243 K2510	R2237-T2239 HydrophobicContact CB-CG2 4.41Å; R2237-T2239 HydrophobicContact CG-CG2 3.84Å; R2237-T2239 PolarHBondContact O-N 3.06Å; T2239-Q2241 VanDerWaalsContact C-N 3.28Å; T2239-Q2241 PolarHBondContact O-N 3.11Å; T2239-H2242 PolarHBondContact O-N 2.97Å; T2239-H2242 PolarHBondContact OG1-CD2 3.48Å; T2239-H2242 VanDerWaalsContact OG1-CG 3.29Å; T2239-H2242 PolarHBondContact OG1-N 3.2Å; T2239-H2242 VanDerWaalsContact OG1-N 3.13Å; T2239-H2242 PolarHBondContact OG1-ND1 3.07Å; T2239-H2242 VanDerWaalsContact OG1-ND1 3.16Å; T2239-R2243 VanDerWaalsContact O-CB 3.29Å; T2239-R2243 WeakPolarHBondContact O-CB 3.42Å; T2239-R2243 PolarHBondContact O-N 3.06Å; T2239-K2510 WeakPolarHBondContact CA-O 3.41Å; T2239-K2510 HydrophobicContact CG2-CB 4.31Å; T2239-K2510 HydrophobicContact CG2-CD 4.26Å; T2239-K2510 HydrophobicContact CG2-CG 4.07Å
2240	E	82.4	Confident	87.7	Confident	59 Å²	59	46.3 Å²	46.3	28%	0.276	22%	0.219	S	C	.	.	H	α-helix	trans	-58.4	-39.9	175.1	-170.7	-178.3	-168	0	0	112.3	H2242 R2243 N2244 N2512 L2783	E2240-H2242 PolarHBondContact O-N 2.52Å; E2240-R2243 VanDerWaalsContact CD-NH2 3.28Å; E2240-R2243 VanDerWaalsContact CG-CZ 3.4Å; E2240-R2243 VanDerWaalsContact CG-NH1 3.26Å; E2240-R2243 WeakPolarHBondContact O-CB 3.25Å; E2240-R2243 PolarHBondContact O-N 3.1Å; E2240-R2243 IonicContact OE1-CZ 2.99Å; E2240-R2243 IonicContact OE1-NH1 2.86Å; E2240-R2243 PolarHBondContact OE1-NH1 3.16Å; E2240-R2243 IonicContact OE1-NH2 3.41Å; E2240-R2243 PolarHBondContact OE1-NH2 3.2Å; E2240-R2243 VanDerWaalsContact OE1-NH2 3.1Å; E2240-R2243 IonicContact OE2-NH2 3.65Å; E2240-N2244 VanDerWaalsContact CG-ND2 3.33Å; E2240-N2244 WeakPolarHBondContact CG-ND2 3.3Å; E2240-N2244 WeakPolarHBondContact O-CB 3.36Å; E2240-N2244 PolarHBondContact O-N 2.99Å; E2240-N2244 VanDerWaalsContact O-N 3.09Å; E2240-N2244 PolarHBondContact O-ND2 2.99Å; E2240-N2244 PolarHBondContact O-OD1 3.01Å; E2240-N2244 PolarHBondContact OE1-ND2 3.15Å; E2240-N2512 WeakPolarHBondContact CB-ND2 3.36Å; E2240-N2512 WeakPolarHBondContact CB-OD1 3.39Å; E2240-N2512 PolarHBondContact OE2-ND2 3.21Å; E2240-L2783 HydrophobicContact CB-CD1 4.38Å
2241	Q	82.5	Confident	87.1	Confident	108.8 Å²	108.8	47.9 Å²	47.9	51%	0.508	23%	0.229	S	C	.	.	H	α-helix	trans	-59.6	-52.9	174.9	-164.4	177.6	-16.1	0	0	111	T2239 R2243 N2244 L2245	T2239-Q2241 VanDerWaalsContact C-N 3.28Å; T2239-Q2241 PolarHBondContact O-N 3.11Å; Q2241-R2243 VanDerWaalsContact C-N 3.32Å; Q2241-R2243 PolarHBondContact O-N 3.07Å; Q2241-N2244 PolarHBondContact O-N 3.04Å; Q2241-N2244 VanDerWaalsContact O-N 3.12Å; Q2241-L2245 WeakPolarHBondContact O-CB 3.07Å; Q2241-L2245 WeakPolarHBondContact O-CG 3.26Å; Q2241-L2245 PolarHBondContact O-N 3.31Å; Q2241-L2245 VanDerWaalsContact O-N 3.08Å
2242	H	85.8	Confident	86.3	Confident	22.4 Å²	22.4	49.2 Å²	49.2	10%	0.104	24%	0.239	C	C	.	.	H	α-helix	trans	-61.8	-42	179.5	-65.2	159.8	0	0	0	112.1	L2015 F2074 R2237 T2239 E2240 N2244 L2245 V2246	L2015-H2242 HydrophobicContact CD1-CB 4.17Å; F2074-H2242 HydrophobicContact CD2-CB 3.71Å; F2074-H2242 AromaticContact CD2-CG 3.58Å; F2074-H2242 AromaticContact CD2-ND1 3.53Å; F2074-H2242 WeakPolarHBondContact CD2-ND1 3.31Å; F2074-H2242 HydrophobicContact CE2-CB 3.87Å; R2237-H2242 PolarHBondContact O-ND1 3.06Å; T2239-H2242 PolarHBondContact O-N 2.97Å; T2239-H2242 PolarHBondContact OG1-CD2 3.48Å; T2239-H2242 VanDerWaalsContact OG1-CG 3.29Å; T2239-H2242 PolarHBondContact OG1-N 3.2Å; T2239-H2242 VanDerWaalsContact OG1-N 3.13Å; T2239-H2242 PolarHBondContact OG1-ND1 3.07Å; T2239-H2242 VanDerWaalsContact OG1-ND1 3.16Å; E2240-H2242 PolarHBondContact O-N 2.52Å; H2242-N2244 VanDerWaalsContact C-N 3.34Å; H2242-N2244 PolarHBondContact O-N 3.18Å; H2242-L2245 PolarHBondContact O-N 3.06Å; H2242-V2246 WeakPolarHBondContact O-CB 3.23Å; H2242-V2246 VanDerWaalsContact O-CG2 3.31Å; H2242-V2246 WeakPolarHBondContact O-CG2 3.37Å; H2242-V2246 PolarHBondContact O-N 3.1Å
2243	R	85.3	Confident	85.8	Confident	25.8 Å²	25.8	53.2 Å²	53.2	10%	0.097	25%	0.253	C	S	.	.	H	α-helix	trans	-54.3	-50.4	173.7	178.5	-165.6	74	-165.5	-3.4	111.2	W2238 T2239 E2240 Q2241 L2245 V2246 Y2247 N2512 D2782	W2238-R2243 HydrophobicContact CH2-CB 4.33Å; W2238-R2243 HydrophobicContact CH2-CG 4.29Å; W2238-R2243 HydrophobicContact CZ2-CB 3.9Å; W2238-R2243 HydrophobicContact CZ2-CG 3.78Å; T2239-R2243 VanDerWaalsContact O-CB 3.29Å; T2239-R2243 WeakPolarHBondContact O-CB 3.42Å; T2239-R2243 PolarHBondContact O-N 3.06Å; E2240-R2243 VanDerWaalsContact CD-NH2 3.28Å; E2240-R2243 VanDerWaalsContact CG-CZ 3.4Å; E2240-R2243 VanDerWaalsContact CG-NH1 3.26Å; E2240-R2243 WeakPolarHBondContact O-CB 3.25Å; E2240-R2243 PolarHBondContact O-N 3.1Å; E2240-R2243 IonicContact OE1-CZ 2.99Å; E2240-R2243 IonicContact OE1-NH1 2.86Å; E2240-R2243 PolarHBondContact OE1-NH1 3.16Å; E2240-R2243 IonicContact OE1-NH2 3.41Å; E2240-R2243 PolarHBondContact OE1-NH2 3.2Å; E2240-R2243 VanDerWaalsContact OE1-NH2 3.1Å; E2240-R2243 IonicContact OE2-NH2 3.65Å; Q2241-R2243 VanDerWaalsContact C-N 3.32Å; Q2241-R2243 PolarHBondContact O-N 3.07Å; R2243-L2245 VanDerWaalsContact C-N 3.31Å; R2243-L2245 PolarHBondContact O-N 3.28Å; R2243-V2246 PolarHBondContact O-N 3.06Å; R2243-Y2247 HydrophobicContact CG-CD2 3.97Å; R2243-Y2247 HydrophobicContact CG-CE2 3.52Å; R2243-Y2247 VanDerWaalsContact CG-CE2 3.45Å; R2243-Y2247 WeakPolarHBondContact O-CD2 3.38Å; R2243-Y2247 PolarHBondContact O-N 2.99Å; R2243-Y2247 VanDerWaalsContact O-N 3.07Å; R2243-N2512 PolarHBondContact NH2-ND2 3.41Å; R2243-D2782 IonicContact CZ-OD2 2.81Å; R2243-D2782 PolarHBondContact NH1-O 3.08Å; R2243-D2782 IonicContact NH1-OD2 3.99Å; R2243-D2782 PolarHBondContact NH1-OD2 3.45Å; R2243-D2782 IonicContact NH2-OD2 3.67Å
2244	N	83.8	Confident	85.3	Confident	62.4 Å²	62.4	57.5 Å²	57.5	33%	0.334	27%	0.268	S	S	.	.	H	α-helix	trans	-63.3	-42.2	-179.2	-67.3	-13.9	0	0	0	111.4	E2240 Q2241 H2242 V2246 Y2247 I2248	E2240-N2244 VanDerWaalsContact CG-ND2 3.33Å; E2240-N2244 WeakPolarHBondContact CG-ND2 3.3Å; E2240-N2244 WeakPolarHBondContact O-CB 3.36Å; E2240-N2244 PolarHBondContact O-N 2.99Å; E2240-N2244 VanDerWaalsContact O-N 3.09Å; E2240-N2244 PolarHBondContact O-ND2 2.99Å; E2240-N2244 PolarHBondContact O-OD1 3.01Å; E2240-N2244 PolarHBondContact OE1-ND2 3.15Å; Q2241-N2244 PolarHBondContact O-N 3.04Å; Q2241-N2244 VanDerWaalsContact O-N 3.12Å; H2242-N2244 VanDerWaalsContact C-N 3.34Å; H2242-N2244 PolarHBondContact O-N 3.18Å; N2244-V2246 PolarHBondContact O-N 2.92Å; N2244-Y2247 PolarHBondContact O-N 3.13Å; N2244-I2248 WeakPolarHBondContact O-CD1 3.39Å; N2244-I2248 VanDerWaalsContact O-CG1 3.28Å; N2244-I2248 WeakPolarHBondContact O-CG1 3.43Å; N2244-I2248 PolarHBondContact O-N 2.92Å
2245	L	85.2	Confident	84.7	Confident	28.2 Å²	28.2	59.4 Å²	59.4	15%	0.148	28%	0.277	C	S	.	.	H	α-helix	trans	-62.6	-43.7	175.3	-77.5	176	0	0	0	112.3	L2015 H2017 Q2241 H2242 R2243 Y2247 I2248 L2249	L2015-L2245 HydrophobicContact CB-CB 4.29Å; L2015-L2245 HydrophobicContact CB-CD1 3.68Å; L2015-L2245 HydrophobicContact CD1-CB 4.17Å; L2015-L2245 WeakPolarHBondContact O-CD1 3.46Å; H2017-L2245 HydrophobicContact CB-CD1 4.14Å; H2017-L2245 HydrophobicContact CB-CD2 3.39Å; H2017-L2245 HydrophobicContact CB-CG 4.37Å; H2017-L2245 WeakPolarHBondContact CD2-CD2 3.41Å; Q2241-L2245 WeakPolarHBondContact O-CB 3.07Å; Q2241-L2245 WeakPolarHBondContact O-CG 3.26Å; Q2241-L2245 PolarHBondContact O-N 3.31Å; Q2241-L2245 VanDerWaalsContact O-N 3.08Å; H2242-L2245 PolarHBondContact O-N 3.06Å; R2243-L2245 VanDerWaalsContact C-N 3.31Å; R2243-L2245 PolarHBondContact O-N 3.28Å; L2245-Y2247 VanDerWaalsContact C-N 3.33Å; L2245-Y2247 PolarHBondContact O-N 3.15Å; L2245-I2248 HydrophobicContact CD2-CD1 4.32Å; L2245-I2248 PolarHBondContact O-N 2.92Å; L2245-L2249 HydrophobicContact CD2-CD1 3.9Å; L2245-L2249 HydrophobicContact CG-CD1 4.09Å; L2245-L2249 WeakPolarHBondContact O-CB 3.43Å; L2245-L2249 VanDerWaalsContact O-CG 3.28Å; L2245-L2249 WeakPolarHBondContact O-CG 3.36Å; L2245-L2249 PolarHBondContact O-N 3.09Å
2246	V	85.5	Confident	84	Confident	45.2 Å²	45.2	59.5 Å²	59.5	27%	0.274	29%	0.286	S	S	.	.	H	α-helix	trans	-61.5	-41.9	176.7	170	0	0	0	0	111.2	L2015 F2074 W2238 H2242 R2243 N2244 L2249 M2250	L2015-V2246 HydrophobicContact CD1-CG2 3.71Å; F2074-V2246 HydrophobicContact CE1-CG2 4.43Å; F2074-V2246 HydrophobicContact CZ-CG2 4.12Å; W2238-V2246 HydrophobicContact CH2-CB 4.26Å; W2238-V2246 HydrophobicContact CH2-CG1 4.3Å; W2238-V2246 HydrophobicContact CZ3-CB 4.33Å; W2238-V2246 HydrophobicContact CZ3-CG1 4.25Å; W2238-V2246 HydrophobicContact CZ3-CG2 4.16Å; H2242-V2246 WeakPolarHBondContact O-CB 3.23Å; H2242-V2246 VanDerWaalsContact O-CG2 3.31Å; H2242-V2246 WeakPolarHBondContact O-CG2 3.37Å; H2242-V2246 PolarHBondContact O-N 3.1Å; R2243-V2246 PolarHBondContact O-N 3.06Å; N2244-V2246 PolarHBondContact O-N 2.92Å; V2246-L2249 PolarHBondContact O-N 3.2Å; V2246-M2250 VanDerWaalsContact O-CB 3.25Å; V2246-M2250 WeakPolarHBondContact O-CB 3.34Å; V2246-M2250 PolarHBondContact O-N 2.91Å
2247	Y	84.1	Confident	83.3	Confident	85.4 Å²	85.4	61.1 Å²	61.1	34%	0.335	29%	0.293	S	S	.	.	H	α-helix	trans	-64.7	-43.4	175	-70.5	-37.4	0	0	0	112.6	R2243 N2244 L2245 L2249 M2250 D2251 Y2786	R2243-Y2247 HydrophobicContact CG-CD2 3.97Å; R2243-Y2247 HydrophobicContact CG-CE2 3.52Å; R2243-Y2247 VanDerWaalsContact CG-CE2 3.45Å; R2243-Y2247 WeakPolarHBondContact O-CD2 3.38Å; R2243-Y2247 PolarHBondContact O-N 2.99Å; R2243-Y2247 VanDerWaalsContact O-N 3.07Å; N2244-Y2247 PolarHBondContact O-N 3.13Å; L2245-Y2247 VanDerWaalsContact C-N 3.33Å; L2245-Y2247 PolarHBondContact O-N 3.15Å; Y2247-L2249 VanDerWaalsContact C-N 3.32Å; Y2247-L2249 PolarHBondContact O-N 2.95Å; Y2247-M2250 HydrophobicContact CD1-CE 3.67Å; Y2247-M2250 HydrophobicContact CE1-CE 4.16Å; Y2247-M2250 PolarHBondContact O-N 3.14Å; Y2247-M2250 VanDerWaalsContact O-N 3.16Å; Y2247-D2251 VanDerWaalsContact O-CB 3.32Å; Y2247-D2251 WeakPolarHBondContact O-CB 3.32Å; Y2247-D2251 PolarHBondContact O-N 3.06Å; Y2247-Y2786 HydrophobicContact CE2-CD1 4.19Å; Y2247-Y2786 HydrophobicContact CE2-CE1 4.44Å
2248	I	83.2	Confident	82.9	Confident	78.6 Å²	78.6	61.9 Å²	61.9	40%	0.403	30%	0.302	S	S	.	.	H	α-helix	trans	-58.7	-43.3	175.5	-68.5	163.1	0	0	0	111.3	T1905 N2244 L2245 S2252	T1905-I2248 HydrophobicContact CG2-CG2 4.08Å; N2244-I2248 WeakPolarHBondContact O-CD1 3.39Å; N2244-I2248 VanDerWaalsContact O-CG1 3.28Å; N2244-I2248 WeakPolarHBondContact O-CG1 3.43Å; N2244-I2248 PolarHBondContact O-N 2.92Å; L2245-I2248 HydrophobicContact CD2-CD1 4.32Å; L2245-I2248 PolarHBondContact O-N 2.92Å; I2248-S2252 VanDerWaalsContact O-CB 3.29Å; I2248-S2252 WeakPolarHBondContact O-CB 3.19Å; I2248-S2252 PolarHBondContact O-N 2.91Å; I2248-S2252 VanDerWaalsContact O-N 3.12Å; I2248-S2252 PolarHBondContact O-OG 3.07Å
2249	L	84	Confident	82.3	Confident	37.6 Å²	37.6	61.8 Å²	61.8	20%	0.197	31%	0.305	C	S	.	.	H	α-helix	trans	-65.2	-45	176.4	-69.6	173.5	0	0	0	111.7	V1899 V1907 L2015 L2245 V2246 Y2247 D2251 S2252 Y2253	V1899-L2249 HydrophobicContact CG2-CD2 3.46Å; V1899-L2249 VanDerWaalsContact CG2-CD2 3.45Å; V1907-L2249 HydrophobicContact CG2-CD1 4.05Å; L2015-L2249 HydrophobicContact CD2-CD1 4.18Å; L2245-L2249 HydrophobicContact CD2-CD1 3.9Å; L2245-L2249 HydrophobicContact CG-CD1 4.09Å; L2245-L2249 WeakPolarHBondContact O-CB 3.43Å; L2245-L2249 VanDerWaalsContact O-CG 3.28Å; L2245-L2249 WeakPolarHBondContact O-CG 3.36Å; L2245-L2249 PolarHBondContact O-N 3.09Å; V2246-L2249 PolarHBondContact O-N 3.2Å; Y2247-L2249 VanDerWaalsContact C-N 3.32Å; Y2247-L2249 PolarHBondContact O-N 2.95Å; L2249-D2251 VanDerWaalsContact C-N 3.29Å; L2249-D2251 PolarHBondContact O-N 2.92Å; L2249-S2252 WeakPolarHBondContact CA-OG 3.47Å; L2249-S2252 PolarHBondContact O-N 3.04Å; L2249-S2252 PolarHBondContact O-OG 2.88Å; L2249-S2252 VanDerWaalsContact O-OG 3.13Å; L2249-Y2253 WeakPolarHBondContact O-CB 3.4Å; L2249-Y2253 PolarHBondContact O-N 3.01Å; L2249-Y2253 VanDerWaalsContact O-N 3.13Å
2250	M	81.9	Confident	82	Confident	74.4 Å²	74.4	67.4 Å²	67.4	37%	0.367	33%	0.328	S	S	.	.	H	α-helix	trans	-64.7	-42.5	179.7	-172.3	141.5	171.4	0	0	112.1	V2246 Y2247 Y2253 R2254	V2246-M2250 VanDerWaalsContact O-CB 3.25Å; V2246-M2250 WeakPolarHBondContact O-CB 3.34Å; V2246-M2250 PolarHBondContact O-N 2.91Å; Y2247-M2250 HydrophobicContact CD1-CE 3.67Å; Y2247-M2250 HydrophobicContact CE1-CE 4.16Å; Y2247-M2250 PolarHBondContact O-N 3.14Å; Y2247-M2250 VanDerWaalsContact O-N 3.16Å; M2250-Y2253 WeakPolarHBondContact O-CB 3.33Å; M2250-Y2253 PolarHBondContact O-N 3.06Å; M2250-Y2253 HydrophobicContact SD-CD1 4.3Å; M2250-R2254 HydrophobicContact CE-CG 4.34Å; M2250-R2254 HydrophobicContact CG-CG 4.43Å; M2250-R2254 WeakPolarHBondContact O-CB 3.35Å; M2250-R2254 VanDerWaalsContact O-CG 3.31Å; M2250-R2254 WeakPolarHBondContact O-CG 3.35Å; M2250-R2254 PolarHBondContact O-N 3.06Å; M2250-R2254 HydrophobicContact SD-CG 4.24Å; M2250-R2254 VanDerWaalsContact SD-CZ 3.5Å; M2250-R2254 PolarHBondContact SD-NE 2.81Å; M2250-R2254 PolarHBondContact SD-NH1 3.17Å; M2250-R2254 PolarHBondContact SD-NH2 2.84Å; M2250-R2254 VanDerWaalsContact SD-NH2 3.36Å
2251	D	81.4	Confident	81.6	Confident	68.4 Å²	68.4	69.9 Å²	69.9	37%	0.366	34%	0.338	S	S	.	.	H	α-helix	trans	-70.9	-38	179.1	-80.8	-8.6	0	0	0	112.2	Y2247 L2249 Y2253 R2254 H2255 R2791	Y2247-D2251 VanDerWaalsContact O-CB 3.32Å; Y2247-D2251 WeakPolarHBondContact O-CB 3.32Å; Y2247-D2251 PolarHBondContact O-N 3.06Å; L2249-D2251 VanDerWaalsContact C-N 3.29Å; L2249-D2251 PolarHBondContact O-N 2.92Å; D2251-Y2253 VanDerWaalsContact C-N 3.31Å; D2251-Y2253 PolarHBondContact O-N 2.89Å; D2251-R2254 PolarHBondContact O-N 3Å; D2251-R2254 IonicContact OD1-NH1 3.77Å; D2251-R2254 PolarHBondContact OD1-NH1 3.19Å; D2251-H2255 VanDerWaalsContact O-CB 3.27Å; D2251-H2255 WeakPolarHBondContact O-CB 3.37Å; D2251-H2255 PolarHBondContact O-N 3.09Å; D2251-R2791 IonicContact OD1-CZ 3.64Å; D2251-R2791 IonicContact OD1-NH1 3.62Å; D2251-R2791 IonicContact OD1-NH2 2.86Å; D2251-R2791 PolarHBondContact OD1-NH2 2.85Å; D2251-R2791 IonicContact OD2-CZ 2.83Å; D2251-R2791 IonicContact OD2-NH1 2.77Å; D2251-R2791 PolarHBondContact OD2-NH1 2.95Å; D2251-R2791 IonicContact OD2-NH2 3.73Å; D2251-R2791 PolarHBondContact OD2-NH2 3.47Å
2252	S	79.7	Confident	81.4	Confident	41.6 Å²	41.6	66.5 Å²	66.5	29%	0.291	32%	0.323	S	S	.	.	H	α-helix	trans	-59.9	-40.5	171.4	-21.8	0	0	0	0	111.7	I2248 L2249 A2256	I2248-S2252 VanDerWaalsContact O-CB 3.29Å; I2248-S2252 WeakPolarHBondContact O-CB 3.19Å; I2248-S2252 PolarHBondContact O-N 2.91Å; I2248-S2252 VanDerWaalsContact O-N 3.12Å; I2248-S2252 PolarHBondContact O-OG 3.07Å; L2249-S2252 WeakPolarHBondContact CA-OG 3.47Å; L2249-S2252 PolarHBondContact O-N 3.04Å; L2249-S2252 PolarHBondContact O-OG 2.88Å; L2249-S2252 VanDerWaalsContact O-OG 3.13Å; S2252-A2256 VanDerWaalsContact O-CB 3.28Å; S2252-A2256 WeakPolarHBondContact O-CB 3.43Å; S2252-A2256 PolarHBondContact O-N 3.12Å; S2252-A2256 VanDerWaalsContact O-N 3.12Å
2253	Y	82.3	Confident	80.8	Confident	130.8 Å²	130.8	69.2 Å²	69.2	51%	0.513	34%	0.338	S	S	.	.	H	α-helix	trans	-67.4	-49.3	175.1	176	-97.3	0	0	0	112.5	L2249 M2250 D2251 H2255 A2256 Q2257	L2249-Y2253 WeakPolarHBondContact O-CB 3.4Å; L2249-Y2253 PolarHBondContact O-N 3.01Å; L2249-Y2253 VanDerWaalsContact O-N 3.13Å; M2250-Y2253 WeakPolarHBondContact O-CB 3.33Å; M2250-Y2253 PolarHBondContact O-N 3.06Å; M2250-Y2253 HydrophobicContact SD-CD1 4.3Å; D2251-Y2253 VanDerWaalsContact C-N 3.31Å; D2251-Y2253 PolarHBondContact O-N 2.89Å; Y2253-H2255 VanDerWaalsContact C-N 3.34Å; Y2253-H2255 PolarHBondContact O-N 3.04Å; Y2253-A2256 WeakPolarHBondContact O-CB 3.37Å; Y2253-A2256 PolarHBondContact O-N 2.87Å; Y2253-A2256 VanDerWaalsContact O-N 3.15Å; Y2253-Q2257 HydrophobicContact CD1-CG 4.27Å; Y2253-Q2257 HydrophobicContact CD2-CG 4.38Å; Y2253-Q2257 HydrophobicContact CE1-CG 3.87Å; Y2253-Q2257 HydrophobicContact CE2-CG 4.08Å; Y2253-Q2257 VanDerWaalsContact CZ-NE2 3.33Å; Y2253-Q2257 WeakPolarHBondContact O-CG 3.39Å; Y2253-Q2257 PolarHBondContact O-N 3.01Å; Y2253-Q2257 PolarHBondContact OH-NE2 3.05Å
2254	R	79.6	Confident	80.2	Confident	127.6 Å²	127.6	69.7 Å²	69.7	48%	0.482	35%	0.346	S	S	.	.	H	α-helix	trans	-58.3	-45	177.2	-75.6	175.2	177	164.7	-3.1	111.4	M2250 D2251 A2256 Q2257 S2258	M2250-R2254 HydrophobicContact CE-CG 4.34Å; M2250-R2254 HydrophobicContact CG-CG 4.43Å; M2250-R2254 WeakPolarHBondContact O-CB 3.35Å; M2250-R2254 VanDerWaalsContact O-CG 3.31Å; M2250-R2254 WeakPolarHBondContact O-CG 3.35Å; M2250-R2254 PolarHBondContact O-N 3.06Å; M2250-R2254 HydrophobicContact SD-CG 4.24Å; M2250-R2254 VanDerWaalsContact SD-CZ 3.5Å; M2250-R2254 PolarHBondContact SD-NE 2.81Å; M2250-R2254 PolarHBondContact SD-NH1 3.17Å; M2250-R2254 PolarHBondContact SD-NH2 2.84Å; M2250-R2254 VanDerWaalsContact SD-NH2 3.36Å; D2251-R2254 PolarHBondContact O-N 3Å; D2251-R2254 IonicContact OD1-NH1 3.77Å; D2251-R2254 PolarHBondContact OD1-NH1 3.19Å; R2254-A2256 VanDerWaalsContact C-N 3.34Å; R2254-A2256 PolarHBondContact O-N 2.95Å; R2254-Q2257 PolarHBondContact O-N 3.17Å; R2254-S2258 VanDerWaalsContact O-CB 3.29Å; R2254-S2258 WeakPolarHBondContact O-CB 3.42Å; R2254-S2258 PolarHBondContact O-N 3.12Å
2255	H	79.9	Confident	79.3	Confident	75.6 Å²	75.6	70.8 Å²	70.8	35%	0.35	36%	0.363	S	S	.	.	H	α-helix	trans	-60.4	-46.6	175.1	178.3	57	0	0	0	111.2	D2251 Y2253 Q2257 S2258 L2259	D2251-H2255 VanDerWaalsContact O-CB 3.27Å; D2251-H2255 WeakPolarHBondContact O-CB 3.37Å; D2251-H2255 PolarHBondContact O-N 3.09Å; Y2253-H2255 VanDerWaalsContact C-N 3.34Å; Y2253-H2255 PolarHBondContact O-N 3.04Å; H2255-Q2257 VanDerWaalsContact C-N 3.34Å; H2255-Q2257 PolarHBondContact O-N 2.91Å; H2255-S2258 PolarHBondContact O-N 3.22Å; H2255-L2259 WeakPolarHBondContact CE1-CD1 3.39Å; H2255-L2259 WeakPolarHBondContact ND1-CD1 3.37Å; H2255-L2259 WeakPolarHBondContact NE2-CD1 3.35Å; H2255-L2259 VanDerWaalsContact O-CB 3.26Å; H2255-L2259 WeakPolarHBondContact O-CB 3.35Å; H2255-L2259 VanDerWaalsContact O-CD1 3.26Å; H2255-L2259 WeakPolarHBondContact O-CD1 3.27Å; H2255-L2259 PolarHBondContact O-N 3.06Å
2256	A	79.2	Confident	78.2	Confident	45 Å²	45	77.4 Å²	77.4	37%	0.372	39%	0.386	S	S	.	.	H	α-helix	trans	-62.4	-39	178.2	0	0	0	0	0	113.2	S2252 Y2253 R2254 L2259 K2260	S2252-A2256 VanDerWaalsContact O-CB 3.28Å; S2252-A2256 WeakPolarHBondContact O-CB 3.43Å; S2252-A2256 PolarHBondContact O-N 3.12Å; S2252-A2256 VanDerWaalsContact O-N 3.12Å; Y2253-A2256 WeakPolarHBondContact O-CB 3.37Å; Y2253-A2256 PolarHBondContact O-N 2.87Å; Y2253-A2256 VanDerWaalsContact O-N 3.15Å; R2254-A2256 VanDerWaalsContact C-N 3.34Å; R2254-A2256 PolarHBondContact O-N 2.95Å; A2256-L2259 PolarHBondContact O-N 2.65Å; A2256-K2260 VanDerWaalsContact O-CB 3.32Å; A2256-K2260 WeakPolarHBondContact O-CB 3.42Å; A2256-K2260 PolarHBondContact O-N 3.15Å; A2256-K2260 VanDerWaalsContact O-N 3.11Å
2257	Q	78.9	Confident	77	Confident	74.2 Å²	74.2	76.2 Å²	76.2	35%	0.347	38%	0.381	S	S	.	.	H	α-helix	trans	-68.8	-43.1	175.2	-69.8	-70.9	19.1	0	0	112	Y2253 R2254 H2255 L2259 K2260 K2261	Y2253-Q2257 HydrophobicContact CD1-CG 4.27Å; Y2253-Q2257 HydrophobicContact CD2-CG 4.38Å; Y2253-Q2257 HydrophobicContact CE1-CG 3.87Å; Y2253-Q2257 HydrophobicContact CE2-CG 4.08Å; Y2253-Q2257 VanDerWaalsContact CZ-NE2 3.33Å; Y2253-Q2257 WeakPolarHBondContact O-CG 3.39Å; Y2253-Q2257 PolarHBondContact O-N 3.01Å; Y2253-Q2257 PolarHBondContact OH-NE2 3.05Å; R2254-Q2257 PolarHBondContact O-N 3.17Å; H2255-Q2257 VanDerWaalsContact C-N 3.34Å; H2255-Q2257 PolarHBondContact O-N 2.91Å; Q2257-L2259 VanDerWaalsContact C-N 3.33Å; Q2257-L2259 PolarHBondContact O-N 3.21Å; Q2257-K2260 WeakPolarHBondContact O-CB 3.14Å; Q2257-K2260 PolarHBondContact O-N 3.16Å; Q2257-K2261 WeakPolarHBondContact O-CB 3.27Å; Q2257-K2261 WeakPolarHBondContact O-CG 3.49Å; Q2257-K2261 PolarHBondContact O-N 3.28Å
2258	S	79.9	Confident	75.9	Confident	42.2 Å²	42.2	75.5 Å²	75.5	30%	0.295	38%	0.382	S	S	.	.	H	α-helix	trans	-57.6	-49.1	173.4	174.4	0	0	0	0	111.2	R2254 H2255 K2260 K2261 N2262 N2912 S2916	R2254-S2258 VanDerWaalsContact O-CB 3.29Å; R2254-S2258 WeakPolarHBondContact O-CB 3.42Å; R2254-S2258 PolarHBondContact O-N 3.12Å; H2255-S2258 PolarHBondContact O-N 3.22Å; S2258-K2260 VanDerWaalsContact C-N 3.32Å; S2258-K2260 PolarHBondContact O-N 2.85Å; S2258-K2261 WeakPolarHBondContact O-CB 3.41Å; S2258-K2261 PolarHBondContact O-N 3.12Å; S2258-K2261 VanDerWaalsContact O-N 3.11Å; S2258-N2262 VanDerWaalsContact O-CB 3.31Å; S2258-N2262 WeakPolarHBondContact O-CB 3.31Å; S2258-N2262 VanDerWaalsContact O-CG 3.22Å; S2258-N2262 PolarHBondContact O-N 3.11Å; S2258-N2262 PolarHBondContact O-ND2 3.23Å; S2258-N2262 PolarHBondContact OG-ND2 3.32Å; S2258-N2262 VanDerWaalsContact OG-ND2 3.16Å; S2258-N2912 PolarHBondContact OG-ND2 3.26Å; S2258-S2916 PolarHBondContact OG-OG 3.11Å; S2258-S2916 VanDerWaalsContact OG-OG 3.05Å
2259	L	78.3	Confident	74.7	Confident	47.6 Å²	47.6	78.6 Å²	78.6	25%	0.249	40%	0.395	C	S	.	.	H	α-helix	trans	-59.3	-41.4	177.1	-140.9	72.2	0	0	0	112.2	H2255 A2256 Q2257 K2261 N2262 L2263 L2822 I2826 I2908 N2912	H2255-L2259 WeakPolarHBondContact CE1-CD1 3.39Å; H2255-L2259 WeakPolarHBondContact ND1-CD1 3.37Å; H2255-L2259 WeakPolarHBondContact NE2-CD1 3.35Å; H2255-L2259 VanDerWaalsContact O-CB 3.26Å; H2255-L2259 WeakPolarHBondContact O-CB 3.35Å; H2255-L2259 VanDerWaalsContact O-CD1 3.26Å; H2255-L2259 WeakPolarHBondContact O-CD1 3.27Å; H2255-L2259 PolarHBondContact O-N 3.06Å; A2256-L2259 PolarHBondContact O-N 2.65Å; Q2257-L2259 VanDerWaalsContact C-N 3.33Å; Q2257-L2259 PolarHBondContact O-N 3.21Å; L2259-K2261 VanDerWaalsContact C-N 3.33Å; L2259-K2261 PolarHBondContact O-N 3.26Å; L2259-N2262 PolarHBondContact O-N 3.13Å; L2259-L2263 HydrophobicContact CD1-CD1 3.88Å; L2259-L2263 HydrophobicContact CD1-CG 4.31Å; L2259-L2263 HydrophobicContact CG-CD1 3.98Å; L2259-L2263 VanDerWaalsContact O-CB 3.29Å; L2259-L2263 WeakPolarHBondContact O-CB 3.43Å; L2259-L2263 VanDerWaalsContact O-CG 3.29Å; L2259-L2263 WeakPolarHBondContact O-CG 3.34Å; L2259-L2263 PolarHBondContact O-N 3.13Å; L2259-L2263 VanDerWaalsContact O-N 3.08Å; L2259-L2822 HydrophobicContact CD1-CD1 4.23Å; L2259-L2822 HydrophobicContact CD1-CD2 3.59Å; L2259-L2822 HydrophobicContact CD1-CG 3.95Å; L2259-I2826 HydrophobicContact CD1-CD1 4.09Å; L2259-I2826 HydrophobicContact CD2-CD1 3.97Å; L2259-I2826 HydrophobicContact CD2-CG1 4.48Å; L2259-I2826 HydrophobicContact CG-CD1 4.28Å; L2259-I2908 HydrophobicContact CD1-CG2 4.43Å; L2259-I2908 HydrophobicContact CD2-CG2 4.43Å; L2259-N2912 WeakPolarHBondContact CA-OD1 3.34Å; L2259-N2912 HydrophobicContact CD1-CB 3.99Å; L2259-N2912 PolarHBondContact N-ND2 3.26Å
2260	K	78.1	Confident	73.2	Confident	135.4 Å²	135.4	78.8 Å²	78.8	59%	0.589	41%	0.406	S	S	*	.	H	α-helix	trans	-64	-41.7	175.9	-176.3	-177.6	178	-176.5	0	111.9	D1848 A2256 Q2257 S2258 S2264	D1848-K2260 IonicContact OD2-NZ 3.77Å; D1848-K2260 PolarHBondContact OD2-NZ 2.81Å; A2256-K2260 VanDerWaalsContact O-CB 3.32Å; A2256-K2260 WeakPolarHBondContact O-CB 3.42Å; A2256-K2260 PolarHBondContact O-N 3.15Å; A2256-K2260 VanDerWaalsContact O-N 3.11Å; Q2257-K2260 WeakPolarHBondContact O-CB 3.14Å; Q2257-K2260 PolarHBondContact O-N 3.16Å; S2258-K2260 VanDerWaalsContact C-N 3.32Å; S2258-K2260 PolarHBondContact O-N 2.85Å; K2260-S2264 VanDerWaalsContact O-CB 3.27Å; K2260-S2264 WeakPolarHBondContact O-CB 3.4Å; K2260-S2264 PolarHBondContact O-N 3.02Å; K2260-S2264 VanDerWaalsContact O-N 3.08Å
2261	K	74.8	Confident	71.8	Confident	111.6 Å²	111.6	78.2 Å²	78.2	49%	0.485	40%	0.401	S	S	.	.	H	α-helix	trans	-64	-50.1	176.1	-151.9	175.2	-176.6	177.3	0	110.4	Q2257 S2258 L2259 L2263 S2264 A2267 E2724 P2725	Q2257-K2261 WeakPolarHBondContact O-CB 3.27Å; Q2257-K2261 WeakPolarHBondContact O-CG 3.49Å; Q2257-K2261 PolarHBondContact O-N 3.28Å; S2258-K2261 WeakPolarHBondContact O-CB 3.41Å; S2258-K2261 PolarHBondContact O-N 3.12Å; S2258-K2261 VanDerWaalsContact O-N 3.11Å; L2259-K2261 VanDerWaalsContact C-N 3.33Å; L2259-K2261 PolarHBondContact O-N 3.26Å; K2261-L2263 VanDerWaalsContact C-N 3.32Å; K2261-L2263 PolarHBondContact O-N 2.82Å; K2261-S2264 VanDerWaalsContact O-CB 3.24Å; K2261-S2264 WeakPolarHBondContact O-CB 3.29Å; K2261-S2264 PolarHBondContact O-N 3.12Å; K2261-S2264 PolarHBondContact O-OG 3.13Å; K2261-A2267 WeakPolarHBondContact O-CB 3.36Å; K2261-E2724 IonicContact NZ-OE1 3.19Å; K2261-E2724 PolarHBondContact NZ-OE1 3.32Å; K2261-P2725 PolarHBondContact NZ-O 3.06Å
2262	N	77.6	Confident	70.1	Confident	36.2 Å²	36.2	85.2 Å²	85.2	19%	0.194	42%	0.422	C	S	.	.	H	α-helix	trans	-67.4	-36	-175.7	-68.4	-14.4	0	0	0	114.3	S2258 L2259 S2264 A2267 Q2819 N2912 L2915 S2916	S2258-N2262 VanDerWaalsContact O-CB 3.31Å; S2258-N2262 WeakPolarHBondContact O-CB 3.31Å; S2258-N2262 VanDerWaalsContact O-CG 3.22Å; S2258-N2262 PolarHBondContact O-N 3.11Å; S2258-N2262 PolarHBondContact O-ND2 3.23Å; S2258-N2262 PolarHBondContact OG-ND2 3.32Å; S2258-N2262 VanDerWaalsContact OG-ND2 3.16Å; L2259-N2262 PolarHBondContact O-N 3.13Å; N2262-S2264 VanDerWaalsContact C-N 3.28Å; N2262-S2264 PolarHBondContact O-N 3.22Å; N2262-A2267 WeakPolarHBondContact O-CB 3.14Å; N2262-Q2819 PolarHBondContact O-NE2 3.26Å; N2262-N2912 PolarHBondContact ND2-O 3.21Å; N2262-N2912 PolarHBondContact ND2-OD1 2.99Å; N2262-L2915 HydrophobicContact CB-CD2 3.87Å; N2262-L2915 HydrophobicContact CB-CG 4.17Å; N2262-S2916 PolarHBondContact ND2-OG 3.18Å
2263	L	74.6	Confident	68.3	Low	78.4 Å²	78.4	87.6 Å²	87.6	41%	0.41	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-9.3	178	-69.1	174.6	0	0	0	113.6	L2259 K2261 Q2819 L2822 R2823 I2826	L2259-L2263 HydrophobicContact CD1-CD1 3.88Å; L2259-L2263 HydrophobicContact CD1-CG 4.31Å; L2259-L2263 HydrophobicContact CG-CD1 3.98Å; L2259-L2263 VanDerWaalsContact O-CB 3.29Å; L2259-L2263 WeakPolarHBondContact O-CB 3.43Å; L2259-L2263 VanDerWaalsContact O-CG 3.29Å; L2259-L2263 WeakPolarHBondContact O-CG 3.34Å; L2259-L2263 PolarHBondContact O-N 3.13Å; L2259-L2263 VanDerWaalsContact O-N 3.08Å; K2261-L2263 VanDerWaalsContact C-N 3.32Å; K2261-L2263 PolarHBondContact O-N 2.82Å; L2263-Q2819 HydrophobicContact CD2-CB 4.4Å; L2263-Q2819 HydrophobicContact CD2-CG 4.33Å; L2263-L2822 HydrophobicContact CD1-CD2 4.48Å; L2263-L2822 HydrophobicContact CD1-CG 4.46Å; L2263-L2822 HydrophobicContact CD2-CB 4.15Å; L2263-L2822 HydrophobicContact CD2-CD2 3.95Å; L2263-L2822 HydrophobicContact CD2-CG 4.17Å; L2263-L2822 HydrophobicContact CG-CD2 4.28Å; L2263-R2823 HydrophobicContact CD2-CG 4.04Å; L2263-R2823 PolarHBondContact O-NH2 3.22Å; L2263-R2823 VanDerWaalsContact O-NH2 3.14Å; L2263-I2826 HydrophobicContact CD1-CD1 3.49Å; L2263-I2826 VanDerWaalsContact CD1-CD1 3.49Å
2264	S	72.6	Confident	66.2	Low	37.8 Å²	37.8	89.1 Å²	89.1	26%	0.264	44%	0.443	S	S	.	.	S	Bend	trans	-68	145.8	179.8	78.3	0	0	0	0	111.3	K2260 K2261 N2262 R2266 A2267	K2260-S2264 VanDerWaalsContact O-CB 3.27Å; K2260-S2264 WeakPolarHBondContact O-CB 3.4Å; K2260-S2264 PolarHBondContact O-N 3.02Å; K2260-S2264 VanDerWaalsContact O-N 3.08Å; K2261-S2264 VanDerWaalsContact O-CB 3.24Å; K2261-S2264 WeakPolarHBondContact O-CB 3.29Å; K2261-S2264 PolarHBondContact O-N 3.12Å; K2261-S2264 PolarHBondContact O-OG 3.13Å; N2262-S2264 VanDerWaalsContact C-N 3.28Å; N2262-S2264 PolarHBondContact O-N 3.22Å; S2264-R2266 PolarHBondContact O-N 2.99Å; S2264-R2266 VanDerWaalsContact O-N 3.15Å; S2264-R2266 PolarHBondContact OG-N 2.92Å; S2264-A2267 VanDerWaalsContact O-CB 3.27Å; S2264-A2267 WeakPolarHBondContact O-CB 3.3Å; S2264-A2267 PolarHBondContact O-N 2.98Å; S2264-A2267 VanDerWaalsContact O-N 3.15Å; S2264-A2267 PolarHBondContact OG-N 2.91Å
2265	A	64.6	Low	64.2	Low	84.8 Å²	84.8	88.3 Å²	88.3	70%	0.701	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-14.2	173.4	0	0	0	0	0	113.2	L2268 H2269	A2265-L2268 WeakPolarHBondContact O-CB 3.42Å; A2265-L2268 PolarHBondContact O-N 2.78Å; A2265-H2269 PolarHBondContact O-N 2.78Å
2266	R	62.6	Low	62	Low	167.4 Å²	167.4	88.5 Å²	88.5	63%	0.632	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-18.7	175.6	-77.6	-177.2	-175.4	169.8	-1.5	113.1	S2264 L2268 H2269	S2264-R2266 PolarHBondContact O-N 2.99Å; S2264-R2266 VanDerWaalsContact O-N 3.15Å; S2264-R2266 PolarHBondContact OG-N 2.92Å; R2266-L2268 VanDerWaalsContact C-N 3.27Å; R2266-L2268 PolarHBondContact O-N 3.05Å; R2266-L2268 VanDerWaalsContact O-N 3.13Å; R2266-H2269 WeakPolarHBondContact O-CB 3.31Å; R2266-H2269 PolarHBondContact O-N 3.3Å; R2266-H2269 VanDerWaalsContact O-N 3.16Å
2267	A	59.2	Low	59.6	Low	18.8 Å²	18.8	89.7 Å²	89.7	16%	0.155	49%	0.494	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-32.5	177.4	0	0	0	0	0	112.7	K2261 N2262 S2264 H2269 G2270 L2919	K2261-A2267 WeakPolarHBondContact O-CB 3.36Å; N2262-A2267 WeakPolarHBondContact O-CB 3.14Å; S2264-A2267 VanDerWaalsContact O-CB 3.27Å; S2264-A2267 WeakPolarHBondContact O-CB 3.3Å; S2264-A2267 PolarHBondContact O-N 2.98Å; S2264-A2267 VanDerWaalsContact O-N 3.15Å; S2264-A2267 PolarHBondContact OG-N 2.91Å; A2267-H2269 VanDerWaalsContact C-N 3.3Å; A2267-H2269 PolarHBondContact O-N 2.91Å; A2267-G2270 PolarHBondContact O-N 2.76Å; A2267-L2919 HydrophobicContact CB-CD1 3.92Å; A2267-L2919 HydrophobicContact CB-CD2 3.88Å; A2267-L2919 HydrophobicContact CB-CG 4.47Å; A2267-L2919 WeakPolarHBondContact O-CD1 3.4Å
2268	L	60.3	Low	57.3	Low	70.8 Å²	70.8	94 Å²	94	37%	0.371	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-5.7	177.9	-67.5	174.1	0	0	0	114.3	A2265 R2266 G2270 F2271 R2812 I2815 Y2922	A2265-L2268 WeakPolarHBondContact O-CB 3.42Å; A2265-L2268 PolarHBondContact O-N 2.78Å; R2266-L2268 VanDerWaalsContact C-N 3.27Å; R2266-L2268 PolarHBondContact O-N 3.05Å; R2266-L2268 VanDerWaalsContact O-N 3.13Å; L2268-G2270 PolarHBondContact O-N 3.17Å; L2268-G2270 VanDerWaalsContact O-N 3.12Å; L2268-F2271 HydrophobicContact CB-CD2 4.4Å; L2268-F2271 HydrophobicContact CD2-CD2 4.07Å; L2268-F2271 HydrophobicContact CD2-CE2 3.69Å; L2268-F2271 HydrophobicContact CD2-CZ 4.35Å; L2268-F2271 VanDerWaalsContact O-CD2 3.29Å; L2268-F2271 WeakPolarHBondContact O-CD2 3.44Å; L2268-F2271 PolarHBondContact O-N 3.08Å; L2268-R2812 HydrophobicContact CD1-CG 4.19Å; L2268-R2812 HydrophobicContact CD2-CG 4.24Å; L2268-I2815 HydrophobicContact CD1-CG2 4.48Å; L2268-I2815 HydrophobicContact CD2-CB 4.34Å; L2268-I2815 HydrophobicContact CD2-CD1 3.93Å; L2268-I2815 HydrophobicContact CD2-CG2 3.86Å; L2268-I2815 HydrophobicContact CG-CG2 4.3Å; L2268-Y2922 HydrophobicContact CB-CE1 4.43Å; L2268-Y2922 HydrophobicContact CD2-CD1 4.04Å; L2268-Y2922 HydrophobicContact CD2-CE1 3.77Å; L2268-Y2922 HydrophobicContact CD2-CE2 4.36Å; L2268-Y2922 HydrophobicContact CD2-CG 4.32Å; L2268-Y2922 WeakPolarHBondContact O-CE1 3.47Å
2269	H	58.1	Low	54.8	Low	145.2 Å²	145.2	95.7 Å²	95.7	67%	0.672	54%	0.544	S	S	*	.			trans	-73.2	61.3	177.9	-113.1	-80.9	0	0	0	111.4	A2265 R2266 A2267 F2271 P2728	A2265-H2269 PolarHBondContact O-N 2.78Å; R2266-H2269 WeakPolarHBondContact O-CB 3.31Å; R2266-H2269 PolarHBondContact O-N 3.3Å; R2266-H2269 VanDerWaalsContact O-N 3.16Å; A2267-H2269 VanDerWaalsContact C-N 3.3Å; A2267-H2269 PolarHBondContact O-N 2.91Å; H2269-F2271 VanDerWaalsContact C-N 3.33Å; H2269-F2271 PolarHBondContact O-N 3.16Å; H2269-P2728 VanDerWaalsContact O-CG 3.25Å; H2269-P2728 WeakPolarHBondContact O-CG 3.45Å
2270	G	54.2	Low	52.4	Low	40.6 Å²	40.6	98.9 Å²	98.9	42%	0.419	57%	0.57	S	S	.	*			trans	-68.1	130.9	172.5	0	0	0	0	0	113	A2267 L2268 R2272	A2267-G2270 PolarHBondContact O-N 2.76Å; L2268-G2270 PolarHBondContact O-N 3.17Å; L2268-G2270 VanDerWaalsContact O-N 3.12Å; G2270-R2272 PolarHBondContact O-N 3.26Å; G2270-R2272 VanDerWaalsContact O-N 3.15Å
2271	F	51	Low	50	Low	61.2 Å²	61.2	98.2 Å²	98.2	27%	0.268	58%	0.582	S	S	.	*			trans	-68.8	114.1	175.1	-61.8	-90.6	0	0	0	110.5	L2268 H2269 L2273 L2541 A2726 P2728 L2731 I2927 Q2930	L2268-F2271 HydrophobicContact CB-CD2 4.4Å; L2268-F2271 HydrophobicContact CD2-CD2 4.07Å; L2268-F2271 HydrophobicContact CD2-CE2 3.69Å; L2268-F2271 HydrophobicContact CD2-CZ 4.35Å; L2268-F2271 VanDerWaalsContact O-CD2 3.29Å; L2268-F2271 WeakPolarHBondContact O-CD2 3.44Å; L2268-F2271 PolarHBondContact O-N 3.08Å; H2269-F2271 VanDerWaalsContact C-N 3.33Å; H2269-F2271 PolarHBondContact O-N 3.16Å; F2271-L2273 HydrophobicContact CB-CD1 3.92Å; F2271-L2273 HydrophobicContact CB-CG 4.5Å; F2271-L2273 PolarHBondContact O-N 3.32Å; F2271-L2273 VanDerWaalsContact O-N 3.15Å; F2271-L2541 HydrophobicContact CD1-CD2 4.49Å; F2271-L2541 HydrophobicContact CE1-CB 4.26Å; F2271-L2541 HydrophobicContact CE1-CD2 4.25Å; F2271-L2541 HydrophobicContact CZ-CB 4.45Å; F2271-A2726 HydrophobicContact CE1-CB 4.35Å; F2271-A2726 WeakPolarHBondContact CE1-O 3.28Å; F2271-A2726 VanDerWaalsContact CZ-O 3.32Å; F2271-A2726 WeakPolarHBondContact CZ-O 3.13Å; F2271-P2728 HydrophobicContact CD1-CB 3.9Å; F2271-P2728 HydrophobicContact CD2-CB 4.47Å; F2271-P2728 HydrophobicContact CE1-CB 3.91Å; F2271-P2728 HydrophobicContact CE1-CG 4.34Å; F2271-P2728 HydrophobicContact CG-CB 4.22Å; F2271-P2728 HydrophobicContact CZ-CB 4.24Å; F2271-P2728 HydrophobicContact CZ-CG 4.47Å; F2271-L2731 HydrophobicContact CD1-CD1 4.18Å; F2271-L2731 HydrophobicContact CD1-CD2 4.15Å; F2271-L2731 HydrophobicContact CE1-CD2 4.01Å; F2271-I2927 HydrophobicContact CD2-CD1 3.78Å; F2271-I2927 HydrophobicContact CD2-CG1 4.25Å; F2271-I2927 HydrophobicContact CE2-CD1 4.01Å; F2271-Q2930 PolarHBondContact O-NE2 3.39Å; F2271-Q2930 PolarHBondContact O-OE1 2.83Å
2272	R	45.4	Very low	47.8	Very low	215.4 Å²	215.4	98.3 Å²	98.3	81%	0.813	60%	0.597	S	S	*	*			trans	-105.3	82.8	169	-155.3	177.6	-170.2	175.3	2.7	108.9	G2270 H2274	G2270-R2272 PolarHBondContact O-N 3.26Å; G2270-R2272 VanDerWaalsContact O-N 3.15Å; R2272-H2274 PolarHBondContact O-N 3.11Å; R2272-H2274 PolarHBondContact O-ND1 3.13Å
2273	L	43.3	Very low	45.3	Very low	93.4 Å²	93.4	99.8 Å²	99.8	49%	0.489	62%	0.621	S	S	.	*			trans	-64.7	115.7	173.5	-69.1	154.6	0	0	0	108.8	F2271 P2275 W2536 I2737 L2740	F2271-L2273 HydrophobicContact CB-CD1 3.92Å; F2271-L2273 HydrophobicContact CB-CG 4.5Å; F2271-L2273 PolarHBondContact O-N 3.32Å; F2271-L2273 VanDerWaalsContact O-N 3.15Å; L2273-P2275 WeakPolarHBondContact O-CD 3.41Å; L2273-W2536 HydrophobicContact CD1-CH2 3.73Å; L2273-W2536 HydrophobicContact CD1-CZ2 3.55Å; L2273-W2536 HydrophobicContact CD2-CZ2 4.03Å; L2273-W2536 HydrophobicContact CG-CZ2 4.4Å; L2273-I2737 HydrophobicContact CD2-CG2 4.13Å; L2273-L2740 HydrophobicContact CD1-CB 4.17Å; L2273-L2740 HydrophobicContact CD1-CD2 4.12Å
2274	H	38.7	Very low	43.1	Very low	161.4 Å²	161.4	104.5 Å²	104.5	75%	0.747	64%	0.641	S	S	*	*			trans	-78.8	121	166.3	-75.9	29.8	0	0	0	107.3	R2272 G2276	R2272-H2274 PolarHBondContact O-N 3.11Å; R2272-H2274 PolarHBondContact O-ND1 3.13Å; H2274-G2276 PolarHBondContact O-N 3.06Å
2275	P	37.6	Very low	40.8	Very low	110.4 Å²	110.4	108.9 Å²	108.9	72%	0.717	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-62.2	132.3	172.3	26.7	-32.4	0	0	0	108.5	L2273 G2277	L2273-P2275 WeakPolarHBondContact O-CD 3.41Å; P2275-G2277 PolarHBondContact O-N 3.07Å; P2275-G2277 VanDerWaalsContact O-N 3.15Å
2276	G	32.8	Very low	39	Very low	79.8 Å²	79.8	110.4 Å²	110.4	82%	0.823	67%	0.666	S	S	*	*			trans	-55.6	117.5	-175.2	0	0	0	0	0	112.3	H2274	H2274-G2276 PolarHBondContact O-N 3.06Å
2277	G	29.5	Very low	37.2	Very low	70.6 Å²	70.6	107.9 Å²	107.9	73%	0.728	67%	0.67	S	S	*	*			trans	-98.6	125.3	167.1	0	0	0	0	0	109.2	P2275 G2279	P2275-G2277 PolarHBondContact O-N 3.07Å; P2275-G2277 VanDerWaalsContact O-N 3.15Å; G2277-G2279 PolarHBondContact O-N 3.26Å
2278	N	29.9	Very low	35.6	Very low	164.4 Å²	164.4	115.2 Å²	115.2	88%	0.879	70%	0.703	S	S	*	*			trans	-69.1	134.9	172.9	-80.3	10.5	0	0	0	110.2	S2280	N2278-S2280 PolarHBondContact O-N 2.89Å
2279	G	28.1	Very low	34	Very low	79.4 Å²	79.4	117.6 Å²	117.6	82%	0.819	72%	0.721	S	S	*	*			trans	-76	108.1	175.2	0	0	0	0	0	113.6	G2277 S2281	G2277-G2279 PolarHBondContact O-N 3.26Å; G2279-S2281 PolarHBondContact O-N 3.06Å
2280	S	27.5	Very low	32.6	Very low	113.6 Å²	113.6	116.5 Å²	116.5	79%	0.794	73%	0.729	S	S	*	*			trans	-85	122	162.8	9.9	0	0	0	0	111.3	N2278 S2282	N2278-S2280 PolarHBondContact O-N 2.89Å; S2280-S2282 PolarHBondContact O-N 3.31Å
2281	S	27.6	Very low	31.3	Very low	120.8 Å²	120.8	118.3 Å²	118.3	85%	0.845	75%	0.748	S	S	*	*			trans	-100	105.5	169.3	56.3	0	0	0	0	111.7	G2279	G2279-S2281 PolarHBondContact O-N 3.06Å
2282	S	27.8	Very low	30	Very low	114.8 Å²	114.8	119.6 Å²	119.6	80%	0.803	78%	0.778	S	S	*	*			trans	-130.7	127.6	150.4	60.9	0	0	0	0	111	S2280	S2280-S2282 PolarHBondContact O-N 3.31Å
2283	G	26	Very low	29.1	Very low	67.2 Å²	67.2	112.8 Å²	112.8	69%	0.693	78%	0.776	S	S	*	*			trans	-168.8	135.8	158.6	0	0	0	0	0	111.9	T2285	G2283-T2285 PolarHBondContact O-N 3.32Å
2284	H	28	Very low	28.3	Very low	177.6 Å²	177.6	115.6 Å²	115.6	82%	0.822	80%	0.796	S	S	*	*			trans	74.3	109.6	151	-76.8	-75.6	0	0	0	115.5	T2286	H2284-T2286 VanDerWaalsContact C-N 3.31Å; H2284-T2286 PolarHBondContact O-N 2.8Å
2285	T	24.9	Very low	27.7	Very low	130.2 Å²	130.2	113.4 Å²	113.4	80%	0.799	80%	0.799	S	S	*	*			trans	-36.8	91.7	147.5	-33	0	0	0	0	113.3	G2283 T2287	G2283-T2285 PolarHBondContact O-N 3.32Å; T2285-T2287 PolarHBondContact O-N 3.3Å
2286	T	26.1	Very low	27.1	Very low	114.8 Å²	114.8	112 Å²	112	70%	0.704	81%	0.805	S	S	*	*			trans	-76.9	123	155	25.2	0	0	0	0	111.9	H2284 M2288	H2284-T2286 VanDerWaalsContact C-N 3.31Å; H2284-T2286 PolarHBondContact O-N 2.8Å; T2286-M2288 PolarHBondContact O-N 3.13Å; T2286-M2288 VanDerWaalsContact O-N 3.12Å
2287	T	24.6	Very low	26.8	Very low	115.2 Å²	115.2	112.8 Å²	112.8	71%	0.707	80%	0.804	S	S	*	*			trans	-8.7	111.1	160.7	-38.9	0	0	0	0	113	T2285 T2289	T2285-T2287 PolarHBondContact O-N 3.3Å; T2287-T2289 HydrophobicContact CG2-CG2 4.19Å; T2287-T2289 PolarHBondContact O-N 3.47Å; T2287-T2289 VanDerWaalsContact O-N 3.09Å
2288	M	25.6	Very low	26.7	Very low	172.2 Å²	172.2	116.5 Å²	116.5	85%	0.848	81%	0.812	S	S	*	*			trans	-96.3	119.4	156.8	-74.2	-67.7	-142	0	0	109.5	T2286	T2286-M2288 PolarHBondContact O-N 3.13Å; T2286-M2288 VanDerWaalsContact O-N 3.12Å
2289	T	27.9	Very low	26.4	Very low	122.2 Å²	122.2	111.8 Å²	111.8	75%	0.75	80%	0.802	S	S	*	*			trans	-100.8	125.9	157.7	40.5	0	0	0	0	110.6	T2287 G2291	T2287-T2289 HydrophobicContact CG2-CG2 4.19Å; T2287-T2289 PolarHBondContact O-N 3.47Å; T2287-T2289 VanDerWaalsContact O-N 3.09Å; T2289-G2291 PolarHBondContact O-N 3.43Å
2290	S	27.1	Very low	26.3	Very low	120.6 Å²	120.6	113.4 Å²	113.4	84%	0.843	80%	0.801	S	S	*	*			trans	-2.5	103.6	159.8	56.4	0	0	0	0	116.1	G2292	S2290-G2292 PolarHBondContact O-N 3.43Å
2291	G	27.4	Very low	26.2	Very low	79.8 Å²	79.8	117.6 Å²	117.6	82%	0.823	81%	0.805	S	S	*	*			trans	-142.5	103.8	164.7	0	0	0	0	0	110.9	T2289 G2293	T2289-G2291 PolarHBondContact O-N 3.43Å; G2291-G2293 PolarHBondContact O-N 2.98Å; G2291-G2293 VanDerWaalsContact O-N 3.17Å
2292	G	24.8	Very low	26.1	Very low	87 Å²	87	115.5 Å²	115.5	90%	0.897	80%	0.802	S	S	*	*			trans	-84.8	130.2	179.9	0	0	0	0	0	112.1	S2290	S2290-G2292 PolarHBondContact O-N 3.43Å
2293	G	26	Very low	26	Very low	73.4 Å²	73.4	118 Å²	118	76%	0.757	81%	0.805	S	S	*	*			trans	-159	100.8	173	0	0	0	0	0	112.5	G2291 S2295	G2291-G2293 PolarHBondContact O-N 2.98Å; G2291-G2293 VanDerWaalsContact O-N 3.17Å; G2293-S2295 PolarHBondContact O-N 3.1Å
2294	V	26.8	Very low	26	Very low	152.2 Å²	152.2	118.2 Å²	118.2	92%	0.922	81%	0.807	S	S	*	*			trans	-67.9	119.4	167.7	-96.8	0	0	0	0	112.9
2295	S	26.4	Very low	25.9	Very low	115.2 Å²	115.2	119.2 Å²	119.2	81%	0.806	81%	0.809	S	S	*	*			trans	-129.2	132	161.6	21.5	0	0	0	0	110.4	G2293 A2297	G2293-S2295 PolarHBondContact O-N 3.1Å; S2295-A2297 PolarHBondContact O-N 2.93Å
2296	G	25.1	Very low	25.8	Very low	81.2 Å²	81.2	120.8 Å²	120.8	84%	0.837	81%	0.812	S	S	*	*			trans	-106.3	112.7	178.9	0	0	0	0	0	113.9
2297	A	26.3	Very low	25.8	Very low	96.8 Å²	96.8	118.6 Å²	118.6	80%	0.8	81%	0.812	S	S	*	*			trans	-144	137.1	163.3	0	0	0	0	0	111.9	S2295 G2299	S2295-A2297 PolarHBondContact O-N 2.93Å; A2297-G2299 PolarHBondContact O-N 2.82Å
2298	V	26.5	Very low	25.8	Very low	147.8 Å²	147.8	119.2 Å²	119.2	90%	0.896	82%	0.815	S	S	*	*			trans	-66.7	121.8	170	-169.9	0	0	0	0	111.7	S2300	V2298-S2300 PolarHBondContact O-N 2.99Å; V2298-S2300 VanDerWaalsContact O-N 3.09Å
2299	G	24.9	Very low	25.6	Very low	65.4 Å²	65.4	116.6 Å²	116.6	67%	0.674	81%	0.812	S	S	*	*			trans	-68.9	114.5	177.2	0	0	0	0	0	112.9	A2297 F2301	A2297-G2299 PolarHBondContact O-N 2.82Å; G2299-F2301 WeakPolarHBondContact O-CD2 3.48Å; G2299-F2301 PolarHBondContact O-N 2.96Å
2300	S	26	Very low	25.4	Very low	114.4 Å²	114.4	116.2 Å²	116.2	80%	0.8	81%	0.814	S	S	*	*			trans	-114.8	106	147.7	-171.6	0	0	0	0	110.5	V2298 G2302	V2298-S2300 PolarHBondContact O-N 2.99Å; V2298-S2300 VanDerWaalsContact O-N 3.09Å; S2300-G2302 PolarHBondContact O-N 2.97Å
2301	F	24.5	Very low	25.2	Very low	201.8 Å²	201.8	115.6 Å²	115.6	89%	0.885	81%	0.81	S	S	*	*			trans	-98.4	135.8	166.3	-79.1	-90.4	0	0	0	109.1	G2299 I2303	G2299-F2301 WeakPolarHBondContact O-CD2 3.48Å; G2299-F2301 PolarHBondContact O-N 2.96Å; F2301-I2303 HydrophobicContact CB-CD1 4.2Å; F2301-I2303 HydrophobicContact CB-CG1 3.74Å; F2301-I2303 PolarHBondContact O-N 2.98Å
2302	G	24.7	Very low	25.1	Very low	75.6 Å²	75.6	117.2 Å²	117.2	78%	0.779	81%	0.809	S	S	*	*			trans	-137.7	116.7	171.4	0	0	0	0	0	111.3	S2300 G2304	S2300-G2302 PolarHBondContact O-N 2.97Å; G2302-G2304 VanDerWaalsContact C-N 3.33Å; G2302-G2304 PolarHBondContact O-N 3.39Å
2303	I	26.1	Very low	25.1	Very low	166.6 Å²	166.6	118.3 Å²	118.3	85%	0.854	80%	0.803	S	S	*	*			trans	-87.4	102.8	172.6	-62.8	173.9	0	0	0	107.9	F2301 K2305	F2301-I2303 HydrophobicContact CB-CD1 4.2Å; F2301-I2303 HydrophobicContact CB-CG1 3.74Å; F2301-I2303 PolarHBondContact O-N 2.98Å; I2303-K2305 PolarHBondContact O-N 3.06Å; I2303-K2305 VanDerWaalsContact O-N 3.13Å
2304	G	25.8	Very low	25.1	Very low	72.4 Å²	72.4	120.3 Å²	120.3	75%	0.746	81%	0.805	S	S	*	*			trans	-58.2	134.7	167.2	0	0	0	0	0	113.2	G2302 L2306	G2302-G2304 VanDerWaalsContact C-N 3.33Å; G2302-G2304 PolarHBondContact O-N 3.39Å; G2304-L2306 PolarHBondContact O-N 3.24Å
2305	K	26.6	Very low	25	Very low	198.6 Å²	198.6	116.5 Å²	116.5	86%	0.863	80%	0.797	S	S	*	*			trans	-122.5	116.9	165.5	-161.7	175.8	-177.5	-177.7	0	112.9	I2303 G2307	I2303-K2305 PolarHBondContact O-N 3.06Å; I2303-K2305 VanDerWaalsContact O-N 3.13Å; K2305-G2307 PolarHBondContact O-N 2.79Å
2306	L	23.3	Very low	24.9	Very low	164.6 Å²	164.6	114.6 Å²	114.6	86%	0.862	80%	0.795	S	S	*	*			trans	-45.5	123.3	161.3	-131.8	76	0	0	0	114.5	G2304 V2308	G2304-L2306 PolarHBondContact O-N 3.24Å; L2306-V2308 PolarHBondContact O-N 3.29Å
2307	G	25.4	Very low	24.9	Very low	67.4 Å²	67.4	114.1 Å²	114.1	70%	0.695	79%	0.79	S	S	*	*			trans	-139.2	116.8	172.3	0	0	0	0	0	111.2	K2305 C2309	K2305-G2307 PolarHBondContact O-N 2.79Å; G2307-C2309 PolarHBondContact O-N 3.18Å
2308	V	24.2	Very low	24.8	Very low	128.6 Å²	128.6	112.9 Å²	112.9	78%	0.779	79%	0.788	S	S	*	*			trans	8.7	118.6	149.7	-176.3	0	0	0	0	112.8	L2306	L2306-V2308 PolarHBondContact O-N 3.29Å
2309	C	21.5	Very low	24.7	Very low	116.8 Å²	116.8	111.6 Å²	111.6	79%	0.789	78%	0.78	S	S	*	*			trans	176.2	131.7	153.4	-37.8	0	0	0	0	113.6	G2307	G2307-C2309 PolarHBondContact O-N 3.18Å
2310	S	23.3	Very low	24.7	Very low	113.2 Å²	113.2	112.3 Å²	112.3	79%	0.792	78%	0.779	S	S	*	*			trans	-93.2	138.6	156.2	-54.5	0	0	0	0	113.5
2311	S	24.3	Very low	24.7	Very low	108.4 Å²	108.4	113.4 Å²	113.4	76%	0.758	78%	0.776	S	S	*	*			trans	-150.3	121	156.4	53.4	0	0	0	0	113.4	S2313	S2311-S2313 PolarHBondContact O-N 3.43Å
2312	S	24.7	Very low	24.8	Very low	113.4 Å²	113.4	108.3 Å²	108.3	79%	0.793	77%	0.765	S	S	*	*			trans	25.3	121.1	152.7	60	0	0	0	0	117	S2314	S2312-S2314 PolarHBondContact O-N 3.09Å
2313	S	24.8	Very low	25	Very low	111 Å²	111	114.2 Å²	114.2	78%	0.776	76%	0.764	S	S	*	*			trans	-86.7	98.7	162.1	59.5	0	0	0	0	112.8	S2311	S2311-S2313 PolarHBondContact O-N 3.43Å
2314	S	26.7	Very low	25	Very low	115.4 Å²	115.4	113.6 Å²	113.6	81%	0.807	76%	0.762	S	S	*	*			trans	-117.6	129.6	149.3	60.9	0	0	0	0	110.5	S2312 G2316	S2312-S2314 PolarHBondContact O-N 3.09Å; S2314-G2316 PolarHBondContact O-N 2.98Å; S2314-G2316 VanDerWaalsContact O-N 3.12Å
2315	G	24.4	Very low	25.1	Very low	72.6 Å²	72.6	114.2 Å²	114.2	75%	0.748	76%	0.76	S	S	*	*			trans	-101.7	135.1	179.9	0	0	0	0	0	113.8	G2317	G2315-G2317 PolarHBondContact O-N 3.21Å
2316	G	24.7	Very low	25.1	Very low	73.6 Å²	73.6	115.7 Å²	115.7	76%	0.759	76%	0.761	S	S	*	*			trans	74.5	114.3	140.5	0	0	0	0	0	111.9	S2314 G2318	S2314-G2316 PolarHBondContact O-N 2.98Å; S2314-G2316 VanDerWaalsContact O-N 3.12Å; G2316-G2318 PolarHBondContact O-N 2.98Å
2317	G	24.4	Very low	25.2	Very low	71.8 Å²	71.8	112.1 Å²	112.1	74%	0.74	75%	0.749	S	S	*	*			trans	-12.2	130.6	176.8	0	0	0	0	0	112.4	G2315 T2319	G2315-G2317 PolarHBondContact O-N 3.21Å; G2317-T2319 PolarHBondContact O-N 3.21Å; G2317-T2319 VanDerWaalsContact O-N 3.12Å
2318	G	24.9	Very low	25.2	Very low	72 Å²	72	113.4 Å²	113.4	74%	0.742	75%	0.753	S	S	*	*			trans	-65.4	111.7	174.1	0	0	0	0	0	111.8	G2316 A2320	G2316-G2318 PolarHBondContact O-N 2.98Å; G2318-A2320 PolarHBondContact O-N 3.06Å; G2318-A2320 VanDerWaalsContact O-N 3.1Å
2319	T	24.3	Very low	25.3	Very low	120.2 Å²	120.2	113.4 Å²	113.4	74%	0.737	75%	0.748	S	S	*	*			trans	-91.4	128.8	164.3	41.2	0	0	0	0	109.2	G2317 L2321	G2317-T2319 PolarHBondContact O-N 3.21Å; G2317-T2319 VanDerWaalsContact O-N 3.12Å; T2319-L2321 VanDerWaalsContact C-N 3.31Å; T2319-L2321 PolarHBondContact O-N 3.15Å
2320	A	24.5	Very low	25.5	Very low	80 Å²	80	116.4 Å²	116.4	66%	0.661	75%	0.75	S	S	*	*			trans	-79.8	116	167.5	0	0	0	0	0	111.5	G2318 S2322 L2733	G2318-A2320 PolarHBondContact O-N 3.06Å; G2318-A2320 VanDerWaalsContact O-N 3.1Å; A2320-S2322 PolarHBondContact O-N 3Å; A2320-L2733 HydrophobicContact CB-CD2 4.28Å
2321	L	25.5	Very low	25.6	Very low	138 Å²	138	117.9 Å²	117.9	72%	0.723	75%	0.749	S	S	*	*			trans	-90.6	112.6	153.3	-74.6	173.3	0	0	0	109.8	I1996 T2319 R2323	I1996-L2321 HydrophobicContact CD1-CD1 4.14Å; T2319-L2321 VanDerWaalsContact C-N 3.31Å; T2319-L2321 PolarHBondContact O-N 3.15Å; L2321-R2323 VanDerWaalsContact CD1-NH2 3.29Å; L2321-R2323 PolarHBondContact O-N 2.99Å
2322	S	26.8	Very low	25.7	Very low	94 Å²	94	118.4 Å²	118.4	66%	0.657	75%	0.747	S	S	*	*			trans	-46.3	115.9	152.5	-177.5	0	0	0	0	111.2	A2320 N2324	A2320-S2322 PolarHBondContact O-N 3Å; S2322-N2324 VanDerWaalsContact C-N 3.35Å; S2322-N2324 PolarHBondContact O-N 3.13Å
2323	R	28.5	Very low	25.8	Very low	200 Å²	200	119.7 Å²	119.7	76%	0.755	75%	0.745	S	S	*	*			trans	-118.1	108.6	159.5	-75.2	-177.8	-165.9	159.9	3.8	111.7	L2321 A2325	L2321-R2323 VanDerWaalsContact CD1-NH2 3.29Å; L2321-R2323 PolarHBondContact O-N 2.99Å; R2323-A2325 PolarHBondContact O-N 3.23Å
2324	N	27.1	Very low	25.8	Very low	152.8 Å²	152.8	121.6 Å²	121.6	82%	0.817	75%	0.747	S	S	*	*			trans	-104.3	126.3	153.4	-82.2	-15.7	0	0	0	110.6	S2322 R2326	S2322-N2324 VanDerWaalsContact C-N 3.35Å; S2322-N2324 PolarHBondContact O-N 3.13Å; N2324-R2326 PolarHBondContact O-N 3.31Å; N2324-R2326 VanDerWaalsContact O-N 3.13Å
2325	A	27.3	Very low	25.9	Very low	86.4 Å²	86.4	122 Å²	122	71%	0.714	74%	0.744	S	S	*	*			trans	-174	92.7	160.1	0	0	0	0	0	113.1	R1851 R2323 S2327	R1851-A2325 PolarHBondContact NH2-O 2.87Å; R2323-A2325 PolarHBondContact O-N 3.23Å; A2325-S2327 PolarHBondContact O-N 2.79Å
2326	R	25.5	Very low	26	Very low	230.2 Å²	230.2	125.3 Å²	125.3	87%	0.869	74%	0.743	S	S	*	*			trans	-54	76.1	150.6	-76.9	-177.7	-179	-174.5	-0.5	114.2	N2324 A2328	N2324-R2326 PolarHBondContact O-N 3.31Å; N2324-R2326 VanDerWaalsContact O-N 3.13Å; R2326-A2328 VanDerWaalsContact C-N 3.34Å; R2326-A2328 PolarHBondContact O-N 3.15Å
2327	S	26.7	Very low	26.2	Very low	88 Å²	88	128.2 Å²	128.2	62%	0.615	74%	0.741	S	S	*	*			trans	-98.7	94.7	145.2	57.7	0	0	0	0	110.5	R1851 A2325 I2329	R1851-S2327 VanDerWaalsContact CZ-OG 3.24Å; R1851-S2327 PolarHBondContact NH1-OG 2.95Å; R1851-S2327 PolarHBondContact NH2-OG 3.39Å; A2325-S2327 PolarHBondContact O-N 2.79Å; S2327-I2329 VanDerWaalsContact C-N 3.31Å; S2327-I2329 PolarHBondContact O-N 3.13Å
2328	A	25	Very low	26.3	Very low	95.6 Å²	95.6	131.3 Å²	131.3	79%	0.79	74%	0.741	S	S	*	*			trans	-66.3	100.8	160.9	0	0	0	0	0	109.4	R2326 Q2330	R2326-A2328 VanDerWaalsContact C-N 3.34Å; R2326-A2328 PolarHBondContact O-N 3.15Å; A2328-Q2330 VanDerWaalsContact C-N 3.34Å; A2328-Q2330 PolarHBondContact O-N 3.12Å; A2328-Q2330 VanDerWaalsContact O-N 3.08Å
2329	I	26.4	Very low	26.6	Very low	129 Å²	129	135.6 Å²	135.6	66%	0.662	75%	0.746	S	S	*	*			trans	-91.9	102.5	145.9	-70.2	171.6	0	0	0	107.1	S2327 L2331	S2327-I2329 VanDerWaalsContact C-N 3.31Å; S2327-I2329 PolarHBondContact O-N 3.13Å; I2329-L2331 VanDerWaalsContact C-N 3.33Å; I2329-L2331 HydrophobicContact CG2-CB 4.11Å; I2329-L2331 HydrophobicContact CG2-CD1 3.84Å; I2329-L2331 HydrophobicContact CG2-CG 3.81Å; I2329-L2331 PolarHBondContact O-N 3.18Å; I2329-L2331 VanDerWaalsContact O-N 3.16Å
2330	Q	25	Very low	26.7	Very low	178.8 Å²	178.8	133.2 Å²	133.2	84%	0.836	75%	0.746	S	S	*	*			trans	-64.9	101.8	154.8	-172.6	173	-0.3	0	0	109	A2328 T2332	A2328-Q2330 VanDerWaalsContact C-N 3.34Å; A2328-Q2330 PolarHBondContact O-N 3.12Å; A2328-Q2330 VanDerWaalsContact O-N 3.08Å; Q2330-T2332 VanDerWaalsContact C-N 3.33Å; Q2330-T2332 PolarHBondContact O-N 3.18Å; Q2330-T2332 VanDerWaalsContact O-N 3.1Å
2331	L	26	Very low	26.7	Very low	145 Å²	145	135.7 Å²	135.7	76%	0.759	76%	0.757	S	S	*	*			trans	-94.1	103.5	169.1	-79.2	166.7	0	0	0	109.3	I2329 N2333	I2329-L2331 VanDerWaalsContact C-N 3.33Å; I2329-L2331 HydrophobicContact CG2-CB 4.11Å; I2329-L2331 HydrophobicContact CG2-CD1 3.84Å; I2329-L2331 HydrophobicContact CG2-CG 3.81Å; I2329-L2331 PolarHBondContact O-N 3.18Å; I2329-L2331 VanDerWaalsContact O-N 3.16Å; L2331-N2333 PolarHBondContact O-N 2.85Å
2332	T	26.4	Very low	26.9	Very low	119.6 Å²	119.6	136.5 Å²	136.5	73%	0.734	76%	0.76	S	S	*	*			trans	-91.9	126.4	149.5	37.9	0	0	0	0	110	Q2330 N2334	Q2330-T2332 VanDerWaalsContact C-N 3.33Å; Q2330-T2332 PolarHBondContact O-N 3.18Å; Q2330-T2332 VanDerWaalsContact O-N 3.1Å; T2332-N2334 PolarHBondContact O-N 2.95Å; T2332-N2334 VanDerWaalsContact O-N 3.16Å
2333	N	26.1	Very low	26.7	Very low	140.2 Å²	140.2	139.1 Å²	139.1	75%	0.75	77%	0.766	S	S	*	*			trans	-61	122.4	156.9	-83.9	-19.7	0	0	0	110.3	L2331 V2335	L2331-N2333 PolarHBondContact O-N 2.85Å; N2333-V2335 PolarHBondContact O-N 2.89Å
2334	N	26.2	Very low	26.6	Very low	151 Å²	151	137 Å²	137	81%	0.807	77%	0.769	S	S	*	*			trans	-81.6	109.9	140	-98	-3.9	0	0	0	110.6	T2332 I2336	T2332-N2334 PolarHBondContact O-N 2.95Å; T2332-N2334 VanDerWaalsContact O-N 3.16Å; N2334-I2336 VanDerWaalsContact C-N 3.3Å; N2334-I2336 PolarHBondContact O-N 3.02Å
2335	V	27.5	Very low	26.4	Very low	123.2 Å²	123.2	136.7 Å²	136.7	75%	0.747	77%	0.768	S	S	*	*			trans	-86.9	118	168.5	175.5	0	0	0	0	107.9	N2333 N2337	N2333-V2335 PolarHBondContact O-N 2.89Å; V2335-N2337 VanDerWaalsContact C-N 3.26Å; V2335-N2337 WeakPolarHBondContact CG1-OD1 3.17Å; V2335-N2337 PolarHBondContact O-N 2.94Å
2336	I	28	Very low	26.4	Very low	141.4 Å²	141.4	138 Å²	138	73%	0.725	77%	0.771	S	S	*	*			trans	-81.5	116.3	177	-73	166.9	0	0	0	108.6	N2334 N2338	N2334-I2336 VanDerWaalsContact C-N 3.3Å; N2334-I2336 PolarHBondContact O-N 3.02Å; I2336-N2338 HydrophobicContact CG2-CB 4.46Å; I2336-N2338 PolarHBondContact O-N 2.94Å
2337	N	27.8	Very low	26.5	Very low	135.6 Å²	135.6	132.9 Å²	132.9	73%	0.725	77%	0.766	S	S	*	*			trans	-116.9	117.8	145	-124	-1.2	0	0	0	109.8	V2335 N2339	V2335-N2337 VanDerWaalsContact C-N 3.26Å; V2335-N2337 WeakPolarHBondContact CG1-OD1 3.17Å; V2335-N2337 PolarHBondContact O-N 2.94Å; N2337-N2339 PolarHBondContact O-N 3.15Å
2338	N	27.2	Very low	26.6	Very low	136.4 Å²	136.4	135.6 Å²	135.6	73%	0.729	77%	0.773	S	S	*	*			trans	-52.4	135.3	147.2	-71.2	-27.4	0	0	0	110	I2336	I2336-N2338 HydrophobicContact CG2-CB 4.46Å; I2336-N2338 PolarHBondContact O-N 2.94Å
2339	N	30.4	Very low	26.8	Very low	161.4 Å²	161.4	140.3 Å²	140.3	86%	0.863	78%	0.776	S	S	*	*			trans	-168	129.8	148.6	-80	-28.4	0	0	0	110.5	N2337	N2337-N2339 PolarHBondContact O-N 3.15Å
2340	G	27.2	Very low	26.7	Very low	70 Å²	70	145.6 Å²	145.6	72%	0.722	79%	0.787	S	S	*	*			trans	-102.4	149.1	-162.8	0	0	0	0	0	115.3	I2342	G2340-I2342 VanDerWaalsContact C-N 3.29Å; G2340-I2342 PolarHBondContact O-N 2.96Å
2341	C	24.9	Very low	26.9	Very low	133.2 Å²	133.2	142.8 Å²	142.8	90%	0.9	79%	0.785	S	S	*	*			trans	-97.5	117.2	169.1	-88.4	0	0	0	0	110.7	L2343	C2341-L2343 PolarHBondContact O-N 3.38Å
2342	I	27.9	Very low	26.9	Very low	154.4 Å²	154.4	143.9 Å²	143.9	79%	0.792	79%	0.791	S	S	*	*			trans	-71.3	116.4	160.3	-61.3	177.5	0	0	0	111.6	G2340 L2344	G2340-I2342 VanDerWaalsContact C-N 3.29Å; G2340-I2342 PolarHBondContact O-N 2.96Å; I2342-L2344 PolarHBondContact O-N 3.12Å
2343	L	23.5	Very low	26.8	Very low	149.4 Å²	149.4	143.2 Å²	143.2	78%	0.782	79%	0.791	S	S	*	*			trans	-62.2	131.1	148.5	-119.2	104.2	0	0	0	112.4	C2341 N2345	C2341-L2343 PolarHBondContact O-N 3.38Å; L2343-N2345 PolarHBondContact O-N 2.9Å
2344	L	25.7	Very low	26.7	Very low	156.2 Å²	156.2	142.6 Å²	142.6	82%	0.818	79%	0.792	S	S	*	*			trans	-88.6	110.2	156.3	-69.3	176	0	0	0	113.4	I2342 S2346	I2342-L2344 PolarHBondContact O-N 3.12Å; L2344-S2346 PolarHBondContact O-N 3Å
2345	N	23.8	Very low	26.6	Very low	146.2 Å²	146.2	141.2 Å²	141.2	78%	0.782	79%	0.789	S	S	*	*			trans	-85.7	117.6	139.4	-91.6	-26.1	0	0	0	110.8	L2343	L2343-N2345 PolarHBondContact O-N 2.9Å
2346	S	26.9	Very low	26.5	Very low	112.2 Å²	112.2	142.7 Å²	142.7	79%	0.785	79%	0.792	S	S	*	*			trans	-136.1	122.1	142.8	-155	0	0	0	0	110	L2344	L2344-S2346 PolarHBondContact O-N 3Å
2347	T	26.9	Very low	26.3	Very low	123.8 Å²	123.8	144.2 Å²	144.2	76%	0.76	80%	0.795	S	S	*	*			trans	-80.1	118.5	178.9	53	0	0	0	0	110.4
2348	D	29.8	Very low	26.3	Very low	144 Å²	144	143.2 Å²	143.2	77%	0.77	80%	0.797	S	S	*	*			trans	-130.1	123.1	151.9	-103.6	-32.7	0	0	0	113.8
2349	K	28.9	Very low	26.1	Very low	195 Å²	195	141.5 Å²	141.5	85%	0.848	80%	0.795	S	S	*	*			trans	-89.5	132.3	170.2	-69.2	173.6	177.7	164.8	0	112.4
2350	R	24.8	Very low	25.8	Very low	239.8 Å²	239.8	140.9 Å²	140.9	91%	0.905	79%	0.792	S	S	*	*			trans	-109	146	169.2	-83.6	177.5	-177.2	-175.7	0.6	111.7
2351	P	29.5	Very low	25.7	Very low	121 Å²	121	142.8 Å²	142.8	79%	0.786	79%	0.794	S	S	*	*			trans	-99.3	149.3	176.1	26.3	-15.7	0	0	0	113.3
2352	L	24.6	Very low	25.7	Very low	168.2 Å²	168.2	142.3 Å²	142.3	88%	0.881	79%	0.791	S	S	*	*			trans	-95.4	135.1	160.5	-129.6	85.6	0	0	0	113.7	T2354	L2352-T2354 PolarHBondContact O-N 3.28Å
2353	S	24.6	Very low	25.5	Very low	105.6 Å²	105.6	142.2 Å²	142.2	74%	0.738	79%	0.792	S	S	*	*			trans	-36.4	135.9	169.8	105.8	0	0	0	0	113.7	V2355	S2353-V2355 PolarHBondContact O-N 3.08Å; S2353-V2355 VanDerWaalsContact O-N 3.16Å
2354	T	25.4	Very low	25.4	Very low	125.8 Å²	125.8	143.1 Å²	143.1	77%	0.772	80%	0.796	S	S	*	*			trans	-123.3	123.2	157.6	-57.1	0	0	0	0	109.3	L2352 I2356	L2352-T2354 PolarHBondContact O-N 3.28Å; T2354-I2356 HydrophobicContact CG2-CG1 4.35Å
2355	V	24.3	Very low	25.4	Very low	123.4 Å²	123.4	140.5 Å²	140.5	75%	0.748	79%	0.792	S	S	*	*			trans	-93.4	115.3	165.9	176.8	0	0	0	0	110.2	S2353 Q2357	S2353-V2355 PolarHBondContact O-N 3.08Å; S2353-V2355 VanDerWaalsContact O-N 3.16Å; V2355-Q2357 HydrophobicContact CG1-CG 4.28Å; V2355-Q2357 PolarHBondContact O-N 3.29Å; V2355-Q2357 VanDerWaalsContact O-N 3.15Å
2356	I	24.8	Very low	25.4	Very low	154.6 Å²	154.6	143 Å²	143	79%	0.793	80%	0.795	S	S	*	*			trans	-78.3	118.7	162.8	-55.2	174.3	0	0	0	110.7	T2354	T2354-I2356 HydrophobicContact CG2-CG1 4.35Å
2357	Q	24.1	Very low	25.2	Very low	171.2 Å²	171.2	145.3 Å²	145.3	80%	0.8	80%	0.798	S	S	*	*			trans	-80.4	144.5	162.3	-80.2	-175.7	-20.8	0	0	109.8	V2355 S2359	V2355-Q2357 HydrophobicContact CG1-CG 4.28Å; V2355-Q2357 PolarHBondContact O-N 3.29Å; V2355-Q2357 VanDerWaalsContact O-N 3.15Å; Q2357-S2359 PolarHBondContact O-N 2.98Å
2358	P	26.8	Very low	25.1	Very low	116.4 Å²	116.4	145.2 Å²	145.2	76%	0.756	80%	0.797	S	S	*	*				-107.5	148.5	122.3	30.5	-16.3	0	0	0	111.5	D2360	P2358-D2360 PolarHBondContact O-N 2.85Å
2359	S	23.6	Very low	24.8	Very low	99.6 Å²	99.6	148 Å²	148	70%	0.697	80%	0.803	S	S	*	*			trans	-64.3	127.2	169	56.5	0	0	0	0	114.4	Q2357	Q2357-S2359 PolarHBondContact O-N 2.98Å
2360	D	24.7	Very low	24.6	Very low	149 Å²	149	143.9 Å²	143.9	80%	0.797	80%	0.798	S	S	*	*				-117.9	141	126.6	-81	-43.7	0	0	0	113.7	P2358	P2358-D2360 PolarHBondContact O-N 2.85Å
2361	S	25.4	Very low	24.6	Very low	108.8 Å²	108.8	139.5 Å²	139.5	76%	0.761	79%	0.793	S	S	*	*			trans	84.1	112.3	146.3	79.1	0	0	0	0	116.3
2362	C	24	Very low	24.5	Very low	123.6 Å²	123.6	144.3 Å²	144.3	84%	0.835	80%	0.797	S	S	*	*			trans	-143	135.6	134.3	-67.5	0	0	0	0	110.7
2363	N	23.7	Very low	24.6	Very low	152.8 Å²	152.8	142.6 Å²	142.6	82%	0.817	79%	0.789	S	S	*	*			trans	-65.4	149.3	176.8	-81.6	-48.1	0	0	0	114.4	S2365	N2363-S2365 PolarHBondContact O-N 2.87Å
2364	L	21.5	Very low	24.7	Very low	167.6 Å²	167.6	144.1 Å²	144.1	88%	0.877	79%	0.788	S	S	*	*			trans	-18.3	112.5	151.8	-162.1	71.4	0	0	0	113.9
2365	S	24.7	Very low	24.8	Very low	102.6 Å²	102.6	144.8 Å²	144.8	72%	0.717	79%	0.788	S	S	*	*			trans	-159.9	145.2	137.1	61.3	0	0	0	0	114.4	N2363 L2367	N2363-S2365 PolarHBondContact O-N 2.87Å; S2365-L2367 PolarHBondContact O-N 3.47Å
2366	K	23.8	Very low	24.9	Very low	198.2 Å²	198.2	144.6 Å²	144.6	86%	0.862	79%	0.79	S	S	*	*			trans	4.3	129.5	164	-68.3	171.2	177.8	176	0	115.1
2367	L	23.3	Very low	25	Very low	161.2 Å²	161.2	145.8 Å²	145.8	84%	0.844	79%	0.79	S	S	*	*				-158.2	141	121.1	-138.2	79.9	0	0	0	112.4	S2365	S2365-L2367 PolarHBondContact O-N 3.47Å
2368	T	24.4	Very low	25	Very low	119.8 Å²	119.8	145 Å²	145	74%	0.735	79%	0.79	S	S	*	*			trans	-123.2	148.4	166.5	28.3	0	0	0	0	113.5	S2370	T2368-S2370 PolarHBondContact O-N 3.06Å; T2368-S2370 VanDerWaalsContact O-N 3.13Å
2369	K	24	Very low	25	Very low	204.8 Å²	204.8	147.8 Å²	147.8	89%	0.89	80%	0.795	S	S	*	*			trans	-10.7	128.6	159.4	-73	174.6	176.6	-179.4	0	113.5
2370	S	25.2	Very low	25	Very low	107.8 Å²	107.8	152 Å²	152	75%	0.754	80%	0.801	S	S	*	*			trans	-136.5	138.6	140.2	46	0	0	0	0	109.2	T2368 Y2372	T2368-S2370 PolarHBondContact O-N 3.06Å; T2368-S2370 VanDerWaalsContact O-N 3.13Å; S2370-Y2372 PolarHBondContact O-N 3.05Å
2371	N	24.7	Very low	25	Very low	147 Å²	147	152.9 Å²	152.9	79%	0.786	80%	0.803	S	S	*	*			trans	-84.4	139.9	179.6	-78.7	-10.2	0	0	0	109.3
2372	Y	27	Very low	25.2	Very low	221.4 Å²	221.4	153.5 Å²	153.5	87%	0.868	80%	0.803	S	S	*	*			trans	-131.8	146.1	134.6	-109	-76	0	0	0	108.6	S2370	S2370-Y2372 PolarHBondContact O-N 3.05Å
2373	N	26.1	Very low	25.2	Very low	133.6 Å²	133.6	153.7 Å²	153.7	71%	0.714	80%	0.801	S	S	*	*			trans	-88.4	147.6	-170.5	-134	22.9	0	0	0	111.7	N2375	N2373-N2375 VanDerWaalsContact C-N 3.35Å; N2373-N2375 PolarHBondContact O-N 2.76Å
2374	D	27.7	Very low	25.4	Very low	136.4 Å²	136.4	152.8 Å²	152.8	73%	0.729	80%	0.801	S	S	*	*			trans	-57.4	132	155.8	-75.5	-39.8	0	0	0	114.2	C2376	D2374-C2376 PolarHBondContact O-N 2.79Å; D2374-C2376 VanDerWaalsContact O-N 3.13Å
2375	N	27.7	Very low	25.6	Very low	141.6 Å²	141.6	152.1 Å²	152.1	76%	0.757	80%	0.799	S	S	*	*			trans	-128.2	104.5	149.4	-84.3	-50	0	0	0	111.4	N2373	N2373-N2375 VanDerWaalsContact C-N 3.35Å; N2373-N2375 PolarHBondContact O-N 2.76Å
2376	C	26.4	Very low	25.6	Very low	118 Å²	118	155.4 Å²	155.4	80%	0.797	80%	0.803	S	S	*	*			trans	-94.9	119.3	158.3	-129.4	0	0	0	0	112.6	D2374 L2378	D2374-C2376 PolarHBondContact O-N 2.79Å; D2374-C2376 VanDerWaalsContact O-N 3.13Å; C2376-L2378 PolarHBondContact O-N 3.07Å
2377	F	25.8	Very low	25.8	Very low	181.2 Å²	181.2	153.8 Å²	153.8	80%	0.795	80%	0.8	S	S	*	*			trans	-74.8	114.6	169.7	-103.1	-97.6	0	0	0	112.7	M2379	F2377-M2379 HydrophobicContact CD1-CE 4.09Å; F2377-M2379 HydrophobicContact CE1-CE 4.07Å; F2377-M2379 PolarHBondContact O-N 3.17Å; F2377-M2379 VanDerWaalsContact O-N 3.12Å
2378	L	24.9	Very low	25.9	Very low	153.6 Å²	153.6	153.6 Å²	153.6	80%	0.804	80%	0.799	S	S	*	*			trans	-46.8	109.2	155.8	-156.8	75.4	0	0	0	112.5	C2376 K2380	C2376-L2378 PolarHBondContact O-N 3.07Å; L2378-K2380 PolarHBondContact O-N 3.15Å
2379	M	26.8	Very low	26.3	Very low	174.6 Å²	174.6	153.2 Å²	153.2	86%	0.86	80%	0.799	S	S	*	*			trans	-79.1	109.7	159.4	-101.3	-110.5	169.5	0	0	111.8	F2377 M2381	F2377-M2379 HydrophobicContact CD1-CE 4.09Å; F2377-M2379 HydrophobicContact CE1-CE 4.07Å; F2377-M2379 PolarHBondContact O-N 3.17Å; F2377-M2379 VanDerWaalsContact O-N 3.12Å; M2379-M2381 PolarHBondContact O-N 2.84Å
2380	K	23.9	Very low	26.4	Very low	187.6 Å²	187.6	150.2 Å²	150.2	82%	0.816	79%	0.792	S	S	*	*			trans	-78.9	137.2	176	-153.6	174.1	178.8	-178.7	0	111.3	L2378 P2382	L2378-K2380 PolarHBondContact O-N 3.15Å; K2380-P2382 WeakPolarHBondContact O-CD 3.21Å
2381	M	24.6	Very low	26.4	Very low	169.4 Å²	169.4	151.8 Å²	151.8	83%	0.834	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-63.7	142.1	166.8	-73	-70.9	-177	0	0	111.2	M2379 T2383	M2379-M2381 PolarHBondContact O-N 2.84Å; M2381-T2383 PolarHBondContact O-N 2.81Å
2382	P	28.2	Very low	26.6	Very low	119.8 Å²	119.8	152.2 Å²	152.2	78%	0.778	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-93.2	138.5	165.7	24.4	-14.4	0	0	0	112.5	K2380 T2384	K2380-P2382 WeakPolarHBondContact O-CD 3.21Å; P2382-T2384 PolarHBondContact O-N 2.78Å
2383	T	24.6	Very low	26.6	Very low	128.6 Å²	128.6	148.3 Å²	148.3	79%	0.789	79%	0.787	S	S	*	*			trans	-96.9	130.1	165.8	50.5	0	0	0	0	109.2	M2381	M2381-T2383 PolarHBondContact O-N 2.81Å
2384	T	27.3	Very low	26.5	Very low	133.4 Å²	133.4	149.7 Å²	149.7	82%	0.818	79%	0.792	S	S	*	*			trans	-131.6	131.7	153.9	36	0	0	0	0	109.2	P2382 E2386	P2382-T2384 PolarHBondContact O-N 2.78Å; T2384-E2386 VanDerWaalsContact C-N 3.31Å; T2384-E2386 PolarHBondContact O-N 2.95Å
2385	D	25.4	Very low	26.8	Very low	153.6 Å²	153.6	148.1 Å²	148.1	82%	0.821	79%	0.789	S	S	*	*			trans	-84.5	151.1	172.4	-82.1	-52.7	0	0	0	112.6	M2387	D2385-M2387 PolarHBondContact O-N 2.9Å
2386	E	25.9	Very low	26.7	Very low	171 Å²	171	146.5 Å²	146.5	80%	0.799	79%	0.788	S	S	*	*			trans	-81.8	122.5	157.9	-72.7	-148.7	151.7	0	0	115.7	T2384 L2388	T2384-E2386 VanDerWaalsContact C-N 3.31Å; T2384-E2386 PolarHBondContact O-N 2.95Å; E2386-L2388 PolarHBondContact O-N 3.48Å; E2386-L2388 VanDerWaalsContact O-N 3.16Å
2387	M	27.7	Very low	26.6	Very low	166.2 Å²	166.2	148.2 Å²	148.2	82%	0.819	79%	0.789	S	S	*	*			trans	70.9	122	142	-68.8	-79.9	131.7	0	0	115.5	D2385	D2385-M2387 PolarHBondContact O-N 2.9Å
2388	L	25.7	Very low	26.6	Very low	157 Å²	157	145.5 Å²	145.5	82%	0.822	79%	0.788	S	S	*	*			trans	-102.1	149.8	156.2	-120.8	103.3	0	0	0	110	E2386 D2390	E2386-L2388 PolarHBondContact O-N 3.48Å; E2386-L2388 VanDerWaalsContact O-N 3.16Å; L2388-D2390 PolarHBondContact O-N 2.94Å
2389	P	32.2	Very low	26.6	Very low	111.2 Å²	111.2	144.3 Å²	144.3	72%	0.722	79%	0.787	S	S	*	*			trans	-111	147.6	176.7	34.9	-26.7	0	0	0	113.2
2390	D	26	Very low	26.5	Very low	140.4 Å²	140.4	141.4 Å²	141.4	75%	0.751	78%	0.779	S	S	*	*			trans	-125.9	130.1	146.5	-88.3	-36.7	0	0	0	115.7	L2388	L2388-D2390 PolarHBondContact O-N 2.94Å
2391	N	25.7	Very low	26.6	Very low	142 Å²	142	140.3 Å²	140.3	76%	0.759	78%	0.779	S	S	*	*			trans	40.6	124.8	139.9	-84	-38.6	0	0	0	121.5
2392	I	28.9	Very low	26.6	Very low	156.6 Å²	156.6	137.9 Å²	137.9	80%	0.803	77%	0.773	S	S	*	*				171.5	116.9	129.9	-76.5	158.6	0	0	0	113.6
2393	N	26.3	Very low	26.6	Very low	138.6 Å²	138.6	138.1 Å²	138.1	74%	0.741	77%	0.773	S	S	*	*			trans	44.2	123.1	154.8	-90.6	-10.3	0	0	0	120.7
2394	M	25.1	Very low	26.6	Very low	163.8 Å²	163.8	136 Å²	136	81%	0.807	77%	0.769	S	S	*	*			trans	160	150	131.3	-84.4	-66	131.3	0	0	113.9
2395	P	33.3	Very low	26.6	Very low	102.8 Å²	102.8	135.6 Å²	135.6	67%	0.668	77%	0.766	S	S	*	*				-126.1	162.9	-92.3	34.4	-17.5	0	0	0	115	N2397	P2395-N2397 PolarHBondContact O-N 2.81Å
2396	S	25.3	Very low	26.6	Very low	107.2 Å²	107.2	134.2 Å²	134.2	75%	0.75	76%	0.763	S	S	*	*			trans	-32.2	126.2	159.1	-61.3	0	0	0	0	116.4	T2398	S2396-T2398 PolarHBondContact O-N 3.08Å
2397	N	25.6	Very low	26.7	Very low	153 Å²	153	132.1 Å²	132.1	82%	0.818	76%	0.762	S	S	*	*			trans	-57.3	114.4	161.4	-82.2	-7.9	0	0	0	113.1	P2395	P2395-N2397 PolarHBondContact O-N 2.81Å
2398	T	25.2	Very low	26.7	Very low	125.2 Å²	125.2	128.4 Å²	128.4	77%	0.768	76%	0.758	S	S	*	*			trans	-122.7	120.2	137.6	40	0	0	0	0	111.5	S2396 T2400	S2396-T2398 PolarHBondContact O-N 3.08Å; T2398-T2400 PolarHBondContact O-N 3.11Å
2399	V	25.1	Very low	26.7	Very low	128.6 Å²	128.6	127.1 Å²	127.1	78%	0.779	76%	0.756	S	S	*	*			trans	-129.8	122.4	159.7	-179.5	0	0	0	0	109.4
2400	T	23.8	Very low	26.5	Very low	113.2 Å²	113.2	127.5 Å²	127.5	69%	0.694	76%	0.757	S	S	*	*				175.2	130.3	99.9	-31.2	0	0	0	0	111.7	T2398 V2402	T2398-T2400 PolarHBondContact O-N 3.11Å; T2400-V2402 HydrophobicContact CG2-CG2 4.34Å
2401	M	25.8	Very low	26.7	Very low	164.2 Å²	164.2	127.7 Å²	127.7	81%	0.809	76%	0.757	S	S	*	*				-143.5	144.4	120.9	-90.7	-58	-117.6	0	0	111.7
2402	V	26.6	Very low	26.7	Very low	119 Å²	119	126.9 Å²	126.9	72%	0.721	75%	0.752	S	S	*	*				-148.4	127.5	129.6	166.5	0	0	0	0	110.2	T2400	T2400-V2402 HydrophobicContact CG2-CG2 4.34Å
2403	T	26.6	Very low	26.7	Very low	125.4 Å²	125.4	125.2 Å²	125.2	77%	0.769	75%	0.745	S	S	*	*			trans	-115.5	140.1	135.7	-21.6	0	0	0	0	113
2404	A	25.9	Very low	26.9	Very low	84.6 Å²	84.6	124.6 Å²	124.6	70%	0.699	74%	0.742	S	S	*	*				-123.9	150.7	89	0	0	0	0	0	112.4
2405	T	26.2	Very low	27	Very low	124.4 Å²	124.4	123 Å²	123	76%	0.763	74%	0.736	S	S	*	*				-138.7	142.3	97.9	-8.8	0	0	0	0	112
2406	T	26.9	Very low	26.7	Very low	124.6 Å²	124.6	124.7 Å²	124.7	76%	0.764	74%	0.74	S	S	*	*			trans	-18.3	146.4	158.8	20.4	0	0	0	0	114
2407	T	27.2	Very low	26.8	Very low	126 Å²	126	124 Å²	124	77%	0.773	74%	0.735	S	S	*	*				-148.3	147.2	51.2	27.6	0	0	0	0	111.2
2408	A	26.6	Very low	26.8	Very low	88.2 Å²	88.2	124.5 Å²	124.5	73%	0.729	73%	0.732	S	S	*	*				-145	133.4	81	0	0	0	0	0	109.9
2409	T	27.4	Very low	26.9	Very low	129.8 Å²	129.8	126.5 Å²	126.5	80%	0.796	74%	0.735	S	S	*	*				-159.6	137.4	105.9	27.1	0	0	0	0	110.7
2410	T	26.8	Very low	27	Very low	119.2 Å²	119.2	128.1 Å²	128.1	73%	0.731	73%	0.732	S	S	*	*				-139.8	133	126	-63.2	0	0	0	0	110.2	N2412	T2410-N2412 HydrophobicContact CG2-CB 4.43Å
2411	I	29.7	Very low	27.2	Very low	145.2 Å²	145.2	130.2 Å²	130.2	75%	0.745	73%	0.733	S	S	*	*				130.6	109.1	84.4	-78.7	168.2	0	0	0	108.6
2412	N	27.1	Very low	27.3	Very low	125.8 Å²	125.8	128.7 Å²	128.7	67%	0.673	73%	0.729	S	S	*	*				73	131	79.5	-137.1	29.1	0	0	0	114	T2410	T2410-N2412 HydrophobicContact CG2-CB 4.43Å
2413	N	29.1	Very low	27.4	Very low	121 Å²	121	128.7 Å²	128.7	65%	0.647	73%	0.725	S	S	*	*				107.6	142.8	116.3	-83	-6.4	0	0	0	114.6
2414	N	29	Very low	27.7	Very low	125.8 Å²	125.8	132.2 Å²	132.2	67%	0.673	73%	0.725	S	S	*	*				115.9	137	96.2	-84.6	-2.9	0	0	0	115.6
2415	N	28.8	Very low	27.8	Very low	129.4 Å²	129.4	134.4 Å²	134.4	69%	0.692	73%	0.725	S	S	*	*				76.1	129	126.8	-62.5	-5	0	0	0	118.9
2416	N	26.4	Very low	27.9	Very low	138.6 Å²	138.6	135.1 Å²	135.1	74%	0.741	72%	0.724	S	S	*	*				90	142.2	99.3	-74.8	-2.3	0	0	0	114.7
2417	S	27.7	Very low	28	Very low	92.2 Å²	92.2	134.5 Å²	134.5	65%	0.645	72%	0.72	S	S	*	*				112.9	140	97.4	63.5	0	0	0	0	114.5
2418	E	24.1	Very low	28	Very low	164.6 Å²	164.6	137.9 Å²	137.9	77%	0.769	72%	0.72	S	S	*	*				112.9	128.5	110.8	-89.5	175.6	139.4	0	0	114.3	K2420	E2418-K2420 HydrophobicContact CG-CD 4.5Å; E2418-K2420 HydrophobicContact CG-CG 4.47Å; E2418-K2420 WeakPolarHBondContact OE1-CE 3.3Å
2419	M	28.1	Very low	27.9	Very low	166.4 Å²	166.4	140.5 Å²	140.5	82%	0.82	72%	0.721	S	S	*	*				129.6	134.1	103.5	-76.8	-101.2	-112.3	0	0	111.6
2420	K	26.6	Very low	27.8	Very low	163.2 Å²	163.2	138.7 Å²	138.7	71%	0.71	71%	0.714	S	S	*	*				-145.5	146	97.3	-87.9	168.6	172.3	-143	0	112.4	E2418	E2418-K2420 HydrophobicContact CG-CD 4.5Å; E2418-K2420 HydrophobicContact CG-CG 4.47Å; E2418-K2420 WeakPolarHBondContact OE1-CE 3.3Å
2421	E	27.8	Very low	27.8	Very low	156.6 Å²	156.6	138.8 Å²	138.8	73%	0.732	71%	0.714	S	S	*	*			cis	-145	156.6	39.4	-96.9	157.3	168.2	0	0	108.4
2422	D	29.7	Very low	27.7	Very low	132.8 Å²	132.8	138.7 Å²	138.7	71%	0.71	72%	0.715	S	S	*	*				145.7	145.5	61.8	-89.1	-17.1	0	0	0	110.3
2423	N	28.6	Very low	27.7	Very low	119.6 Å²	119.6	140.6 Å²	140.6	64%	0.64	73%	0.725	S	S	*	*			cis	159	146.8	38.9	-139.4	-25.7	0	0	0	112.7
2424	Y	30.9	Very low	27.6	Very low	198.6 Å²	198.6	140.1 Å²	140.1	78%	0.779	73%	0.731	S	S	*	*			trans	72.8	109.8	154.3	-77.3	-81.9	0	0	0	119.5
2425	D	28.2	Very low	27.8	Very low	131.2 Å²	131.2	139.7 Å²	139.7	70%	0.702	74%	0.735	S	S	*	*				69.9	139.7	121.1	-77.7	-2.1	0	0	0	119.5
2426	D	28.7	Very low	27.7	Very low	138.8 Å²	138.8	138.7 Å²	138.7	74%	0.742	74%	0.738	S	S	*	*				107.9	127.3	128.8	-124.4	10.6	0	0	0	118.1
2427	V	28.4	Very low	27.7	Very low	111.8 Å²	111.8	137 Å²	137	68%	0.678	74%	0.737	S	S	*	*				122.2	127.2	117.4	154.8	0	0	0	0	116
2428	Y	27.2	Very low	27.7	Very low	196.4 Å²	196.4	141.3 Å²	141.3	77%	0.77	75%	0.747	S	S	*	*			trans	57.2	132.7	162.3	-84.3	-105.6	0	0	0	119.1
2429	L	26.4	Very low	27.8	Very low	142.6 Å²	142.6	138.2 Å²	138.2	75%	0.747	74%	0.744	S	S	*	*				98.8	134.7	92	-105.1	103.3	0	0	0	114.6
2430	S	25.1	Very low	27.8	Very low	93.8 Å²	93.8	137 Å²	137	66%	0.656	74%	0.741	S	S	*	*				118.5	138.2	98.1	32.6	0	0	0	0	118.1
2431	T	26.6	Very low	28	Very low	119.6 Å²	119.6	138.8 Å²	138.8	73%	0.734	75%	0.748	S	S	*	*				101.8	125.9	123.6	42	0	0	0	0	117.8
2432	N	27.1	Very low	28	Very low	143.6 Å²	143.6	136.6 Å²	136.6	77%	0.768	75%	0.75	S	S	*	*				137.3	145.6	118.2	-83.3	-22.9	0	0	0	118.4
2433	L	27.9	Very low	28	Very low	165.4 Å²	165.4	139.5 Å²	139.5	87%	0.866	76%	0.756	S	S	*	*			trans	91.4	110.4	146.3	-76.8	153.8	0	0	0	119.3
2434	S	26.8	Very low	27.9	Very low	110.2 Å²	110.2	141.4 Å²	141.4	77%	0.771	77%	0.766	S	S	*	*			trans	-69.6	167.1	148.2	-98.9	0	0	0	0	113.5
2435	P	33.6	Very low	27.8	Very low	118.6 Å²	118.6	137.7 Å²	137.7	77%	0.77	76%	0.764	S	S	*	*			cis	-132.9	176	29.1	39.2	-24	0	0	0	114.6
2436	S	25	Very low	28	Very low	107.2 Å²	107.2	140.8 Å²	140.8	75%	0.75	77%	0.772	S	S	*	*			trans	-161.7	146.7	160.8	53.1	0	0	0	0	112.2
2437	S	27.7	Very low	28.1	Very low	103.6 Å²	103.6	139.1 Å²	139.1	72%	0.724	77%	0.771	S	S	*	*				122	138.5	80.9	-20.6	0	0	0	0	114.8
2438	E	26.7	Very low	28.5	Very low	183.6 Å²	183.6	142.8 Å²	142.8	86%	0.858	78%	0.777	S	S	*	*			trans	68.3	130.3	130.9	-72.8	-179.7	169	0	0	118.4
2439	S	27.4	Very low	29.2	Very low	98.8 Å²	98.8	141.9 Å²	141.9	69%	0.691	78%	0.78	S	S	*	*				129.4	145.9	58.1	69.6	0	0	0	0	114.5
2440	N	28	Very low	30.1	Very low	141.4 Å²	141.4	140.6 Å²	140.6	76%	0.756	77%	0.773	S	S	*	*			trans	-51.6	123.5	136.7	-80.8	-41.3	0	0	0	115.4
2441	K	29.5	Very low	31.6	Very low	199.6 Å²	199.6	141 Å²	141	87%	0.868	77%	0.773	S	S	*	*				158.4	121.8	125.1	-86.5	166.3	-170.7	169.6	0	114.2	K2443	K2441-K2443 PolarHBondContact O-N 2.86Å
2442	S	28.2	Very low	33	Very low	111 Å²	111	141.9 Å²	141.9	78%	0.776	77%	0.771	S	S	*	*				-139.5	145.8	121.4	59.4	0	0	0	0	112.8
2443	K	29.1	Very low	34.4	Very low	193.6 Å²	193.6	139.9 Å²	139.9	84%	0.842	76%	0.76	S	S	*	*			trans	159.9	131.1	141.1	-130.7	179.7	-178.8	-179.4	0	112.2	K2441	K2441-K2443 PolarHBondContact O-N 2.86Å
2444	L	27.6	Very low	36	Very low	160.2 Å²	160.2	134.4 Å²	134.4	84%	0.839	74%	0.738	S	S	*	*			trans	148.1	122	170.2	-95.7	138.1	0	0	0	113.6
2445	T	28.8	Very low	37.7	Very low	120.2 Å²	120.2	134.1 Å²	134.1	74%	0.737	73%	0.725	S	S	*	*			trans	-86.4	114.3	166.6	50.8	0	0	0	0	112.6
2446	F	31.7	Very low	39	Very low	197.6 Å²	197.6	132.6 Å²	132.6	87%	0.867	71%	0.709	S	S	*	*			trans	-147	82.3	144	-126.6	-87.3	0	0	0	112.9
2447	S	31.8	Very low	40.7	Very low	102.2 Å²	102.2	132.6 Å²	132.6	72%	0.715	70%	0.7	S	S	*	*			trans	-116.1	83.4	177.4	54.8	0	0	0	0	113.1	Q2449	S2447-Q2449 VanDerWaalsContact C-N 3.3Å; S2447-Q2449 PolarHBondContact O-N 2.87Å; S2447-Q2449 VanDerWaalsContact O-N 3.14Å
2448	K	36.4	Very low	42.2	Very low	188.6 Å²	188.6	134.5 Å²	134.5	82%	0.82	70%	0.698	S	S	*	*			trans	-113.1	79.7	171.7	-105.4	178.1	179.8	-177.9	0	111.3	I2450	K2448-I2450 PolarHBondContact O-N 3.24Å; K2448-I2450 VanDerWaalsContact O-N 3.09Å
2449	Q	41.1	Very low	43.8	Very low	178.4 Å²	178.4	129.6 Å²	129.6	83%	0.834	68%	0.675	S	S	*	*			trans	-47.5	76.6	157.7	-76.5	177.8	-31.2	0	0	114.2	S2447 P2451	S2447-Q2449 VanDerWaalsContact C-N 3.3Å; S2447-Q2449 PolarHBondContact O-N 2.87Å; S2447-Q2449 VanDerWaalsContact O-N 3.14Å; Q2449-P2451 WeakPolarHBondContact O-CD 3.5Å; Q2449-P2451 VanDerWaalsContact O-N 3.12Å
2450	I	45.4	Very low	45	Very low	116.2 Å²	116.2	129.8 Å²	129.8	60%	0.596	67%	0.672	S	S	*	*			trans	-97.4	113.3	175.9	-58.5	171.9	0	0	0	107.8	K2448 M2452 L2453 A2454	K2448-I2450 PolarHBondContact O-N 3.24Å; K2448-I2450 VanDerWaalsContact O-N 3.09Å; I2450-M2452 VanDerWaalsContact C-N 3.28Å; I2450-M2452 HydrophobicContact CG2-CB 3.92Å; I2450-M2452 PolarHBondContact O-N 3.16Å; I2450-L2453 HydrophobicContact CB-CB 3.92Å; I2450-L2453 HydrophobicContact CD1-CD2 4.24Å; I2450-L2453 HydrophobicContact CG2-CB 3.87Å; I2450-L2453 WeakPolarHBondContact O-CB 3.37Å; I2450-L2453 PolarHBondContact O-N 2.92Å; I2450-L2453 VanDerWaalsContact O-N 3.1Å; I2450-A2454 HydrophobicContact CG2-CB 3.93Å; I2450-A2454 WeakPolarHBondContact O-CB 3.36Å; I2450-A2454 PolarHBondContact O-N 2.87Å; I2450-A2454 VanDerWaalsContact O-N 3.07Å
2451	P	57.2	Low	45.9	Very low	101.4 Å²	101.4	129.7 Å²	129.7	66%	0.658	67%	0.671	S	S	*	*	H	α-helix	trans	-67	-32.6	-175.7	25.3	-33	0	0	0	112.1	Q2449 L2453 A2454 Q2455	Q2449-P2451 WeakPolarHBondContact O-CD 3.5Å; Q2449-P2451 VanDerWaalsContact O-N 3.12Å; P2451-L2453 PolarHBondContact O-N 2.99Å; P2451-A2454 HydrophobicContact CG-CB 4.24Å; P2451-A2454 PolarHBondContact O-N 3.01Å; P2451-Q2455 VanDerWaalsContact O-CB 3.31Å; P2451-Q2455 WeakPolarHBondContact O-CB 3.35Å; P2451-Q2455 PolarHBondContact O-N 3.03Å
2452	M	56.5	Low	46.9	Very low	137.8 Å²	137.8	125 Å²	125	68%	0.679	66%	0.659	S	S	*	*	H	α-helix	trans	-61.5	-35.1	179.4	-169.6	-174.4	-105.3	0	0	113.1	I2450 A2454 Q2455 L2456	I2450-M2452 VanDerWaalsContact C-N 3.28Å; I2450-M2452 HydrophobicContact CG2-CB 3.92Å; I2450-M2452 PolarHBondContact O-N 3.16Å; M2452-A2454 VanDerWaalsContact C-N 3.35Å; M2452-A2454 PolarHBondContact O-N 2.66Å; M2452-Q2455 PolarHBondContact O-N 3.13Å; M2452-L2456 HydrophobicContact CG-CD1 4.11Å; M2452-L2456 HydrophobicContact CG-CG 4.29Å; M2452-L2456 WeakPolarHBondContact O-CB 3.27Å; M2452-L2456 WeakPolarHBondContact O-CD1 3.33Å; M2452-L2456 VanDerWaalsContact O-CG 3.28Å; M2452-L2456 WeakPolarHBondContact O-CG 3.37Å; M2452-L2456 PolarHBondContact O-N 3.17Å; M2452-L2456 VanDerWaalsContact O-N 3.11Å; M2452-L2456 HydrophobicContact SD-CD1 4.35Å
2453	L	54.8	Low	47.5	Very low	102.4 Å²	102.4	122.6 Å²	122.6	54%	0.536	65%	0.647	S	S	.	*	H	α-helix	trans	-70.9	-38.1	177.8	-176.7	64.7	0	0	0	111.9	I2450 P2451 Q2455 L2456 L2457	I2450-L2453 HydrophobicContact CB-CB 3.92Å; I2450-L2453 HydrophobicContact CD1-CD2 4.24Å; I2450-L2453 HydrophobicContact CG2-CB 3.87Å; I2450-L2453 WeakPolarHBondContact O-CB 3.37Å; I2450-L2453 PolarHBondContact O-N 2.92Å; I2450-L2453 VanDerWaalsContact O-N 3.1Å; P2451-L2453 PolarHBondContact O-N 2.99Å; L2453-Q2455 VanDerWaalsContact C-N 3.32Å; L2453-L2456 CarbonylContact O-C 3.58Å; L2453-L2456 PolarHBondContact O-N 3.06Å; L2453-L2457 HydrophobicContact CD1-CD1 4.08Å; L2453-L2457 HydrophobicContact CD2-CD1 4.39Å; L2453-L2457 HydrophobicContact CG-CD1 4.06Å; L2453-L2457 WeakPolarHBondContact O-CB 3.21Å; L2453-L2457 WeakPolarHBondContact O-CD1 3.19Å; L2453-L2457 VanDerWaalsContact O-CG 3.31Å; L2453-L2457 WeakPolarHBondContact O-CG 3.31Å; L2453-L2457 PolarHBondContact O-N 3.08Å; L2453-L2457 VanDerWaalsContact O-N 3.12Å
2454	A	63	Low	48	Very low	50 Å²	50	123.5 Å²	123.5	41%	0.413	65%	0.645	S	S	.	*	H	α-helix	trans	-65.1	-43	175	0	0	0	0	0	111.1	I2450 P2451 M2452 L2456 L2457 E2458	I2450-A2454 HydrophobicContact CG2-CB 3.93Å; I2450-A2454 WeakPolarHBondContact O-CB 3.36Å; I2450-A2454 PolarHBondContact O-N 2.87Å; I2450-A2454 VanDerWaalsContact O-N 3.07Å; P2451-A2454 HydrophobicContact CG-CB 4.24Å; P2451-A2454 PolarHBondContact O-N 3.01Å; M2452-A2454 VanDerWaalsContact C-N 3.35Å; M2452-A2454 PolarHBondContact O-N 2.66Å; A2454-L2456 PolarHBondContact O-N 2.97Å; A2454-L2457 PolarHBondContact O-N 3.08Å; A2454-E2458 VanDerWaalsContact O-CB 3.32Å; A2454-E2458 WeakPolarHBondContact O-CB 3.4Å; A2454-E2458 PolarHBondContact O-N 3.14Å; A2454-E2458 VanDerWaalsContact O-N 3.08Å
2455	Q	62.6	Low	48.4	Very low	104 Å²	104	124.1 Å²	124.1	49%	0.486	64%	0.641	S	S	.	*	H	α-helix	trans	-64.8	-41	174.8	-173.8	176.9	-10.4	0	0	111.9	P2451 M2452 L2453 L2457 E2458 E2459	P2451-Q2455 VanDerWaalsContact O-CB 3.31Å; P2451-Q2455 WeakPolarHBondContact O-CB 3.35Å; P2451-Q2455 PolarHBondContact O-N 3.03Å; M2452-Q2455 PolarHBondContact O-N 3.13Å; L2453-Q2455 VanDerWaalsContact C-N 3.32Å; Q2455-L2457 VanDerWaalsContact C-N 3.33Å; Q2455-L2457 PolarHBondContact O-N 3.28Å; Q2455-E2458 CarbonylContact O-C 3.57Å; Q2455-E2458 PolarHBondContact O-N 3.18Å; Q2455-E2459 HydrophobicContact CG-CG 4.35Å; Q2455-E2459 WeakPolarHBondContact CG-OE1 3.27Å; Q2455-E2459 PolarHBondContact NE2-OE1 3.16Å; Q2455-E2459 VanDerWaalsContact NE2-OE1 3.08Å; Q2455-E2459 VanDerWaalsContact O-CB 3.31Å; Q2455-E2459 WeakPolarHBondContact O-CB 3.36Å; Q2455-E2459 VanDerWaalsContact O-CG 3.32Å; Q2455-E2459 WeakPolarHBondContact O-CG 3.34Å; Q2455-E2459 PolarHBondContact O-N 2.92Å
2456	L	59.8	Low	48.8	Very low	86 Å²	86	127.5 Å²	127.5	45%	0.45	64%	0.641	S	S	.	*	H	α-helix	trans	-64	-36.2	174.3	-83.2	164.1	0	0	0	112.6	M2452 L2453 A2454 E2459 V2460	M2452-L2456 HydrophobicContact CG-CD1 4.11Å; M2452-L2456 HydrophobicContact CG-CG 4.29Å; M2452-L2456 WeakPolarHBondContact O-CB 3.27Å; M2452-L2456 WeakPolarHBondContact O-CD1 3.33Å; M2452-L2456 VanDerWaalsContact O-CG 3.28Å; M2452-L2456 WeakPolarHBondContact O-CG 3.37Å; M2452-L2456 PolarHBondContact O-N 3.17Å; M2452-L2456 VanDerWaalsContact O-N 3.11Å; M2452-L2456 HydrophobicContact SD-CD1 4.35Å; L2453-L2456 CarbonylContact O-C 3.58Å; L2453-L2456 PolarHBondContact O-N 3.06Å; A2454-L2456 PolarHBondContact O-N 2.97Å; L2456-E2459 PolarHBondContact O-N 3.43Å; L2456-V2460 VanDerWaalsContact O-CB 3.26Å; L2456-V2460 WeakPolarHBondContact O-CB 3.19Å; L2456-V2460 VanDerWaalsContact O-CG2 3.26Å; L2456-V2460 WeakPolarHBondContact O-CG2 3.32Å; L2456-V2460 PolarHBondContact O-N 3.08Å
2457	L	60.9	Low	48.9	Very low	107.2 Å²	107.2	122.2 Å²	122.2	56%	0.561	63%	0.634	S	S	*	*	H	α-helix	trans	-68.2	-41.5	173.9	-84.4	136.3	0	0	0	111.7	L2453 A2454 Q2455 E2459 V2460 D2461	L2453-L2457 HydrophobicContact CD1-CD1 4.08Å; L2453-L2457 HydrophobicContact CD2-CD1 4.39Å; L2453-L2457 HydrophobicContact CG-CD1 4.06Å; L2453-L2457 WeakPolarHBondContact O-CB 3.21Å; L2453-L2457 WeakPolarHBondContact O-CD1 3.19Å; L2453-L2457 VanDerWaalsContact O-CG 3.31Å; L2453-L2457 WeakPolarHBondContact O-CG 3.31Å; L2453-L2457 PolarHBondContact O-N 3.08Å; L2453-L2457 VanDerWaalsContact O-N 3.12Å; A2454-L2457 PolarHBondContact O-N 3.08Å; Q2455-L2457 VanDerWaalsContact C-N 3.33Å; Q2455-L2457 PolarHBondContact O-N 3.28Å; L2457-E2459 VanDerWaalsContact C-N 3.34Å; L2457-V2460 PolarHBondContact O-N 3.25Å; L2457-D2461 PolarHBondContact O-N 3.18Å
2458	E	59.5	Low	49.1	Very low	144 Å²	144	127.1 Å²	127.1	67%	0.673	64%	0.638	S	S	*	*	H	α-helix	trans	-68.9	-34.4	177.1	-150.8	171.2	-167.5	0	0	112.3	A2454 Q2455 V2460 T2462	A2454-E2458 VanDerWaalsContact O-CB 3.32Å; A2454-E2458 WeakPolarHBondContact O-CB 3.4Å; A2454-E2458 PolarHBondContact O-N 3.14Å; A2454-E2458 VanDerWaalsContact O-N 3.08Å; Q2455-E2458 CarbonylContact O-C 3.57Å; Q2455-E2458 PolarHBondContact O-N 3.18Å; E2458-V2460 PolarHBondContact O-N 3.08Å; E2458-T2462 WeakPolarHBondContact O-CB 3.22Å; E2458-T2462 WeakPolarHBondContact O-CG2 3.35Å; E2458-T2462 PolarHBondContact O-N 3.02Å; E2458-T2462 PolarHBondContact O-OG1 3.04Å
2459	E	60.4	Low	49.2	Very low	82 Å²	82	123.1 Å²	123.1	38%	0.383	63%	0.633	S	S	.	*	H	α-helix	trans	-75.3	-31.2	174.5	-74.6	177.6	-173.3	0	0	112.8	Q2455 L2456 L2457 D2461 T2462 A2463 F2465	Q2455-E2459 HydrophobicContact CG-CG 4.35Å; Q2455-E2459 WeakPolarHBondContact CG-OE1 3.27Å; Q2455-E2459 PolarHBondContact NE2-OE1 3.16Å; Q2455-E2459 VanDerWaalsContact NE2-OE1 3.08Å; Q2455-E2459 VanDerWaalsContact O-CB 3.31Å; Q2455-E2459 WeakPolarHBondContact O-CB 3.36Å; Q2455-E2459 VanDerWaalsContact O-CG 3.32Å; Q2455-E2459 WeakPolarHBondContact O-CG 3.34Å; Q2455-E2459 PolarHBondContact O-N 2.92Å; L2456-E2459 PolarHBondContact O-N 3.43Å; L2457-E2459 VanDerWaalsContact C-N 3.34Å; E2459-D2461 VanDerWaalsContact C-N 3.31Å; E2459-D2461 PolarHBondContact O-N 3.11Å; E2459-T2462 WeakPolarHBondContact CA-OG1 3.5Å; E2459-T2462 CarbonylContact O-C 3.54Å; E2459-T2462 PolarHBondContact O-N 3.18Å; E2459-T2462 VanDerWaalsContact O-O 3.05Å; E2459-T2462 PolarHBondContact O-OG1 3.03Å; E2459-A2463 HydrophobicContact CB-CB 4.32Å; E2459-A2463 WeakPolarHBondContact O-CA 3.43Å; E2459-A2463 WeakPolarHBondContact O-CB 3.32Å; E2459-A2463 PolarHBondContact O-N 3.31Å; E2459-F2465 HydrophobicContact CB-CE2 3.64Å; E2459-F2465 HydrophobicContact CB-CZ 4.06Å; E2459-F2465 WeakPolarHBondContact OE2-CE2 3.44Å
2460	V	53.2	Low	49.3	Very low	101.2 Å²	101.2	122.4 Å²	122.4	61%	0.613	63%	0.63	S	S	*	*	H	α-helix	trans	-63.8	-38.8	175.4	160.7	0	0	0	0	111.8	L2456 L2457 E2458 T2462 A2463	L2456-V2460 VanDerWaalsContact O-CB 3.26Å; L2456-V2460 WeakPolarHBondContact O-CB 3.19Å; L2456-V2460 VanDerWaalsContact O-CG2 3.26Å; L2456-V2460 WeakPolarHBondContact O-CG2 3.32Å; L2456-V2460 PolarHBondContact O-N 3.08Å; L2457-V2460 PolarHBondContact O-N 3.25Å; E2458-V2460 PolarHBondContact O-N 3.08Å; V2460-T2462 VanDerWaalsContact C-N 3.34Å; V2460-T2462 PolarHBondContact O-N 2.78Å; V2460-A2463 PolarHBondContact O-N 2.91Å
2461	D	47	Very low	49	Very low	140 Å²	140	124.6 Å²	124.6	75%	0.749	64%	0.638	S	S	*	*	H	α-helix	trans	-76.7	-21.6	178.5	-77.5	-18.7	0	0	0	113.1	L2457 E2459 A2463 Y2466	L2457-D2461 PolarHBondContact O-N 3.18Å; E2459-D2461 VanDerWaalsContact C-N 3.31Å; E2459-D2461 PolarHBondContact O-N 3.11Å; D2461-A2463 PolarHBondContact O-N 2.85Å; D2461-Y2466 PolarHBondContact O-OH 3.41Å
2462	T	49.9	Very low	48.5	Very low	100.2 Å²	100.2	126.7 Å²	126.7	62%	0.615	64%	0.639	S	S	*	*	H	α-helix	trans	-101	-7.1	-179.4	61.6	0	0	0	0	114.5	E2458 E2459 V2460 R2464 Y2466	E2458-T2462 WeakPolarHBondContact O-CB 3.22Å; E2458-T2462 WeakPolarHBondContact O-CG2 3.35Å; E2458-T2462 PolarHBondContact O-N 3.02Å; E2458-T2462 PolarHBondContact O-OG1 3.04Å; E2459-T2462 WeakPolarHBondContact CA-OG1 3.5Å; E2459-T2462 CarbonylContact O-C 3.54Å; E2459-T2462 PolarHBondContact O-N 3.18Å; E2459-T2462 VanDerWaalsContact O-O 3.05Å; E2459-T2462 PolarHBondContact O-OG1 3.03Å; V2460-T2462 VanDerWaalsContact C-N 3.34Å; V2460-T2462 PolarHBondContact O-N 2.78Å; T2462-R2464 VanDerWaalsContact C-N 3.31Å; T2462-R2464 PolarHBondContact O-N 3.01Å; T2462-Y2466 WeakPolarHBondContact O-CE2 3.22Å
2463	A	40.1	Very low	48.1	Very low	62 Å²	62	123.1 Å²	123.1	51%	0.512	63%	0.626	S	S	.	*			trans	-78.5	75.9	-179.1	0	0	0	0	0	113	E2459 V2460 D2461 F2465 Y2466	E2459-A2463 HydrophobicContact CB-CB 4.32Å; E2459-A2463 WeakPolarHBondContact O-CA 3.43Å; E2459-A2463 WeakPolarHBondContact O-CB 3.32Å; E2459-A2463 PolarHBondContact O-N 3.31Å; V2460-A2463 PolarHBondContact O-N 2.91Å; D2461-A2463 PolarHBondContact O-N 2.85Å; A2463-F2465 HydrophobicContact CB-CD2 3.79Å; A2463-F2465 VanDerWaalsContact CB-CD2 3.45Å; A2463-F2465 HydrophobicContact CB-CE2 3.7Å; A2463-F2465 HydrophobicContact CB-CG 4.16Å; A2463-F2465 HydrophobicContact CB-CZ 4.24Å; A2463-F2465 PolarHBondContact O-N 3Å; A2463-Y2466 HydrophobicContact CB-CE2 4.43Å
2464	R	39.6	Very low	47.9	Very low	211.6 Å²	211.6	127.5 Å²	127.5	80%	0.798	64%	0.64	S	S	*	*			trans	-83.5	81.5	168.5	-88.4	-179.1	170.4	176.4	-2.1	110.8	T2462 Y2466	T2462-R2464 VanDerWaalsContact C-N 3.31Å; T2462-R2464 PolarHBondContact O-N 3.01Å; R2464-Y2466 VanDerWaalsContact C-N 3.34Å; R2464-Y2466 HydrophobicContact CB-CD2 4.16Å; R2464-Y2466 HydrophobicContact CB-CE2 4.37Å; R2464-Y2466 HydrophobicContact CG-CE2 4.32Å; R2464-Y2466 WeakPolarHBondContact O-CD2 3.37Å; R2464-Y2466 WeakPolarHBondContact O-CE2 3.42Å; R2464-Y2466 PolarHBondContact O-N 2.89Å
2465	F	36.9	Very low	47.5	Very low	174 Å²	174	130.5 Å²	130.5	76%	0.763	65%	0.646	S	S	*	*			trans	-69.1	83.1	168.1	-72.9	-78	0	0	0	110.5	E2459 A2463 A2467	E2459-F2465 HydrophobicContact CB-CE2 3.64Å; E2459-F2465 HydrophobicContact CB-CZ 4.06Å; E2459-F2465 WeakPolarHBondContact OE2-CE2 3.44Å; A2463-F2465 HydrophobicContact CB-CD2 3.79Å; A2463-F2465 VanDerWaalsContact CB-CD2 3.45Å; A2463-F2465 HydrophobicContact CB-CE2 3.7Å; A2463-F2465 HydrophobicContact CB-CG 4.16Å; A2463-F2465 HydrophobicContact CB-CZ 4.24Å; A2463-F2465 PolarHBondContact O-N 3Å; F2465-A2467 PolarHBondContact O-N 3.21Å
2466	Y	37.6	Very low	47.3	Very low	189.8 Å²	189.8	129 Å²	129	74%	0.744	64%	0.644	S	S	*	*			trans	-82.7	93.3	158.1	-76.7	-81.4	0	0	0	108.3	D2461 T2462 A2463 R2464 Y2468	D2461-Y2466 PolarHBondContact O-OH 3.41Å; T2462-Y2466 WeakPolarHBondContact O-CE2 3.22Å; A2463-Y2466 HydrophobicContact CB-CE2 4.43Å; R2464-Y2466 VanDerWaalsContact C-N 3.34Å; R2464-Y2466 HydrophobicContact CB-CD2 4.16Å; R2464-Y2466 HydrophobicContact CB-CE2 4.37Å; R2464-Y2466 HydrophobicContact CG-CE2 4.32Å; R2464-Y2466 WeakPolarHBondContact O-CD2 3.37Å; R2464-Y2466 WeakPolarHBondContact O-CE2 3.42Å; R2464-Y2466 PolarHBondContact O-N 2.89Å; Y2466-Y2468 PolarHBondContact O-N 3.35Å
2467	A	33.1	Very low	47.8	Very low	86.8 Å²	86.8	129.4 Å²	129.4	72%	0.717	65%	0.646	S	S	*	*			trans	-68.4	126.5	157.3	0	0	0	0	0	107.4	F2465 C2469	F2465-A2467 PolarHBondContact O-N 3.21Å; A2467-C2469 PolarHBondContact O-N 3.14Å
2468	Y	35.3	Very low	48.4	Very low	205.6 Å²	205.6	125.2 Å²	125.2	81%	0.806	63%	0.625	S	S	*	*			trans	-84.1	101.6	168.5	-125.7	-87.8	0	0	0	108.3	Y2466 E2470 V2478	Y2466-Y2468 PolarHBondContact O-N 3.35Å; Y2468-E2470 HydrophobicContact CD1-CG 4.38Å; Y2468-E2470 HydrophobicContact CE1-CG 4.39Å; Y2468-E2470 PolarHBondContact O-N 2.81Å; Y2468-V2478 HydrophobicContact CD2-CG1 4.29Å; Y2468-V2478 HydrophobicContact CG-CG1 4.46Å
2469	C	39.8	Very low	49.2	Very low	104.6 Å²	104.6	120.4 Å²	120.4	71%	0.707	61%	0.606	S	S	*	*			trans	-84	122.2	165	-101.3	0	0	0	0	107.5	A2467 E2471	A2467-C2469 PolarHBondContact O-N 3.14Å; C2469-E2471 HydrophobicContact CB-CB 4.07Å; C2469-E2471 PolarHBondContact O-N 2.89Å
2470	E	42.6	Very low	49.8	Very low	162.6 Å²	162.6	120.1 Å²	120.1	76%	0.76	61%	0.612	S	S	*	*			trans	-48.7	104.7	158.8	-67	-175.1	158.8	0	0	110.4	Y2468 E2472 P2473 R3115	Y2468-E2470 HydrophobicContact CD1-CG 4.38Å; Y2468-E2470 HydrophobicContact CE1-CG 4.39Å; Y2468-E2470 PolarHBondContact O-N 2.81Å; E2470-E2472 PolarHBondContact O-N 3.19Å; E2470-P2473 WeakPolarHBondContact OE1-CB 3.48Å; E2470-P2473 WeakPolarHBondContact OE2-CD 3.49Å; E2470-P2473 WeakPolarHBondContact OE2-CG 3.22Å; E2470-R3115 IonicContact OE2-NH1 3.25Å
2471	E	39.9	Very low	51	Low	164.4 Å²	164.4	119.8 Å²	119.8	77%	0.768	60%	0.604	S	S	*	*			trans	-85.9	89.2	171.9	-167	175.7	-170.9	0	0	108.7	C2469 P2473	C2469-E2471 HydrophobicContact CB-CB 4.07Å; C2469-E2471 PolarHBondContact O-N 2.89Å; E2471-P2473 VanDerWaalsContact O-CD 3.23Å; E2471-P2473 WeakPolarHBondContact O-CD 3.3Å; E2471-P2473 VanDerWaalsContact O-N 3.1Å
2472	E	46.3	Very low	52.6	Low	145.4 Å²	145.4	113.8 Å²	113.8	68%	0.679	57%	0.572	S	S	*	*			trans	-71.3	118.8	172.7	-84.6	-164.2	152.3	0	0	108.4	E2470 K2474 R3091	E2470-E2472 PolarHBondContact O-N 3.19Å; E2472-K2474 PolarHBondContact O-N 2.91Å; E2472-K2474 VanDerWaalsContact O-N 3.13Å; E2472-R3091 VanDerWaalsContact CD-NH1 3.29Å; E2472-R3091 IonicContact OE1-CZ 3.33Å; E2472-R3091 VanDerWaalsContact OE1-CZ 3.29Å; E2472-R3091 IonicContact OE1-NH1 3.19Å; E2472-R3091 PolarHBondContact OE1-NH1 3.15Å; E2472-R3091 IonicContact OE1-NH2 3.2Å; E2472-R3091 PolarHBondContact OE1-NH2 2.86Å; E2472-R3091 IonicContact OE2-CZ 3.07Å; E2472-R3091 IonicContact OE2-NH1 3.83Å; E2472-R3091 PolarHBondContact OE2-NH1 2.92Å; E2472-R3091 IonicContact OE2-NH2 2.71Å
2473	P	48.5	Very low	54	Low	62.2 Å²	62.2	111.7 Å²	111.7	40%	0.404	56%	0.555	S	S	.	*			trans	-69.8	126.1	-172.1	25.3	-30.8	0	0	0	109.7	E2470 E2471 Q2475 W3113 Y3138	E2470-P2473 WeakPolarHBondContact OE1-CB 3.48Å; E2470-P2473 WeakPolarHBondContact OE2-CD 3.49Å; E2470-P2473 WeakPolarHBondContact OE2-CG 3.22Å; E2471-P2473 VanDerWaalsContact O-CD 3.23Å; E2471-P2473 WeakPolarHBondContact O-CD 3.3Å; E2471-P2473 VanDerWaalsContact O-N 3.1Å; P2473-Q2475 WeakPolarHBondContact O-CA 3.5Å; P2473-Q2475 PolarHBondContact O-N 3.23Å; P2473-W3113 HydrophobicContact CG-CD2 4.29Å; P2473-W3113 HydrophobicContact CG-CE3 3.62Å; P2473-W3113 HydrophobicContact CG-CH2 4.37Å; P2473-W3113 HydrophobicContact CG-CZ3 3.56Å; P2473-W3113 VanDerWaalsContact CG-CZ3 3.44Å; P2473-Y3138 HydrophobicContact CB-CE1 4.26Å; P2473-Y3138 HydrophobicContact CG-CE1 4.37Å
2474	K	50.6	Low	55.9	Low	193.2 Å²	193.2	108.8 Å²	108.8	84%	0.84	53%	0.531	S	S	*	.			trans	-48.5	93.3	179.4	-71.1	178.9	-179.7	174.1	0	111	E2472 T2476	E2472-K2474 PolarHBondContact O-N 2.91Å; E2472-K2474 VanDerWaalsContact O-N 3.13Å; K2474-T2476 PolarHBondContact O-N 3.07Å; K2474-T2476 VanDerWaalsContact O-N 3.15Å
2475	Q	54.1	Low	57.9	Low	114.2 Å²	114.2	99.7 Å²	99.7	53%	0.534	50%	0.498	S	S	.	.			trans	-67.3	117.5	-170.4	-172.5	149.2	11	0	0	110	P2473 D2477 E3070	P2473-Q2475 WeakPolarHBondContact O-CA 3.5Å; P2473-Q2475 PolarHBondContact O-N 3.23Å; Q2475-D2477 PolarHBondContact O-N 3Å; Q2475-D2477 VanDerWaalsContact O-N 3.09Å; Q2475-E3070 PolarHBondContact NE2-O 3.21Å
2476	T	59.3	Low	60	Low	72.6 Å²	72.6	96.9 Å²	96.9	45%	0.445	49%	0.487	S	S	.	.			trans	-67.4	111.6	179.6	6.3	0	0	0	0	110	K2474 V2478	K2474-T2476 PolarHBondContact O-N 3.07Å; K2474-T2476 VanDerWaalsContact O-N 3.15Å; T2476-V2478 VanDerWaalsContact C-N 3.31Å; T2476-V2478 HydrophobicContact CG2-CG1 4.2Å; T2476-V2478 WeakPolarHBondContact O-CG2 3.38Å; T2476-V2478 PolarHBondContact O-N 3.16Å
2477	D	68.7	Low	62	Low	94 Å²	94	88.2 Å²	88.2	50%	0.503	45%	0.454	S	S	.	.			trans	-80.7	88.3	179.9	-174.8	3	0	0	0	110.3	Q2475 V2479 S2480 Q2481	Q2475-D2477 PolarHBondContact O-N 3Å; Q2475-D2477 VanDerWaalsContact O-N 3.09Å; D2477-V2479 PolarHBondContact O-N 3.46Å; D2477-V2479 WeakPolarHBondContact OD1-CB 3.36Å; D2477-V2479 PolarHBondContact OD1-N 3.05Å; D2477-S2480 WeakPolarHBondContact O-CB 3.45Å; D2477-S2480 PolarHBondContact O-N 3.2Å; D2477-S2480 PolarHBondContact O-OG 3.14Å; D2477-S2480 WeakPolarHBondContact OD1-CB 3.41Å; D2477-S2480 PolarHBondContact OD1-N 2.89Å; D2477-S2480 PolarHBondContact OD1-OG 2.88Å; D2477-S2480 VanDerWaalsContact OD2-CB 3.24Å; D2477-S2480 WeakPolarHBondContact OD2-CB 3.39Å; D2477-S2480 PolarHBondContact OD2-OG 2.9Å; D2477-Q2481 PolarHBondContact O-NE2 2.97Å
2478	V	73.8	Confident	64.2	Low	19.2 Å²	19.2	84.4 Å²	84.4	12%	0.116	42%	0.422	C	S	.	.			trans	-80.7	-25.1	176.5	-111.3	0	0	0	0	111.6	Y2468 T2476 S2480 Q2481 L2482 C3068 E3070 I3094	Y2468-V2478 HydrophobicContact CD2-CG1 4.29Å; Y2468-V2478 HydrophobicContact CG-CG1 4.46Å; T2476-V2478 VanDerWaalsContact C-N 3.31Å; T2476-V2478 HydrophobicContact CG2-CG1 4.2Å; T2476-V2478 WeakPolarHBondContact O-CG2 3.38Å; T2476-V2478 PolarHBondContact O-N 3.16Å; V2478-S2480 VanDerWaalsContact C-N 3.33Å; V2478-S2480 PolarHBondContact O-N 3.3Å; V2478-Q2481 WeakPolarHBondContact O-CB 3.31Å; V2478-Q2481 PolarHBondContact O-N 3.03Å; V2478-Q2481 VanDerWaalsContact O-N 3.12Å; V2478-L2482 WeakPolarHBondContact O-CG 3.47Å; V2478-C3068 WeakPolarHBondContact CG2-SG 3.42Å; V2478-E3070 HydrophobicContact CG2-CG 4.22Å; V2478-I3094 HydrophobicContact CB-CB 4.39Å; V2478-I3094 HydrophobicContact CB-CD1 3.7Å; V2478-I3094 HydrophobicContact CB-CG1 3.69Å; V2478-I3094 HydrophobicContact CG1-CB 4.25Å; V2478-I3094 HydrophobicContact CG1-CD1 3.71Å; V2478-I3094 HydrophobicContact CG1-CG1 3.71Å; V2478-I3094 HydrophobicContact CG1-CG2 4.08Å
2479	V	75.8	Confident	66.4	Low	43.4 Å²	43.4	76.9 Å²	76.9	26%	0.263	40%	0.402	S	S	.	.	G	3₁₀ helix	trans	-69.3	-39.1	-176.4	-179.3	0	0	0	0	110.9	D2477 Q2481 L2482 L2485 L2760 E3070	D2477-V2479 PolarHBondContact O-N 3.46Å; D2477-V2479 WeakPolarHBondContact OD1-CB 3.36Å; D2477-V2479 PolarHBondContact OD1-N 3.05Å; V2479-Q2481 PolarHBondContact O-N 2.95Å; V2479-Q2481 VanDerWaalsContact O-N 3.14Å; V2479-L2482 WeakPolarHBondContact O-CB 3.36Å; V2479-L2482 PolarHBondContact O-N 3.04Å; V2479-L2482 VanDerWaalsContact O-N 3.1Å; V2479-L2485 HydrophobicContact CG1-CD1 3.69Å; V2479-L2485 HydrophobicContact CG1-CD2 3.42Å; V2479-L2485 VanDerWaalsContact CG1-CD2 3.4Å; V2479-L2485 HydrophobicContact CG1-CG 4.41Å; V2479-L2760 HydrophobicContact CG1-CD2 4.4Å; V2479-L2760 HydrophobicContact CG2-CD1 4.25Å; V2479-L2760 HydrophobicContact CG2-CD2 4.31Å; V2479-E3070 HydrophobicContact CG2-CG 4.06Å; V2479-E3070 WeakPolarHBondContact CG2-OE1 3.45Å
2480	S	74.5	Confident	68.2	Low	74.2 Å²	74.2	74.8 Å²	74.8	52%	0.519	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-65	-19	174.8	67.2	0	0	0	0	114.3	D2477 V2478 L2482	D2477-S2480 WeakPolarHBondContact O-CB 3.45Å; D2477-S2480 PolarHBondContact O-N 3.2Å; D2477-S2480 PolarHBondContact O-OG 3.14Å; D2477-S2480 WeakPolarHBondContact OD1-CB 3.41Å; D2477-S2480 PolarHBondContact OD1-N 2.89Å; D2477-S2480 PolarHBondContact OD1-OG 2.88Å; D2477-S2480 VanDerWaalsContact OD2-CB 3.24Å; D2477-S2480 WeakPolarHBondContact OD2-CB 3.39Å; D2477-S2480 PolarHBondContact OD2-OG 2.9Å; V2478-S2480 VanDerWaalsContact C-N 3.33Å; V2478-S2480 PolarHBondContact O-N 3.3Å; S2480-L2482 VanDerWaalsContact C-N 3.34Å
2481	Q	76.8	Confident	70	Confident	96 Å²	96	67.8 Å²	67.8	45%	0.449	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-84.6	-12	177.5	-59.4	-176.6	47.1	0	0	113.2	D2477 V2478 V2479 Q2483 I3094	D2477-Q2481 PolarHBondContact O-NE2 2.97Å; V2478-Q2481 WeakPolarHBondContact O-CB 3.31Å; V2478-Q2481 PolarHBondContact O-N 3.03Å; V2478-Q2481 VanDerWaalsContact O-N 3.12Å; V2479-Q2481 PolarHBondContact O-N 2.95Å; V2479-Q2481 VanDerWaalsContact O-N 3.14Å; Q2481-Q2483 PolarHBondContact O-N 3.06Å; Q2481-I3094 HydrophobicContact CB-CD1 3.89Å; Q2481-I3094 HydrophobicContact CG-CD1 4.34Å
2482	L	81.4	Confident	72.1	Confident	14.4 Å²	14.4	64 Å²	64	8%	0.075	34%	0.342	C	S	.	.			trans	-76	101.6	-178.8	-60.7	176.5	0	0	0	110.7	V2478 V2479 S2480 G2484 L2485 H2486 T2758 L2760 E3066 C3068 I3094	V2478-L2482 WeakPolarHBondContact O-CG 3.47Å; V2479-L2482 WeakPolarHBondContact O-CB 3.36Å; V2479-L2482 PolarHBondContact O-N 3.04Å; V2479-L2482 VanDerWaalsContact O-N 3.1Å; S2480-L2482 VanDerWaalsContact C-N 3.34Å; L2482-G2484 VanDerWaalsContact C-N 3.3Å; L2482-G2484 PolarHBondContact O-N 3.36Å; L2482-G2484 VanDerWaalsContact O-N 3.09Å; L2482-L2485 HydrophobicContact CB-CB 3.96Å; L2482-L2485 HydrophobicContact CD1-CD1 4.5Å; L2482-L2485 HydrophobicContact CD1-CD2 4.44Å; L2482-L2485 WeakPolarHBondContact O-CB 3.41Å; L2482-L2485 PolarHBondContact O-N 2.94Å; L2482-L2485 VanDerWaalsContact O-N 3.07Å; L2482-H2486 WeakPolarHBondContact O-CB 3.26Å; L2482-H2486 PolarHBondContact O-N 3.1Å; L2482-T2758 HydrophobicContact CB-CG2 4.19Å; L2482-T2758 HydrophobicContact CD1-CG2 4.03Å; L2482-T2758 HydrophobicContact CD2-CG2 4.28Å; L2482-T2758 HydrophobicContact CG-CG2 4.31Å; L2482-L2760 HydrophobicContact CD1-CB 4.45Å; L2482-L2760 HydrophobicContact CD1-CD1 4.26Å; L2482-L2760 HydrophobicContact CD1-CD2 4.28Å; L2482-E3066 HydrophobicContact CD2-CB 4.33Å; L2482-C3068 HydrophobicContact CD1-CB 3.86Å; L2482-C3068 HydrophobicContact CD2-CB 3.81Å; L2482-C3068 HydrophobicContact CG-CB 4.42Å; L2482-I3094 HydrophobicContact CD2-CD1 3.67Å; L2482-I3094 HydrophobicContact CD2-CG1 4.15Å; L2482-I3094 HydrophobicContact CD2-CG2 4.48Å
2483	Q	79.9	Confident	73.8	Confident	55.2 Å²	55.2	58 Å²	58	26%	0.258	32%	0.316	S	S	.	.	H	α-helix	trans	-63.3	-34.2	-175.4	-173.3	164.1	11.1	0	0	112.5	Q2481 L2485 H2486 I2487 P2751 R3064 E3066	Q2481-Q2483 PolarHBondContact O-N 3.06Å; Q2483-L2485 VanDerWaalsContact C-N 3.35Å; Q2483-L2485 PolarHBondContact O-N 3.47Å; Q2483-H2486 PolarHBondContact O-N 3.33Å; Q2483-I2487 HydrophobicContact CG-CD1 3.68Å; Q2483-I2487 HydrophobicContact CG-CG1 4.26Å; Q2483-I2487 WeakPolarHBondContact O-CB 3.3Å; Q2483-I2487 WeakPolarHBondContact O-CD1 3.41Å; Q2483-I2487 VanDerWaalsContact O-CG1 3.24Å; Q2483-I2487 WeakPolarHBondContact O-CG1 3.45Å; Q2483-I2487 PolarHBondContact O-N 3.22Å; Q2483-P2751 PolarHBondContact NE2-O 3.07Å; Q2483-R3064 VanDerWaalsContact OE1-NH1 3.1Å; Q2483-E3066 VanDerWaalsContact CB-OE1 3.29Å; Q2483-E3066 WeakPolarHBondContact CB-OE1 3.38Å; Q2483-E3066 PolarHBondContact N-OE1 3.17Å; Q2483-E3066 PolarHBondContact N-OE2 2.94Å
2484	G	78.7	Confident	75.4	Confident	0.6 Å²	0.6	57.1 Å²	57.1	1%	0.006	31%	0.314	C	S	.	.	H	α-helix	trans	-64.6	-45.1	175.5	0	0	0	0	0	112.7	L2482 H2486 I2487 C2488 I2721 T2758 E3066	L2482-G2484 VanDerWaalsContact C-N 3.3Å; L2482-G2484 PolarHBondContact O-N 3.36Å; L2482-G2484 VanDerWaalsContact O-N 3.09Å; G2484-H2486 VanDerWaalsContact C-N 3.33Å; G2484-H2486 PolarHBondContact O-N 3.17Å; G2484-I2487 PolarHBondContact O-N 3.09Å; G2484-C2488 PolarHBondContact O-N 2.95Å; G2484-C2488 VanDerWaalsContact O-N 3.14Å; G2484-C2488 PolarHBondContact O-SG 3.31Å; G2484-I2721 VanDerWaalsContact O-CD1 3.31Å; G2484-I2721 WeakPolarHBondContact O-CD1 3.38Å; G2484-T2758 WeakPolarHBondContact CA-OG1 3.46Å; G2484-E3066 PolarHBondContact N-OE2 2.92Å
2485	L	81.9	Confident	77	Confident	21.2 Å²	21.2	52.8 Å²	52.8	11%	0.111	30%	0.296	C	S	.	.	H	α-helix	trans	-62.3	-46.9	175.6	178.9	76.7	0	0	0	111.3	I2100 V2479 L2482 Q2483 I2487 C2488 A2489 F2719	I2100-L2485 HydrophobicContact CB-CD1 4.49Å; I2100-L2485 HydrophobicContact CD1-CD1 3.61Å; I2100-L2485 HydrophobicContact CD1-CD2 3.54Å; I2100-L2485 HydrophobicContact CD1-CG 4.18Å; I2100-L2485 HydrophobicContact CG1-CD1 3.87Å; I2100-L2485 HydrophobicContact CG1-CD2 4.23Å; I2100-L2485 HydrophobicContact CG1-CG 4.32Å; I2100-L2485 HydrophobicContact CG2-CD1 4.1Å; V2479-L2485 HydrophobicContact CG1-CD1 3.69Å; V2479-L2485 HydrophobicContact CG1-CD2 3.42Å; V2479-L2485 VanDerWaalsContact CG1-CD2 3.4Å; V2479-L2485 HydrophobicContact CG1-CG 4.41Å; L2482-L2485 HydrophobicContact CB-CB 3.96Å; L2482-L2485 HydrophobicContact CD1-CD1 4.5Å; L2482-L2485 HydrophobicContact CD1-CD2 4.44Å; L2482-L2485 WeakPolarHBondContact O-CB 3.41Å; L2482-L2485 PolarHBondContact O-N 2.94Å; L2482-L2485 VanDerWaalsContact O-N 3.07Å; Q2483-L2485 VanDerWaalsContact C-N 3.35Å; Q2483-L2485 PolarHBondContact O-N 3.47Å; L2485-I2487 VanDerWaalsContact C-N 3.35Å; L2485-I2487 PolarHBondContact O-N 3.12Å; L2485-C2488 WeakPolarHBondContact O-CB 3.41Å; L2485-C2488 PolarHBondContact O-N 3.08Å; L2485-C2488 VanDerWaalsContact O-N 3.15Å; L2485-A2489 WeakPolarHBondContact O-CB 3.36Å; L2485-A2489 PolarHBondContact O-N 3.06Å; L2485-F2719 HydrophobicContact CB-CD2 4.43Å; L2485-F2719 HydrophobicContact CD1-CD1 4.42Å; L2485-F2719 HydrophobicContact CD1-CD2 4.3Å; L2485-F2719 HydrophobicContact CD1-CE1 3.87Å; L2485-F2719 HydrophobicContact CD1-CE2 3.72Å; L2485-F2719 HydrophobicContact CD1-CZ 3.62Å; L2485-F2719 VanDerWaalsContact CD1-CZ 3.46Å; L2485-F2719 HydrophobicContact CG-CE2 4.35Å; L2485-F2719 HydrophobicContact CG-CZ 4.46Å
2486	H	80.9	Confident	78.7	Confident	114.4 Å²	114.4	48.4 Å²	48.4	53%	0.53	28%	0.275	S	S	.	.	H	α-helix	trans	-59.8	-43.2	177.5	-179.5	-78.7	0	0	0	112.5	L2482 Q2483 G2484 C2488 A2489 S2490	L2482-H2486 WeakPolarHBondContact O-CB 3.26Å; L2482-H2486 PolarHBondContact O-N 3.1Å; Q2483-H2486 PolarHBondContact O-N 3.33Å; G2484-H2486 VanDerWaalsContact C-N 3.33Å; G2484-H2486 PolarHBondContact O-N 3.17Å; H2486-C2488 VanDerWaalsContact C-N 3.3Å; H2486-C2488 PolarHBondContact O-N 3.06Å; H2486-A2489 WeakPolarHBondContact O-CB 3.45Å; H2486-A2489 PolarHBondContact O-N 2.93Å; H2486-S2490 PolarHBondContact ND1-OG 2.67Å; H2486-S2490 VanDerWaalsContact O-CB 3.3Å; H2486-S2490 WeakPolarHBondContact O-CB 3.32Å; H2486-S2490 PolarHBondContact O-N 2.95Å; H2486-S2490 PolarHBondContact O-OG 3.01Å
2487	I	79.7	Confident	80.1	Confident	8.4 Å²	8.4	46.9 Å²	46.9	4%	0.043	26%	0.264	C	S	.	.	H	α-helix	trans	-67.9	-32.6	178.8	-69.1	169.1	0	0	0	111.7	Q2483 G2484 L2485 S2490 S2491 K2544 I2721 Y2723 E2752	Q2483-I2487 HydrophobicContact CG-CD1 3.68Å; Q2483-I2487 HydrophobicContact CG-CG1 4.26Å; Q2483-I2487 WeakPolarHBondContact O-CB 3.3Å; Q2483-I2487 WeakPolarHBondContact O-CD1 3.41Å; Q2483-I2487 VanDerWaalsContact O-CG1 3.24Å; Q2483-I2487 WeakPolarHBondContact O-CG1 3.45Å; Q2483-I2487 PolarHBondContact O-N 3.22Å; G2484-I2487 PolarHBondContact O-N 3.09Å; L2485-I2487 VanDerWaalsContact C-N 3.35Å; L2485-I2487 PolarHBondContact O-N 3.12Å; I2487-S2490 PolarHBondContact O-OG 3Å; I2487-S2491 VanDerWaalsContact O-CB 3.3Å; I2487-S2491 WeakPolarHBondContact O-CB 3.31Å; I2487-S2491 PolarHBondContact O-N 2.97Å; I2487-S2491 VanDerWaalsContact O-N 3.13Å; I2487-K2544 VanDerWaalsContact CG2-NZ 3.35Å; I2487-K2544 PolarHBondContact O-NZ 2.94Å; I2487-I2721 HydrophobicContact CB-CD1 3.67Å; I2487-I2721 HydrophobicContact CD1-CD1 4.48Å; I2487-I2721 HydrophobicContact CG2-CD1 3.53Å; I2487-I2721 VanDerWaalsContact CG2-CD1 3.48Å; I2487-I2721 HydrophobicContact CG2-CG1 4.35Å; I2487-I2721 HydrophobicContact CG2-CG2 4.36Å; I2487-Y2723 WeakPolarHBondContact CG2-OH 3.39Å; I2487-E2752 HydrophobicContact CD1-CB 4.41Å; I2487-E2752 HydrophobicContact CD1-CG 4.27Å; I2487-E2752 HydrophobicContact CG1-CG 4.29Å; I2487-E2752 HydrophobicContact CG2-CG 4.13Å
2488	C	80.6	Confident	81.2	Confident	7.2 Å²	7.2	47.9 Å²	47.9	5%	0.049	26%	0.261	C	S	.	.	H	α-helix	trans	-67.8	-51	171.1	-77.9	0	0	0	0	111.5	V2098 G2484 L2485 H2486 S2490 S2491 F2719 I2721	V2098-C2488 WeakPolarHBondContact CB-O 3.44Å; V2098-C2488 HydrophobicContact CG1-CB 4.35Å; V2098-C2488 HydrophobicContact CG2-CB 4.4Å; V2098-C2488 VanDerWaalsContact CG2-O 3.24Å; V2098-C2488 WeakPolarHBondContact CG2-O 3.45Å; G2484-C2488 PolarHBondContact O-N 2.95Å; G2484-C2488 VanDerWaalsContact O-N 3.14Å; G2484-C2488 PolarHBondContact O-SG 3.31Å; L2485-C2488 WeakPolarHBondContact O-CB 3.41Å; L2485-C2488 PolarHBondContact O-N 3.08Å; L2485-C2488 VanDerWaalsContact O-N 3.15Å; H2486-C2488 VanDerWaalsContact C-N 3.3Å; H2486-C2488 PolarHBondContact O-N 3.06Å; C2488-S2490 PolarHBondContact O-N 2.99Å; C2488-S2491 WeakPolarHBondContact O-CB 3.38Å; C2488-S2491 PolarHBondContact O-N 3.11Å; C2488-S2491 VanDerWaalsContact O-N 3.12Å; C2488-F2719 HydrophobicContact CB-CD1 4.18Å; C2488-I2721 VanDerWaalsContact SG-CG1 3.58Å
2489	A	80.2	Confident	82.2	Confident	47.6 Å²	47.6	48 Å²	48	39%	0.393	26%	0.26	S	S	.	.	H	α-helix	trans	-62.9	-42.1	-176.7	0	0	0	0	0	113.6	R2097 I2100 Q2217 L2485 H2486 S2491	R2097-A2489 PolarHBondContact NH1-O 2.83Å; I2100-A2489 HydrophobicContact CD1-CB 3.34Å; I2100-A2489 VanDerWaalsContact CD1-CB 3.47Å; I2100-A2489 HydrophobicContact CG1-CB 4.17Å; Q2217-A2489 PolarHBondContact NE2-O 2.95Å; L2485-A2489 WeakPolarHBondContact O-CB 3.36Å; L2485-A2489 PolarHBondContact O-N 3.06Å; H2486-A2489 WeakPolarHBondContact O-CB 3.45Å; H2486-A2489 PolarHBondContact O-N 2.93Å; A2489-S2491 VanDerWaalsContact C-N 3.3Å; A2489-S2491 PolarHBondContact O-N 3.09Å
2490	S	78.5	Confident	83.1	Confident	60.8 Å²	60.8	47.9 Å²	47.9	43%	0.425	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-15.4	-178.7	60.3	0	0	0	0	113.5	R2097 H2486 I2487 C2488	R2097-S2490 VanDerWaalsContact NH1-C 3.26Å; R2097-S2490 PolarHBondContact NH1-O 3.06Å; H2486-S2490 PolarHBondContact ND1-OG 2.67Å; H2486-S2490 VanDerWaalsContact O-CB 3.3Å; H2486-S2490 WeakPolarHBondContact O-CB 3.32Å; H2486-S2490 PolarHBondContact O-N 2.95Å; H2486-S2490 PolarHBondContact O-OG 3.01Å; I2487-S2490 PolarHBondContact O-OG 3Å; C2488-S2490 PolarHBondContact O-N 2.99Å
2491	S	80.5	Confident	84.1	Confident	14.2 Å²	14.2	45.4 Å²	45.4	10%	0.099	24%	0.238	C	C	.	.	S	Bend	trans	-82.6	138	-177.3	-158.9	0	0	0	0	112.8	R2097 I2487 C2488 A2489 V2493 H2532 K2544	R2097-S2491 PolarHBondContact NH1-O 2.67Å; I2487-S2491 VanDerWaalsContact O-CB 3.3Å; I2487-S2491 WeakPolarHBondContact O-CB 3.31Å; I2487-S2491 PolarHBondContact O-N 2.97Å; I2487-S2491 VanDerWaalsContact O-N 3.13Å; C2488-S2491 WeakPolarHBondContact O-CB 3.38Å; C2488-S2491 PolarHBondContact O-N 3.11Å; C2488-S2491 VanDerWaalsContact O-N 3.12Å; A2489-S2491 VanDerWaalsContact C-N 3.3Å; A2489-S2491 PolarHBondContact O-N 3.09Å; S2491-V2493 PolarHBondContact O-N 3.03Å; S2491-H2532 WeakPolarHBondContact CB-ND1 3.47Å; S2491-H2532 VanDerWaalsContact OG-CG 3.23Å; S2491-H2532 PolarHBondContact OG-ND1 3.13Å; S2491-K2544 WeakPolarHBondContact OG-CE 3.4Å; S2491-K2544 PolarHBondContact OG-NZ 3.23Å
2492	L	82.7	Confident	84.9	Confident	85.2 Å²	85.2	42.2 Å²	42.2	45%	0.446	22%	0.224	S	C	.	.	B	Isolated β-bridge	trans	-72	139.5	165.6	-64.9	176.7	0	0	0	109.8	T2095 V2096 R2097 H2532 P2533	T2095-L2492 HydrophobicContact CG2-CD2 4.32Å; V2096-L2492 WeakPolarHBondContact O-CA 3.27Å; R2097-L2492 HydrophobicContact CG-CD2 4.22Å; L2492-H2532 PolarHBondContact O-ND1 3.02Å; L2492-P2533 HydrophobicContact CB-CG 4.33Å; L2492-P2533 VanDerWaalsContact O-CD 3.23Å; L2492-P2533 WeakPolarHBondContact O-CD 3.35Å
2493	V	83.6	Confident	85.5	Confident	20.4 Å²	20.4	42.6 Å²	42.6	12%	0.124	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-97.2	128.9	174	179.9	0	0	0	0	108.3	V2096 V2098 H2220 L2223 S2491 L2530	V2096-V2493 HydrophobicContact CB-CB 4.41Å; V2096-V2493 HydrophobicContact CG1-CB 4.16Å; V2096-V2493 PolarHBondContact O-N 3.02Å; V2098-V2493 HydrophobicContact CG2-CG2 3.74Å; H2220-V2493 HydrophobicContact CB-CG1 4.19Å; H2220-V2493 HydrophobicContact CB-CG2 4.22Å; L2223-V2493 HydrophobicContact CD1-CB 3.85Å; L2223-V2493 HydrophobicContact CD1-CG1 3.8Å; L2223-V2493 VanDerWaalsContact CD1-CG1 3.49Å; S2491-V2493 PolarHBondContact O-N 3.03Å; V2493-L2530 HydrophobicContact CG1-CB 4.29Å; V2493-L2530 HydrophobicContact CG1-CD1 4.48Å; V2493-L2530 HydrophobicContact CG1-CD2 4.27Å; V2493-L2530 HydrophobicContact CG2-CD1 4.06Å
2494	A	82	Confident	86.1	Confident	43.4 Å²	43.4	40.9 Å²	40.9	36%	0.359	22%	0.218	S	C	.	.			trans	-93.8	-42.5	177.4	0	0	0	0	0	111.7	T2531	A2494-T2531 WeakPolarHBondContact CB-O 3.26Å; A2494-T2531 PolarHBondContact N-O 3.41Å
2495	E	83.7	Confident	86.9	Confident	101.6 Å²	101.6	41.5 Å²	41.5	48%	0.475	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	141.5	-177.4	-100.4	177	179.7	0	0	110.9	V2226 N2497 T2531	V2226-E2495 HydrophobicContact CG2-CG 4.17Å; V2226-E2495 WeakPolarHBondContact CG2-OE1 3.3Å; E2495-N2497 WeakPolarHBondContact CB-OD1 3.48Å; E2495-T2531 PolarHBondContact N-O 3.17Å; E2495-T2531 PolarHBondContact O-N 3.13Å
2496	R	89.5	Confident	87.5	Confident	22.2 Å²	22.2	40.5 Å²	40.5	8%	0.084	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	97.4	170.8	-173.5	-173.4	-169.3	168.4	12.2	108	H2220 E2221 L2223 P2225 V2226 H2499 D2528 L2530	H2220-R2496 WeakPolarHBondContact O-CD 3.44Å; H2220-R2496 PolarHBondContact O-NH1 3.17Å; E2221-R2496 VanDerWaalsContact CD-NH2 3.32Å; E2221-R2496 PolarHBondContact O-NH1 3.13Å; E2221-R2496 IonicContact OE1-NH2 3.83Å; E2221-R2496 IonicContact OE2-CZ 3.72Å; E2221-R2496 VanDerWaalsContact OE2-CZ 3.31Å; E2221-R2496 IonicContact OE2-NH1 3.49Å; E2221-R2496 PolarHBondContact OE2-NH1 2.72Å; E2221-R2496 VanDerWaalsContact OE2-NH1 3.15Å; E2221-R2496 IonicContact OE2-NH2 2.82Å; E2221-R2496 PolarHBondContact OE2-NH2 3.35Å; L2223-R2496 HydrophobicContact CB-CB 3.96Å; L2223-R2496 HydrophobicContact CD1-CB 4.29Å; L2223-R2496 VanDerWaalsContact O-CD 3.24Å; L2223-R2496 WeakPolarHBondContact O-CD 3.36Å; L2223-R2496 PolarHBondContact O-NH1 2.9Å; L2223-R2496 VanDerWaalsContact O-NH1 3.16Å; P2225-R2496 CarbonylContact C-O 3.51Å; P2225-R2496 VanDerWaalsContact CA-O 3.31Å; P2225-R2496 WeakPolarHBondContact CA-O 3.33Å; P2225-R2496 HydrophobicContact CB-CG 4.07Å; V2226-R2496 PolarHBondContact N-O 3.27Å; R2496-H2499 PolarHBondContact NH2-CE1 3.14Å; R2496-H2499 PolarHBondContact NH2-ND1 2.94Å; R2496-D2528 IonicContact CZ-OD1 3.67Å; R2496-D2528 VanDerWaalsContact CZ-OD1 3.25Å; R2496-D2528 IonicContact CZ-OD2 3.48Å; R2496-D2528 IonicContact NE-OD1 3.54Å; R2496-D2528 PolarHBondContact NE-OD1 2.94Å; R2496-D2528 IonicContact NE-OD2 3.14Å; R2496-D2528 VanDerWaalsContact NH2-CG 3.35Å; R2496-D2528 IonicContact NH2-OD1 3.58Å; R2496-D2528 PolarHBondContact NH2-OD1 3.1Å; R2496-D2528 IonicContact NH2-OD2 3.28Å; R2496-D2528 PolarHBondContact NH2-OD2 3.02Å; R2496-L2530 HydrophobicContact CB-CD2 4.08Å; R2496-L2530 HydrophobicContact CG-CD2 3.84Å
2497	N	89.1	Confident	88.1	Confident	41.6 Å²	41.6	37.6 Å²	37.6	22%	0.222	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	-51.4	-168.6	-62.1	-29.1	0	0	0	111.8	V2226 H2227 E2495 A2529 T2531	V2226-N2497 WeakPolarHBondContact CB-O 3.01Å; V2226-N2497 PolarHBondContact N-O 2.79Å; H2227-N2497 WeakPolarHBondContact CB-O 3.33Å; H2227-N2497 PolarHBondContact CD2-O 3.08Å; H2227-N2497 PolarHBondContact N-O 3.04Å; H2227-N2497 VanDerWaalsContact N-O 3.15Å; E2495-N2497 WeakPolarHBondContact CB-OD1 3.48Å; N2497-A2529 WeakPolarHBondContact CB-O 3.39Å; N2497-A2529 PolarHBondContact N-O 3.06Å; N2497-A2529 PolarHBondContact ND2-O 3.45Å; N2497-T2531 VanDerWaalsContact CG-OG1 3.28Å; N2497-T2531 PolarHBondContact ND2-N 2.77Å; N2497-T2531 PolarHBondContact ND2-OG1 3.12Å; N2497-T2531 PolarHBondContact OD1-OG1 3.31Å; N2497-T2531 VanDerWaalsContact OD1-OG1 3.04Å
2498	W	91.6	Very high	88.7	Confident	115.6 Å²	115.6	37.2 Å²	37.2	44%	0.438	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	133.9	-178.2	-64.4	77.1	0	0	0	109.6	Y2082 H2227 L2229 D2528 A2529	Y2082-W2498 HydrophobicContact CD2-CZ3 4.26Å; Y2082-W2498 AromaticContact CE2-CH2 3.98Å; Y2082-W2498 HydrophobicContact CE2-CH2 4.04Å; Y2082-W2498 AromaticContact CE2-CZ3 3.86Å; Y2082-W2498 HydrophobicContact CE2-CZ3 3.94Å; H2227-W2498 HydrophobicContact CB-CD2 3.58Å; H2227-W2498 VanDerWaalsContact CB-CD2 3.45Å; H2227-W2498 HydrophobicContact CB-CE3 3.47Å; H2227-W2498 VanDerWaalsContact CB-CE3 3.45Å; H2227-W2498 HydrophobicContact CB-CG 4.15Å; H2227-W2498 HydrophobicContact CB-CH2 4.15Å; H2227-W2498 HydrophobicContact CB-CZ2 4.12Å; H2227-W2498 HydrophobicContact CB-CZ3 3.77Å; H2227-W2498 AromaticContact CD2-CD2 3.96Å; H2227-W2498 AromaticContact CD2-CE2 3.73Å; H2227-W2498 AromaticContact CD2-CH2 3.7Å; H2227-W2498 AromaticContact CD2-CZ2 3.81Å; H2227-W2498 AromaticContact CD2-NE1 3.8Å; H2227-W2498 AromaticContact CG-CD2 3.93Å; H2227-W2498 AromaticContact CG-CE2 3.73Å; H2227-W2498 AromaticContact CG-CE3 3.99Å; H2227-W2498 AromaticContact CG-CH2 3.98Å; H2227-W2498 AromaticContact CG-CZ2 3.78Å; H2227-W2498 AromaticContact CG-CZ3 3.86Å; H2227-W2498 AromaticContact ND1-CH2 3.91Å; H2227-W2498 AromaticContact ND1-CZ2 3.83Å; H2227-W2498 CarbonylContact O-C 3.49Å; H2227-W2498 VanDerWaalsContact O-CA 3.29Å; H2227-W2498 WeakPolarHBondContact O-CA 3.33Å; L2229-W2498 HydrophobicContact CD2-CZ3 4.36Å; W2498-D2528 CarbonylContact O-C 3.47Å; W2498-D2528 VanDerWaalsContact O-CA 3.32Å; W2498-D2528 WeakPolarHBondContact O-CA 3.29Å; W2498-A2529 HydrophobicContact CB-CB 4Å; W2498-A2529 PolarHBondContact N-O 3.03Å; W2498-A2529 PolarHBondContact O-N 2.98Å
2499	H	94.5	Very high	89.2	Confident	20 Å²	20	37.4 Å²	37.4	9%	0.093	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	116.7	159.5	-175.2	74.3	0	0	0	107.8	P2225 H2227 H2228 L2229 R2496 D2528	P2225-H2499 HydrophobicContact CB-CB 3.73Å; P2225-H2499 HydrophobicContact CG-CB 3.81Å; H2227-H2499 PolarHBondContact O-N 3.18Å; H2228-H2499 CarbonylContact C-O 3.48Å; H2228-H2499 WeakPolarHBondContact CA-O 3.41Å; H2228-H2499 AromaticContact CD2-CD2 3.7Å; H2228-H2499 AromaticContact CE1-CD2 3.64Å; H2228-H2499 AromaticContact ND1-CD2 3.42Å; H2228-H2499 PolarHBondContact ND1-CD2 3.15Å; H2228-H2499 AromaticContact NE2-CD2 3.81Å; L2229-H2499 PolarHBondContact N-O 3.08Å; R2496-H2499 PolarHBondContact NH2-CE1 3.14Å; R2496-H2499 PolarHBondContact NH2-ND1 2.94Å; H2499-D2528 WeakPolarHBondContact CA-OD1 3.45Å; H2499-D2528 WeakPolarHBondContact CB-OD1 3.33Å; H2499-D2528 IonicContact CE1-OD2 3.05Å; H2499-D2528 PolarHBondContact CE1-OD2 2.87Å; H2499-D2528 IonicContact CG-OD1 3.56Å; H2499-D2528 IonicContact CG-OD2 2.7Å; H2499-D2528 VanDerWaalsContact ND1-CG 3.29Å; H2499-D2528 IonicContact ND1-OD1 3.12Å; H2499-D2528 PolarHBondContact ND1-OD1 3.06Å; H2499-D2528 VanDerWaalsContact ND1-OD1 3.13Å; H2499-D2528 IonicContact ND1-OD2 3.5Å; H2499-D2528 PolarHBondContact ND1-OD2 2.97Å; H2499-D2528 VanDerWaalsContact ND1-OD2 3.09Å
2500	L	94.7	Very high	89.5	Confident	41.4 Å²	41.4	37.3 Å²	37.3	22%	0.217	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	126.6	174.6	171.8	68.8	0	0	0	108.4	L2229 I2231 L2502 K2526 L2527	L2229-L2500 HydrophobicContact CB-CD1 4.03Å; L2229-L2500 HydrophobicContact CD2-CD1 3.84Å; L2229-L2500 HydrophobicContact CG-CD1 3.71Å; L2229-L2500 CarbonylContact O-C 3.49Å; L2229-L2500 WeakPolarHBondContact O-CA 3.44Å; I2231-L2500 HydrophobicContact CD1-CD1 3.86Å; I2231-L2500 HydrophobicContact CG1-CD1 4.13Å; L2500-L2502 HydrophobicContact CD1-CD2 3.8Å; L2500-L2502 HydrophobicContact CD1-CG 4.45Å; L2500-L2502 HydrophobicContact CD2-CD2 4.23Å; L2500-L2502 HydrophobicContact CD2-CG 4.36Å; L2500-L2502 HydrophobicContact CG-CD2 4.02Å; L2500-L2502 HydrophobicContact CG-CG 4.32Å; L2500-K2526 CarbonylContact O-C 3.52Å; L2500-K2526 WeakPolarHBondContact O-CA 3.4Å; L2500-L2527 HydrophobicContact CB-CB 4.13Å; L2500-L2527 HydrophobicContact CD2-CB 4.3Å; L2500-L2527 HydrophobicContact CD2-CD1 3.88Å; L2500-L2527 HydrophobicContact CD2-CD2 4.14Å; L2500-L2527 HydrophobicContact CG-CB 4.39Å; L2500-L2527 HydrophobicContact CG-CD1 4.47Å; L2500-L2527 PolarHBondContact N-O 3.22Å; L2500-L2527 PolarHBondContact O-N 3.25Å
2501	E	94.7	Very high	89.7	Confident	21.8 Å²	21.8	34.9 Å²	34.9	10%	0.102	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	119.7	173.7	-172.1	167.1	-153.4	0	0	109.6	L2229 E2230 I2231 I2503 R2524 A2525 K2526	L2229-E2501 PolarHBondContact O-N 3.27Å; E2230-E2501 CarbonylContact C-O 3.56Å; E2230-E2501 WeakPolarHBondContact CA-O 3.38Å; I2231-E2501 PolarHBondContact N-O 3.27Å; E2501-I2503 HydrophobicContact CG-CD1 3.8Å; E2501-I2503 HydrophobicContact CG-CG1 4.35Å; E2501-I2503 WeakPolarHBondContact OE1-CD1 3.22Å; E2501-I2503 WeakPolarHBondContact OE1-CG1 3.35Å; E2501-R2524 HydrophobicContact CG-CG 4.3Å; E2501-R2524 VanDerWaalsContact OE1-CD 3.31Å; E2501-R2524 WeakPolarHBondContact OE1-CD 3.35Å; E2501-R2524 WeakPolarHBondContact OE1-CG 3.4Å; E2501-R2524 IonicContact OE1-CZ 2.93Å; E2501-R2524 IonicContact OE1-NE 3.21Å; E2501-R2524 PolarHBondContact OE1-NE 2.98Å; E2501-R2524 IonicContact OE1-NH1 3.05Å; E2501-R2524 PolarHBondContact OE1-NH1 3.02Å; E2501-R2524 IonicContact OE1-NH2 2.7Å; E2501-R2524 PolarHBondContact OE1-NH2 2.87Å; E2501-R2524 IonicContact OE2-CZ 2.67Å; E2501-R2524 IonicContact OE2-NE 2.72Å; E2501-R2524 PolarHBondContact OE2-NE 3.47Å; E2501-R2524 IonicContact OE2-NH1 3.11Å; E2501-R2524 PolarHBondContact OE2-NH1 3.05Å; E2501-R2524 IonicContact OE2-NH2 3.56Å; E2501-R2524 PolarHBondContact OE2-NH2 2.9Å; E2501-A2525 CarbonylContact C-O 3.55Å; E2501-A2525 WeakPolarHBondContact CA-O 3.07Å; E2501-K2526 HydrophobicContact CG-CG 4.37Å; E2501-K2526 VanDerWaalsContact OE1-CE 3.24Å; E2501-K2526 WeakPolarHBondContact OE1-CE 3.38Å
2502	L	94.8	Very high	89.3	Confident	28.8 Å²	28.8	38.3 Å²	38.3	15%	0.151	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	124.1	174.1	-50.1	178.6	0	0	0	108.7	I2231 F2234 L2500 P2505 R2524 A2525	I2231-L2502 HydrophobicContact CB-CD2 3.75Å; I2231-L2502 HydrophobicContact CD1-CD2 3.78Å; I2231-L2502 HydrophobicContact CG1-CD2 3.97Å; I2231-L2502 HydrophobicContact CG2-CD2 4.45Å; I2231-L2502 CarbonylContact O-C 3.51Å; I2231-L2502 WeakPolarHBondContact O-CA 3.33Å; F2234-L2502 HydrophobicContact CD1-CD1 4.5Å; L2500-L2502 HydrophobicContact CD1-CD2 3.8Å; L2500-L2502 HydrophobicContact CD1-CG 4.45Å; L2500-L2502 HydrophobicContact CD2-CD2 4.23Å; L2500-L2502 HydrophobicContact CD2-CG 4.36Å; L2500-L2502 HydrophobicContact CG-CD2 4.02Å; L2500-L2502 HydrophobicContact CG-CG 4.32Å; L2502-P2505 HydrophobicContact CB-CB 3.97Å; L2502-P2505 HydrophobicContact CB-CG 3.85Å; L2502-P2505 HydrophobicContact CD1-CB 4.21Å; L2502-P2505 HydrophobicContact CD1-CG 4.47Å; L2502-P2505 WeakPolarHBondContact O-CD 3.34Å; L2502-R2524 CarbonylContact O-C 3.57Å; L2502-R2524 VanDerWaalsContact O-CA 3.32Å; L2502-R2524 WeakPolarHBondContact O-CA 3.36Å; L2502-A2525 HydrophobicContact CB-CB 4.25Å; L2502-A2525 HydrophobicContact CD1-CB 4.44Å; L2502-A2525 PolarHBondContact N-O 3.22Å; L2502-A2525 PolarHBondContact O-N 3.02Å
2503	I	93.6	Very high	88.8	Confident	22.6 Å²	22.6	41.2 Å²	41.2	12%	0.116	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	127.9	177.5	-62.3	179.8	0	0	0	108.7	E2230 I2231 H2232 E2233 E2501 R2524	E2230-I2503 HydrophobicContact CG-CD1 4.08Å; E2230-I2503 VanDerWaalsContact OE1-CD1 3.25Å; E2230-I2503 WeakPolarHBondContact OE1-CD1 3.45Å; I2231-I2503 PolarHBondContact O-N 3.07Å; H2232-I2503 VanDerWaalsContact CE1-CD1 3.43Å; H2232-I2503 WeakPolarHBondContact CE1-CD1 3.28Å; H2232-I2503 WeakPolarHBondContact ND1-CB 3.17Å; H2232-I2503 WeakPolarHBondContact ND1-CD1 3.43Å; E2233-I2503 PolarHBondContact N-O 3.01Å; E2501-I2503 HydrophobicContact CG-CD1 3.8Å; E2501-I2503 HydrophobicContact CG-CG1 4.35Å; E2501-I2503 WeakPolarHBondContact OE1-CD1 3.22Å; E2501-I2503 WeakPolarHBondContact OE1-CG1 3.35Å; I2503-R2524 HydrophobicContact CD1-CB 4.41Å; I2503-R2524 HydrophobicContact CD1-CG 3.95Å; I2503-R2524 HydrophobicContact CG1-CG 4.46Å
2504	N	92.9	Very high	88.1	Confident	19 Å²	19	42 Å²	42	10%	0.102	21%	0.209	C	C	.	.	S	Bend	trans	49	42	-171.2	-54.9	-38.7	0	0	0	115.4	E2233 Q2506 A2522 A2523 T2593 V2596 S2597	E2233-N2504 HydrophobicContact CG-CB 4.45Å; E2233-N2504 VanDerWaalsContact OE1-CB 3.27Å; E2233-N2504 WeakPolarHBondContact OE1-CB 3.38Å; E2233-N2504 PolarHBondContact OE1-ND2 3.39Å; N2504-Q2506 PolarHBondContact O-N 3.46Å; N2504-A2522 CarbonylContact C-O 3.54Å; N2504-A2522 VanDerWaalsContact CA-O 3.3Å; N2504-A2522 WeakPolarHBondContact CA-O 3.45Å; N2504-A2523 PolarHBondContact N-O 3.11Å; N2504-A2523 PolarHBondContact OD1-O 2.98Å; N2504-T2593 VanDerWaalsContact ND2-CG2 3.35Å; N2504-T2593 WeakPolarHBondContact ND2-CG2 3.33Å; N2504-V2596 HydrophobicContact CB-CG1 3.93Å; N2504-S2597 WeakPolarHBondContact OD1-CA 3.39Å
2505	P	95.4	Very high	87.5	Confident	14 Å²	14	42.2 Å²	42.2	9%	0.091	21%	0.21	C	C	.	.			trans	-61.6	142.5	176.3	27.3	-37	0	0	0	112.3	F2234 L2502 S2521 A2522 A2525	F2234-P2505 HydrophobicContact CB-CB 4.37Å; F2234-P2505 HydrophobicContact CD1-CB 4.23Å; F2234-P2505 CarbonylContact O-C 3.56Å; F2234-P2505 VanDerWaalsContact O-CA 3.28Å; F2234-P2505 WeakPolarHBondContact O-CA 3.35Å; L2502-P2505 HydrophobicContact CB-CB 3.97Å; L2502-P2505 HydrophobicContact CB-CG 3.85Å; L2502-P2505 HydrophobicContact CD1-CB 4.21Å; L2502-P2505 HydrophobicContact CD1-CG 4.47Å; L2502-P2505 WeakPolarHBondContact O-CD 3.34Å; P2505-S2521 VanDerWaalsContact O-CA 3.24Å; P2505-S2521 WeakPolarHBondContact O-CA 3.41Å; P2505-S2521 WeakPolarHBondContact O-CB 3.36Å; P2505-A2522 VanDerWaalsContact CD-O 3.24Å; P2505-A2522 WeakPolarHBondContact CD-O 3.38Å; P2505-A2522 HydrophobicContact CG-CB 4.2Å; P2505-A2522 PolarHBondContact O-N 2.98Å; P2505-A2522 VanDerWaalsContact O-N 3.12Å; P2505-A2525 HydrophobicContact CG-CB 4.22Å
2506	Q	94.6	Very high	87.3	Confident	1.2 Å²	1.2	37.7 Å²	37.7	1%	0.006	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	130.4	173.6	-54.8	-175.5	35	0	0	110	F2234 K2235 M2236 N2504 L2519 V2520 W2590 L2591 V2596	F2234-Q2506 PolarHBondContact O-N 3.17Å; K2235-Q2506 CarbonylContact C-O 3.57Å; K2235-Q2506 VanDerWaalsContact CA-O 3.32Å; K2235-Q2506 WeakPolarHBondContact CA-O 3.31Å; K2235-Q2506 HydrophobicContact CG-CB 4.14Å; K2235-Q2506 HydrophobicContact CG-CG 4.42Å; M2236-Q2506 PolarHBondContact N-O 3.09Å; N2504-Q2506 PolarHBondContact O-N 3.46Å; Q2506-L2519 HydrophobicContact CB-CD2 4.13Å; Q2506-L2519 HydrophobicContact CG-CD2 4.47Å; Q2506-V2520 CarbonylContact C-O 3.57Å; Q2506-V2520 WeakPolarHBondContact CA-O 3.37Å; Q2506-W2590 HydrophobicContact CB-CE3 3.94Å; Q2506-W2590 HydrophobicContact CB-CZ3 3.97Å; Q2506-L2591 PolarHBondContact NE2-O 3.18Å; Q2506-V2596 HydrophobicContact CG-CG2 4.07Å
2507	L	93.8	Very high	87.3	Confident	52.2 Å²	52.2	36.8 Å²	36.8	27%	0.273	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	117.2	178.9	170.7	60.3	0	0	0	109	M2236 W2238 L2509 L2519 V2520	M2236-L2507 HydrophobicContact CB-CD1 4.11Å; M2236-L2507 HydrophobicContact CE-CD1 3.98Å; M2236-L2507 HydrophobicContact CE-CD2 4.45Å; M2236-L2507 HydrophobicContact CG-CD1 4.01Å; M2236-L2507 CarbonylContact O-C 3.57Å; M2236-L2507 WeakPolarHBondContact O-CA 3.27Å; M2236-L2507 WeakPolarHBondContact O-CD1 3.48Å; M2236-L2507 HydrophobicContact SD-CD1 4.13Å; W2238-L2507 HydrophobicContact CB-CD1 3.95Å; L2507-L2509 HydrophobicContact CD1-CD2 4.13Å; L2507-L2509 HydrophobicContact CD2-CD2 4.08Å; L2507-L2509 HydrophobicContact CG-CD2 3.93Å; L2507-L2509 HydrophobicContact CG-CG 4.43Å; L2507-L2519 CarbonylContact O-C 3.51Å; L2507-L2519 WeakPolarHBondContact O-CA 3.36Å; L2507-V2520 HydrophobicContact CB-CB 4.36Å; L2507-V2520 PolarHBondContact N-O 2.96Å; L2507-V2520 PolarHBondContact O-N 3.16Å
2508	M	92.3	Very high	87.4	Confident	0.2 Å²	0.2	35.1 Å²	35.1	0%	0.001	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	124.3	176.1	-169.7	179.5	70.6	0	0	110.4	M2236 R2237 W2238 K2510 Y2517 V2518 L2519 D2588 W2590	M2236-M2508 PolarHBondContact O-N 2.9Å; R2237-M2508 HydrophobicContact CB-CE 4.09Å; R2237-M2508 HydrophobicContact CG-CE 3.75Å; R2237-M2508 VanDerWaalsContact NE-CE 3.29Å; R2237-M2508 PolarHBondContact NH2-SD 3.09Å; W2238-M2508 WeakPolarHBondContact CA-O 3.4Å; W2238-M2508 WeakPolarHBondContact CB-O 3.29Å; W2238-M2508 PolarHBondContact N-O 3.18Å; M2508-K2510 HydrophobicContact CE-CB 4.27Å; M2508-K2510 HydrophobicContact CE-CD 4.04Å; M2508-K2510 HydrophobicContact CE-CG 3.82Å; M2508-K2510 HydrophobicContact SD-CG 4.43Å; M2508-Y2517 HydrophobicContact CG-CD2 3.71Å; M2508-Y2517 HydrophobicContact CG-CE2 4.3Å; M2508-Y2517 HydrophobicContact CG-CG 4.03Å; M2508-Y2517 HydrophobicContact SD-CD1 4.21Å; M2508-Y2517 HydrophobicContact SD-CD2 3.81Å; M2508-Y2517 VanDerWaalsContact SD-CD2 3.51Å; M2508-Y2517 HydrophobicContact SD-CE1 4.37Å; M2508-Y2517 HydrophobicContact SD-CE2 4.07Å; M2508-Y2517 HydrophobicContact SD-CG 3.97Å; M2508-V2518 CarbonylContact C-O 3.58Å; M2508-V2518 WeakPolarHBondContact CA-O 3.46Å; M2508-L2519 HydrophobicContact CB-CD1 4.24Å; M2508-L2519 HydrophobicContact CB-CD2 3.66Å; M2508-L2519 HydrophobicContact CB-CG 4.31Å; M2508-L2519 HydrophobicContact CG-CD1 4.24Å; M2508-L2519 HydrophobicContact CG-CD2 4Å; M2508-L2519 HydrophobicContact CG-CG 4.43Å; M2508-L2519 HydrophobicContact SD-CD2 4.29Å; M2508-D2588 HydrophobicContact CE-CB 3.98Å; M2508-D2588 WeakPolarHBondContact CE-OD1 3.11Å; M2508-D2588 VanDerWaalsContact CE-OD2 3.29Å; M2508-D2588 WeakPolarHBondContact CE-OD2 3.33Å; M2508-D2588 HydrophobicContact SD-CB 3.91Å; M2508-W2590 HydrophobicContact CB-CH2 3.84Å; M2508-W2590 HydrophobicContact CB-CZ3 4.03Å; M2508-W2590 HydrophobicContact CE-CH2 4.06Å; M2508-W2590 HydrophobicContact CE-CZ2 3.77Å
2509	L	91.6	Very high	87.4	Confident	12.4 Å²	12.4	29.6 Å²	29.6	7%	0.065	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	114.6	177.4	-54.5	176.3	0	0	0	108.5	W2238 L2507 Y2517 V2518 V2520 I2779 L2783 L2784	W2238-L2509 HydrophobicContact CB-CD2 3.9Å; W2238-L2509 HydrophobicContact CG-CD2 4.3Å; L2507-L2509 HydrophobicContact CD1-CD2 4.13Å; L2507-L2509 HydrophobicContact CD2-CD2 4.08Å; L2507-L2509 HydrophobicContact CG-CD2 3.93Å; L2507-L2509 HydrophobicContact CG-CG 4.43Å; L2509-Y2517 WeakPolarHBondContact O-CA 3.36Å; L2509-Y2517 WeakPolarHBondContact O-CB 3.39Å; L2509-V2518 HydrophobicContact CB-CB 4.4Å; L2509-V2518 PolarHBondContact N-O 2.99Å; L2509-V2518 PolarHBondContact O-N 3.06Å; L2509-V2520 HydrophobicContact CD1-CG2 3.91Å; L2509-V2520 HydrophobicContact CG-CG2 4.4Å; L2509-I2779 HydrophobicContact CB-CD1 4.09Å; L2509-I2779 HydrophobicContact CB-CG1 4.46Å; L2509-I2779 HydrophobicContact CB-CG2 4.02Å; L2509-I2779 HydrophobicContact CD1-CG2 3.79Å; L2509-I2779 HydrophobicContact CG-CG2 4.41Å; L2509-L2783 HydrophobicContact CB-CD1 4.48Å; L2509-L2783 HydrophobicContact CB-CD2 3.9Å; L2509-L2783 HydrophobicContact CD1-CD1 4.13Å; L2509-L2783 HydrophobicContact CD2-CD1 4.23Å; L2509-L2783 HydrophobicContact CD2-CD2 4.2Å; L2509-L2784 HydrophobicContact CD1-CD1 4.3Å; L2509-L2784 HydrophobicContact CD2-CD2 4.34Å
2510	K	86.4	Confident	87.3	Confident	45.4 Å²	45.4	29.6 Å²	29.6	20%	0.197	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	127.4	-177.4	-160.7	-179.8	177	179.3	0	110.2	W2238 T2239 M2508 E2585 D2588	W2238-K2510 PolarHBondContact O-N 3.2Å; W2238-K2510 VanDerWaalsContact O-N 3.15Å; T2239-K2510 WeakPolarHBondContact CA-O 3.41Å; T2239-K2510 HydrophobicContact CG2-CB 4.31Å; T2239-K2510 HydrophobicContact CG2-CD 4.26Å; T2239-K2510 HydrophobicContact CG2-CG 4.07Å; M2508-K2510 HydrophobicContact CE-CB 4.27Å; M2508-K2510 HydrophobicContact CE-CD 4.04Å; M2508-K2510 HydrophobicContact CE-CG 3.82Å; M2508-K2510 HydrophobicContact SD-CG 4.43Å; K2510-E2585 WeakPolarHBondContact CE-OE1 3.41Å; K2510-E2585 IonicContact NZ-OE1 4Å; K2510-E2585 PolarHBondContact NZ-OE1 3.17Å; K2510-E2585 IonicContact NZ-OE2 3.5Å; K2510-E2585 PolarHBondContact NZ-OE2 3.05Å; K2510-D2588 VanDerWaalsContact CE-CG 3.4Å; K2510-D2588 WeakPolarHBondContact CE-OD1 3.33Å; K2510-D2588 WeakPolarHBondContact CE-OD2 3.03Å; K2510-D2588 VanDerWaalsContact NZ-CG 3.29Å; K2510-D2588 IonicContact NZ-OD1 2.98Å; K2510-D2588 PolarHBondContact NZ-OD1 3.14Å; K2510-D2588 IonicContact NZ-OD2 3.4Å; K2510-D2588 PolarHBondContact NZ-OD2 3.09Å
2511	T	81.4	Confident	87.3	Confident	9.6 Å²	9.6	27.7 Å²	27.7	6%	0.059	15%	0.15	C	C	.	.			trans	-88.9	161.1	171.2	58.3	0	0	0	0	110.3	H2513 L2514 G2516 M2775 E2778 I2779 D2782 L2783	T2511-H2513 VanDerWaalsContact C-N 3.27Å; T2511-H2513 PolarHBondContact O-N 2.95Å; T2511-H2513 VanDerWaalsContact O-N 3.07Å; T2511-H2513 PolarHBondContact OG1-N 3.12Å; T2511-L2514 WeakPolarHBondContact CB-O 3.06Å; T2511-L2514 HydrophobicContact CG2-CD1 4.11Å; T2511-L2514 WeakPolarHBondContact OG1-CD1 3.42Å; T2511-L2514 WeakPolarHBondContact OG1-CG 3.4Å; T2511-L2514 PolarHBondContact OG1-N 2.96Å; T2511-L2514 PolarHBondContact OG1-O 3.41Å; T2511-G2516 PolarHBondContact OG1-O 3.16Å; T2511-M2775 HydrophobicContact CG2-CB 4.12Å; T2511-M2775 HydrophobicContact CG2-CG 4.19Å; T2511-E2778 VanDerWaalsContact CB-OE2 3.32Å; T2511-E2778 WeakPolarHBondContact CB-OE2 3.43Å; T2511-E2778 HydrophobicContact CG2-CB 3.99Å; T2511-E2778 HydrophobicContact CG2-CG 4.16Å; T2511-E2778 VanDerWaalsContact CG2-OE2 3.32Å; T2511-E2778 WeakPolarHBondContact CG2-OE2 3.24Å; T2511-I2779 HydrophobicContact CG2-CD1 4.12Å; T2511-I2779 HydrophobicContact CG2-CG1 3.95Å; T2511-D2782 HydrophobicContact CG2-CB 4.33Å; T2511-L2783 HydrophobicContact CG2-CD1 3.92Å; T2511-L2783 HydrophobicContact CG2-CG 4.22Å
2512	N	73.2	Confident	87.2	Confident	85.8 Å²	85.8	26.8 Å²	26.8	46%	0.459	15%	0.146	S	C	.	.	S	Bend	trans	-81.4	-12.9	179.1	-68	-18.3	0	0	0	113.1	E2240 R2243 E2778	E2240-N2512 WeakPolarHBondContact CB-ND2 3.36Å; E2240-N2512 WeakPolarHBondContact CB-OD1 3.39Å; E2240-N2512 PolarHBondContact OE2-ND2 3.21Å; R2243-N2512 PolarHBondContact NH2-ND2 3.41Å; N2512-E2778 WeakPolarHBondContact CA-OE1 3.04Å; N2512-E2778 WeakPolarHBondContact CB-OE1 3.38Å; N2512-E2778 PolarHBondContact N-OE1 3.46Å
2513	H	70.5	Confident	87.1	Confident	145.4 Å²	145.4	25.9 Å²	25.9	67%	0.673	14%	0.143	S	C	*	.	S	Bend	trans	-108.7	-20.5	-171	-58.5	-45.9	0	0	0	113.7	T2511 E2778	T2511-H2513 VanDerWaalsContact C-N 3.27Å; T2511-H2513 PolarHBondContact O-N 2.95Å; T2511-H2513 VanDerWaalsContact O-N 3.07Å; T2511-H2513 PolarHBondContact OG1-N 3.12Å; H2513-E2778 IonicContact CD2-OE1 3.3Å; H2513-E2778 IonicContact CG-OE1 2.75Å; H2513-E2778 PolarHBondContact N-OE1 3.22Å
2514	L	69.6	Low	87	Confident	37.8 Å²	37.8	28.5 Å²	28.5	20%	0.198	15%	0.151	C	C	.	.	S	Bend	trans	-102.2	137.2	-179.6	-86.8	137.7	0	0	0	111.6	T2511 G2516 L2771 H2774 M2775 E2778 I2779	T2511-L2514 WeakPolarHBondContact CB-O 3.06Å; T2511-L2514 HydrophobicContact CG2-CD1 4.11Å; T2511-L2514 WeakPolarHBondContact OG1-CD1 3.42Å; T2511-L2514 WeakPolarHBondContact OG1-CG 3.4Å; T2511-L2514 PolarHBondContact OG1-N 2.96Å; T2511-L2514 PolarHBondContact OG1-O 3.41Å; L2514-G2516 PolarHBondContact O-N 3.06Å; L2514-G2516 VanDerWaalsContact O-N 3.15Å; L2514-L2771 HydrophobicContact CD2-CD1 3.76Å; L2514-H2774 HydrophobicContact CD2-CB 3.79Å; L2514-M2775 HydrophobicContact CB-CG 4.11Å; L2514-M2775 HydrophobicContact CD1-CB 4.07Å; L2514-M2775 HydrophobicContact CD1-CG 3.8Å; L2514-M2775 HydrophobicContact CD2-CB 4.38Å; L2514-M2775 HydrophobicContact CD2-CG 4.17Å; L2514-E2778 HydrophobicContact CD1-CB 4.23Å; L2514-E2778 VanDerWaalsContact CD1-OE2 3.26Å; L2514-E2778 WeakPolarHBondContact CD1-OE2 3.38Å; L2514-E2778 WeakPolarHBondContact CD2-OE2 3.41Å; L2514-E2778 VanDerWaalsContact CG-OE2 3.31Å; L2514-E2778 WeakPolarHBondContact CG-OE2 3.31Å; L2514-E2778 PolarHBondContact N-OE2 2.96Å; L2514-I2779 HydrophobicContact CD1-CD1 4.39Å; L2514-I2779 HydrophobicContact CD1-CG1 4.12Å
2515	A	69.2	Low	87.1	Confident	46.8 Å²	46.8	28 Å²	28	39%	0.387	15%	0.149	S	C	.	.	S	Bend	trans	-76.5	72.7	170.5	0	0	0	0	0	111.2	Q2562 V2563 N2581 V2582	A2515-Q2562 HydrophobicContact CB-CB 4.26Å; A2515-Q2562 HydrophobicContact CB-CG 4.32Å; A2515-V2563 HydrophobicContact CB-CB 4.36Å; A2515-V2563 WeakPolarHBondContact O-CB 3.33Å; A2515-V2563 WeakPolarHBondContact O-CG2 3.42Å; A2515-V2563 PolarHBondContact O-N 2.87Å; A2515-N2581 HydrophobicContact CB-CB 3.82Å; A2515-V2582 HydrophobicContact CB-CB 4.36Å; A2515-V2582 HydrophobicContact CB-CG2 4.44Å
2516	G	80.3	Confident	87.1	Confident	8.2 Å²	8.2	30.3 Å²	30.3	9%	0.085	16%	0.158	C	C	.	.			trans	167.1	177.4	-175.8	0	0	0	0	0	113.4	T2511 L2514 T2559 M2775	T2511-G2516 PolarHBondContact OG1-O 3.16Å; L2514-G2516 PolarHBondContact O-N 3.06Å; L2514-G2516 VanDerWaalsContact O-N 3.15Å; G2516-T2559 VanDerWaalsContact CA-OG1 3.26Å; G2516-T2559 WeakPolarHBondContact CA-OG1 3.28Å; G2516-M2775 VanDerWaalsContact C-SD 3.57Å
2517	Y	88.3	Confident	87.1	Confident	3.4 Å²	3.4	32.6 Å²	32.6	1%	0.013	17%	0.17	C	C	.	.			trans	-153.8	159.5	177.5	56.5	-94.4	0	0	0	112	M2508 L2509 L2519 A2558 T2559 D2588 Q2589 I2705 L2707 M2775	M2508-Y2517 HydrophobicContact CG-CD2 3.71Å; M2508-Y2517 HydrophobicContact CG-CE2 4.3Å; M2508-Y2517 HydrophobicContact CG-CG 4.03Å; M2508-Y2517 HydrophobicContact SD-CD1 4.21Å; M2508-Y2517 HydrophobicContact SD-CD2 3.81Å; M2508-Y2517 VanDerWaalsContact SD-CD2 3.51Å; M2508-Y2517 HydrophobicContact SD-CE1 4.37Å; M2508-Y2517 HydrophobicContact SD-CE2 4.07Å; M2508-Y2517 HydrophobicContact SD-CG 3.97Å; L2509-Y2517 WeakPolarHBondContact O-CA 3.36Å; L2509-Y2517 WeakPolarHBondContact O-CB 3.39Å; Y2517-L2519 HydrophobicContact CD2-CD1 4.4Å; Y2517-L2519 HydrophobicContact CD2-CG 4.08Å; Y2517-L2519 HydrophobicContact CE2-CD1 3.9Å; Y2517-L2519 HydrophobicContact CE2-CG 3.97Å; Y2517-A2558 WeakPolarHBondContact O-CA 3.31Å; Y2517-A2558 VanDerWaalsContact O-CB 3.31Å; Y2517-A2558 WeakPolarHBondContact O-CB 3.41Å; Y2517-T2559 HydrophobicContact CD1-CG2 3.75Å; Y2517-T2559 HydrophobicContact CD2-CG2 4.26Å; Y2517-T2559 HydrophobicContact CE1-CG2 3.64Å; Y2517-T2559 HydrophobicContact CE2-CG2 4.17Å; Y2517-T2559 HydrophobicContact CG-CG2 4.06Å; Y2517-T2559 PolarHBondContact N-OG1 2.9Å; Y2517-T2559 VanDerWaalsContact N-OG1 3.09Å; Y2517-T2559 PolarHBondContact O-N 3.09Å; Y2517-T2559 VanDerWaalsContact O-N 3.14Å; Y2517-T2559 PolarHBondContact O-OG1 3.24Å; Y2517-D2588 HydrophobicContact CE1-CB 4.46Å; Y2517-D2588 WeakPolarHBondContact CE1-OD1 3.26Å; Y2517-Q2589 WeakPolarHBondContact OH-CA 3.44Å; Y2517-Q2589 WeakPolarHBondContact OH-CB 3.35Å; Y2517-Q2589 PolarHBondContact OH-N 3.2Å; Y2517-Q2589 VanDerWaalsContact OH-N 3.1Å; Y2517-Q2589 PolarHBondContact OH-O 3.18Å; Y2517-I2705 HydrophobicContact CE1-CD1 4.37Å; Y2517-I2705 HydrophobicContact CE1-CG2 4.5Å; Y2517-L2707 HydrophobicContact CD2-CD2 4.49Å; Y2517-L2707 HydrophobicContact CE2-CD2 3.8Å; Y2517-M2775 VanDerWaalsContact C-SD 3.52Å; Y2517-M2775 PolarHBondContact N-SD 2.77Å
2518	V	91.2	Very high	87.1	Confident	5.4 Å²	5.4	30.5 Å²	30.5	3%	0.033	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	130.2	172.1	177.4	0	0	0	0	109	M2508 L2509 V2520 Y2556 Y2557 A2558 M2710 M2775 I2776 I2779	M2508-V2518 CarbonylContact C-O 3.58Å; M2508-V2518 WeakPolarHBondContact CA-O 3.46Å; L2509-V2518 HydrophobicContact CB-CB 4.4Å; L2509-V2518 PolarHBondContact N-O 2.99Å; L2509-V2518 PolarHBondContact O-N 3.06Å; V2518-V2520 HydrophobicContact CG1-CG2 4.41Å; V2518-Y2556 HydrophobicContact CG1-CD1 4.38Å; V2518-Y2557 CarbonylContact C-O 3.58Å; V2518-Y2557 VanDerWaalsContact CA-O 3.28Å; V2518-Y2557 WeakPolarHBondContact CA-O 3.26Å; V2518-Y2557 WeakPolarHBondContact CG1-O 3.27Å; V2518-A2558 HydrophobicContact CB-CB 4.43Å; V2518-A2558 HydrophobicContact CG2-CB 4.1Å; V2518-M2710 HydrophobicContact CG1-CE 3.81Å; V2518-M2710 HydrophobicContact CG2-CE 4.11Å; V2518-M2775 HydrophobicContact CG2-CB 4.47Å; V2518-M2775 HydrophobicContact CG2-CE 3.89Å; V2518-M2775 HydrophobicContact CG2-CG 4.15Å; V2518-M2775 HydrophobicContact CG2-SD 4.06Å; V2518-I2776 HydrophobicContact CG2-CG1 4.17Å; V2518-I2779 HydrophobicContact CB-CD1 3.92Å; V2518-I2779 HydrophobicContact CG2-CD1 3.51Å; V2518-I2779 VanDerWaalsContact CG2-CD1 3.46Å
2519	L	92.2	Very high	87.2	Confident	0.2 Å²	0.2	31.6 Å²	31.6	0%	0.001	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	122.8	171.1	-92.6	161.8	0	0	0	109.6	Q2506 L2507 M2508 Y2517 Y2556 Y2557 Q2589 W2590 L2591 L2707	Q2506-L2519 HydrophobicContact CB-CD2 4.13Å; Q2506-L2519 HydrophobicContact CG-CD2 4.47Å; L2507-L2519 CarbonylContact O-C 3.51Å; L2507-L2519 WeakPolarHBondContact O-CA 3.36Å; M2508-L2519 HydrophobicContact CB-CD1 4.24Å; M2508-L2519 HydrophobicContact CB-CD2 3.66Å; M2508-L2519 HydrophobicContact CB-CG 4.31Å; M2508-L2519 HydrophobicContact CG-CD1 4.24Å; M2508-L2519 HydrophobicContact CG-CD2 4Å; M2508-L2519 HydrophobicContact CG-CG 4.43Å; M2508-L2519 HydrophobicContact SD-CD2 4.29Å; Y2517-L2519 HydrophobicContact CD2-CD1 4.4Å; Y2517-L2519 HydrophobicContact CD2-CG 4.08Å; Y2517-L2519 HydrophobicContact CE2-CD1 3.9Å; Y2517-L2519 HydrophobicContact CE2-CG 3.97Å; L2519-Y2556 CarbonylContact O-C 3.41Å; L2519-Y2556 WeakPolarHBondContact O-CA 3.37Å; L2519-Y2557 PolarHBondContact N-O 3.26Å; L2519-Y2557 PolarHBondContact O-N 2.99Å; L2519-Q2589 VanDerWaalsContact CD1-O 3.28Å; L2519-Q2589 WeakPolarHBondContact CD1-O 3.24Å; L2519-W2590 HydrophobicContact CD1-CE3 4.1Å; L2519-W2590 HydrophobicContact CD1-CZ3 4.43Å; L2519-W2590 HydrophobicContact CD2-CE3 3.89Å; L2519-W2590 HydrophobicContact CD2-CZ3 3.84Å; L2519-L2591 HydrophobicContact CB-CD1 4.45Å; L2519-L2591 HydrophobicContact CD1-CD1 4.4Å; L2519-L2591 HydrophobicContact CD1-CG 4.16Å; L2519-L2591 HydrophobicContact CD2-CD1 3.69Å; L2519-L2591 HydrophobicContact CD2-CG 4.05Å; L2519-L2707 HydrophobicContact CD1-CD1 3.95Å; L2519-L2707 HydrophobicContact CD1-CD2 4.32Å
2520	V	93.2	Very high	87.2	Confident	19.2 Å²	19.2	31.2 Å²	31.2	12%	0.116	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	127.5	170.4	-168	0	0	0	0	107.6	Q2506 L2507 L2509 V2518 M2554 Q2555 Y2556	Q2506-V2520 CarbonylContact C-O 3.57Å; Q2506-V2520 WeakPolarHBondContact CA-O 3.37Å; L2507-V2520 HydrophobicContact CB-CB 4.36Å; L2507-V2520 PolarHBondContact N-O 2.96Å; L2507-V2520 PolarHBondContact O-N 3.16Å; L2509-V2520 HydrophobicContact CD1-CG2 3.91Å; L2509-V2520 HydrophobicContact CG-CG2 4.4Å; V2518-V2520 HydrophobicContact CG1-CG2 4.41Å; V2520-M2554 HydrophobicContact CG1-CE 3.32Å; V2520-M2554 HydrophobicContact CG1-CG 4.06Å; V2520-M2554 HydrophobicContact CG1-SD 3.86Å; V2520-Q2555 WeakPolarHBondContact CA-O 3.29Å; V2520-Y2556 HydrophobicContact CB-CD1 4.33Å; V2520-Y2556 HydrophobicContact CB-CE1 4.3Å; V2520-Y2556 HydrophobicContact CG1-CD1 4.07Å; V2520-Y2556 HydrophobicContact CG1-CD2 4.47Å; V2520-Y2556 HydrophobicContact CG1-CE1 3.74Å; V2520-Y2556 HydrophobicContact CG1-CE2 4.34Å; V2520-Y2556 HydrophobicContact CG1-CG 4.42Å; V2520-Y2556 HydrophobicContact CG2-CD1 3.71Å; V2520-Y2556 HydrophobicContact CG2-CE1 3.68Å
2521	S	93.5	Very high	87.3	Confident	3.2 Å²	3.2	31.2 Å²	31.2	2%	0.022	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	155.6	176	65.3	0	0	0	0	111.5	P2505 M2554 Q2555	P2505-S2521 VanDerWaalsContact O-CA 3.24Å; P2505-S2521 WeakPolarHBondContact O-CA 3.41Å; P2505-S2521 WeakPolarHBondContact O-CB 3.36Å; S2521-M2554 CarbonylContact O-C 3.55Å; S2521-M2554 VanDerWaalsContact O-CA 3.28Å; S2521-M2554 WeakPolarHBondContact O-CA 3.38Å; S2521-M2554 WeakPolarHBondContact O-CG 3.4Å; S2521-Q2555 PolarHBondContact N-O 3.1Å; S2521-Q2555 PolarHBondContact O-N 3.11Å
2522	A	93.6	Very high	87.7	Confident	2.2 Å²	2.2	31 Å²	31	2%	0.018	17%	0.169	C	C	.	.			trans	-137.2	155.8	171	0	0	0	0	0	109.5	N2504 P2505 R2524 L2551 M2554 V2596	N2504-A2522 CarbonylContact C-O 3.54Å; N2504-A2522 VanDerWaalsContact CA-O 3.3Å; N2504-A2522 WeakPolarHBondContact CA-O 3.45Å; P2505-A2522 VanDerWaalsContact CD-O 3.24Å; P2505-A2522 WeakPolarHBondContact CD-O 3.38Å; P2505-A2522 HydrophobicContact CG-CB 4.2Å; P2505-A2522 PolarHBondContact O-N 2.98Å; P2505-A2522 VanDerWaalsContact O-N 3.12Å; A2522-R2524 VanDerWaalsContact C-N 3.35Å; A2522-L2551 HydrophobicContact CB-CB 4.46Å; A2522-L2551 HydrophobicContact CB-CD2 4.43Å; A2522-M2554 HydrophobicContact CB-CB 4.19Å; A2522-M2554 HydrophobicContact CB-CG 4.31Å; A2522-V2596 VanDerWaalsContact O-CG1 3.25Å; A2522-V2596 WeakPolarHBondContact O-CG1 3.32Å
2523	A	91.8	Very high	88.2	Confident	10.2 Å²	10.2	28.4 Å²	28.4	8%	0.084	16%	0.157	C	C	.	.	S	Bend	trans	-72.9	-38.8	173.5	0	0	0	0	0	110.7	N2504 E2552 C2553 D2598	N2504-A2523 PolarHBondContact N-O 3.11Å; N2504-A2523 PolarHBondContact OD1-O 2.98Å; A2523-E2552 PolarHBondContact N-O 3.03Å; A2523-E2552 VanDerWaalsContact N-O 3.11Å; A2523-C2553 HydrophobicContact CB-CB 3.9Å; A2523-D2598 HydrophobicContact CB-CB 3.8Å
2524	R	92.8	Very high	88.8	Confident	76.6 Å²	76.6	21.7 Å²	21.7	29%	0.289	13%	0.126	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	139.8	177.6	-165.2	177.1	-79.6	-104	-4.9	109.8	E2501 L2502 I2503 A2522 K2526 L2551 E2552	E2501-R2524 HydrophobicContact CG-CG 4.3Å; E2501-R2524 VanDerWaalsContact OE1-CD 3.31Å; E2501-R2524 WeakPolarHBondContact OE1-CD 3.35Å; E2501-R2524 WeakPolarHBondContact OE1-CG 3.4Å; E2501-R2524 IonicContact OE1-CZ 2.93Å; E2501-R2524 IonicContact OE1-NE 3.21Å; E2501-R2524 PolarHBondContact OE1-NE 2.98Å; E2501-R2524 IonicContact OE1-NH1 3.05Å; E2501-R2524 PolarHBondContact OE1-NH1 3.02Å; E2501-R2524 IonicContact OE1-NH2 2.7Å; E2501-R2524 PolarHBondContact OE1-NH2 2.87Å; E2501-R2524 IonicContact OE2-CZ 2.67Å; E2501-R2524 IonicContact OE2-NE 2.72Å; E2501-R2524 PolarHBondContact OE2-NE 3.47Å; E2501-R2524 IonicContact OE2-NH1 3.11Å; E2501-R2524 PolarHBondContact OE2-NH1 3.05Å; E2501-R2524 IonicContact OE2-NH2 3.56Å; E2501-R2524 PolarHBondContact OE2-NH2 2.9Å; L2502-R2524 CarbonylContact O-C 3.57Å; L2502-R2524 VanDerWaalsContact O-CA 3.32Å; L2502-R2524 WeakPolarHBondContact O-CA 3.36Å; I2503-R2524 HydrophobicContact CD1-CB 4.41Å; I2503-R2524 HydrophobicContact CD1-CG 3.95Å; I2503-R2524 HydrophobicContact CG1-CG 4.46Å; A2522-R2524 VanDerWaalsContact C-N 3.35Å; R2524-K2526 HydrophobicContact CG-CG 4.47Å; R2524-L2551 CarbonylContact O-C 3.59Å; R2524-L2551 WeakPolarHBondContact O-CA 3.33Å; R2524-E2552 HydrophobicContact CB-CB 4.21Å; R2524-E2552 WeakPolarHBondContact CB-OE2 3.41Å; R2524-E2552 VanDerWaalsContact CD-OE2 3.23Å; R2524-E2552 WeakPolarHBondContact CD-OE2 3.41Å; R2524-E2552 PolarHBondContact N-O 3.39Å; R2524-E2552 IonicContact NE-OE2 3.2Å; R2524-E2552 PolarHBondContact NE-OE2 2.79Å; R2524-E2552 PolarHBondContact O-N 3.35Å
2525	A	94.5	Very high	89.3	Confident	8 Å²	8	21.2 Å²	21.2	7%	0.066	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	115.8	171	0	0	0	0	0	109.6	E2501 L2502 P2505 H2550 L2551	E2501-A2525 CarbonylContact C-O 3.55Å; E2501-A2525 WeakPolarHBondContact CA-O 3.07Å; L2502-A2525 HydrophobicContact CB-CB 4.25Å; L2502-A2525 HydrophobicContact CD1-CB 4.44Å; L2502-A2525 PolarHBondContact N-O 3.22Å; L2502-A2525 PolarHBondContact O-N 3.02Å; P2505-A2525 HydrophobicContact CG-CB 4.22Å; A2525-H2550 CarbonylContact C-O 3.5Å; A2525-H2550 WeakPolarHBondContact CA-O 3.41Å; A2525-L2551 HydrophobicContact CB-CB 4.45Å; A2525-L2551 HydrophobicContact CB-CD2 4.04Å; A2525-L2551 HydrophobicContact CB-CG 3.83Å
2526	K	94.5	Very high	89.5	Confident	63.6 Å²	63.6	20.8 Å²	20.8	28%	0.277	11%	0.112	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	141.2	175.8	-67.2	163.2	-177.4	155.4	0	109.1	L2500 E2501 R2524 G2549 H2550 E2552	L2500-K2526 CarbonylContact O-C 3.52Å; L2500-K2526 WeakPolarHBondContact O-CA 3.4Å; E2501-K2526 HydrophobicContact CG-CG 4.37Å; E2501-K2526 VanDerWaalsContact OE1-CE 3.24Å; E2501-K2526 WeakPolarHBondContact OE1-CE 3.38Å; R2524-K2526 HydrophobicContact CG-CG 4.47Å; K2526-G2549 CarbonylContact O-C 3.56Å; K2526-G2549 VanDerWaalsContact O-CA 3.26Å; K2526-G2549 WeakPolarHBondContact O-CA 3.34Å; K2526-H2550 PolarHBondContact N-O 3.06Å; K2526-H2550 PolarHBondContact O-N 3.14Å; K2526-E2552 WeakPolarHBondContact CE-OE1 3.43Å; K2526-E2552 IonicContact NZ-OE1 2.87Å; K2526-E2552 PolarHBondContact NZ-OE1 3.12Å; K2526-E2552 IonicContact NZ-OE2 3.76Å
2527	L	94.9	Very high	89	Confident	49.8 Å²	49.8	22 Å²	22	26%	0.261	11%	0.114	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	114.6	-179.5	-145.3	87.3	0	0	0	110.3	L2500 L2547 V2548	L2500-L2527 HydrophobicContact CB-CB 4.13Å; L2500-L2527 HydrophobicContact CD2-CB 4.3Å; L2500-L2527 HydrophobicContact CD2-CD1 3.88Å; L2500-L2527 HydrophobicContact CD2-CD2 4.14Å; L2500-L2527 HydrophobicContact CG-CB 4.39Å; L2500-L2527 HydrophobicContact CG-CD1 4.47Å; L2500-L2527 PolarHBondContact N-O 3.22Å; L2500-L2527 PolarHBondContact O-N 3.25Å; L2527-L2547 HydrophobicContact CB-CD1 4.33Å; L2527-L2547 HydrophobicContact CD1-CD1 3.95Å; L2527-L2547 HydrophobicContact CD1-CD2 3.94Å; L2527-L2547 HydrophobicContact CD1-CG 3.65Å; L2527-L2547 HydrophobicContact CD2-CD1 4.06Å; L2527-L2547 HydrophobicContact CD2-CD2 4.19Å; L2527-L2547 HydrophobicContact CD2-CG 4.28Å; L2527-L2547 HydrophobicContact CG-CD1 3.77Å; L2527-L2547 HydrophobicContact CG-CD2 4.39Å; L2527-L2547 HydrophobicContact CG-CG 4.05Å; L2527-V2548 CarbonylContact C-O 3.49Å; L2527-V2548 WeakPolarHBondContact CA-O 3.37Å
2528	D	94	Very high	87.9	Confident	6.4 Å²	6.4	25.2 Å²	25.2	3%	0.034	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	120.8	-178	-90.3	-61	0	0	0	111.9	H2220 R2496 W2498 H2499 L2530 L2547 V2548	H2220-D2528 IonicContact NE2-OD2 3.12Å; R2496-D2528 IonicContact CZ-OD1 3.67Å; R2496-D2528 VanDerWaalsContact CZ-OD1 3.25Å; R2496-D2528 IonicContact CZ-OD2 3.48Å; R2496-D2528 IonicContact NE-OD1 3.54Å; R2496-D2528 PolarHBondContact NE-OD1 2.94Å; R2496-D2528 IonicContact NE-OD2 3.14Å; R2496-D2528 VanDerWaalsContact NH2-CG 3.35Å; R2496-D2528 IonicContact NH2-OD1 3.58Å; R2496-D2528 PolarHBondContact NH2-OD1 3.1Å; R2496-D2528 IonicContact NH2-OD2 3.28Å; R2496-D2528 PolarHBondContact NH2-OD2 3.02Å; W2498-D2528 CarbonylContact O-C 3.47Å; W2498-D2528 VanDerWaalsContact O-CA 3.32Å; W2498-D2528 WeakPolarHBondContact O-CA 3.29Å; H2499-D2528 WeakPolarHBondContact CA-OD1 3.45Å; H2499-D2528 WeakPolarHBondContact CB-OD1 3.33Å; H2499-D2528 IonicContact CE1-OD2 3.05Å; H2499-D2528 PolarHBondContact CE1-OD2 2.87Å; H2499-D2528 IonicContact CG-OD1 3.56Å; H2499-D2528 IonicContact CG-OD2 2.7Å; H2499-D2528 VanDerWaalsContact ND1-CG 3.29Å; H2499-D2528 IonicContact ND1-OD1 3.12Å; H2499-D2528 PolarHBondContact ND1-OD1 3.06Å; H2499-D2528 VanDerWaalsContact ND1-OD1 3.13Å; H2499-D2528 IonicContact ND1-OD2 3.5Å; H2499-D2528 PolarHBondContact ND1-OD2 2.97Å; H2499-D2528 VanDerWaalsContact ND1-OD2 3.09Å; D2528-L2530 HydrophobicContact CB-CD2 4.25Å; D2528-L2530 HydrophobicContact CB-CG 4.46Å; D2528-L2547 CarbonylContact O-C 3.55Å; D2528-L2547 WeakPolarHBondContact O-CA 3.43Å; D2528-V2548 PolarHBondContact N-O 2.9Å; D2528-V2548 PolarHBondContact O-N 3.14Å
2529	A	93.6	Very high	86.8	Confident	24.8 Å²	24.8	26.4 Å²	26.4	21%	0.205	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	112.5	175.9	0	0	0	0	0	110.5	N2497 W2498 S2546 L2547	N2497-A2529 WeakPolarHBondContact CB-O 3.39Å; N2497-A2529 PolarHBondContact N-O 3.06Å; N2497-A2529 PolarHBondContact ND2-O 3.45Å; W2498-A2529 HydrophobicContact CB-CB 4Å; W2498-A2529 PolarHBondContact N-O 3.03Å; W2498-A2529 PolarHBondContact O-N 2.98Å; A2529-S2546 CarbonylContact C-O 3.59Å; A2529-S2546 WeakPolarHBondContact CA-O 3.38Å; A2529-L2547 HydrophobicContact CB-CD1 4.05Å
2530	L	92.3	Very high	85.8	Confident	2.8 Å²	2.8	29.3 Å²	29.3	2%	0.015	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	138.3	-170.2	-52.5	-179.3	0	0	0	111.8	V2098 H2220 V2493 R2496 D2528 S2545 S2546 V2548	V2098-L2530 HydrophobicContact CG1-CD1 4.44Å; V2098-L2530 HydrophobicContact CG2-CD1 3.88Å; H2220-L2530 HydrophobicContact CB-CD1 3.87Å; H2220-L2530 HydrophobicContact CB-CD2 4.07Å; V2493-L2530 HydrophobicContact CG1-CB 4.29Å; V2493-L2530 HydrophobicContact CG1-CD1 4.48Å; V2493-L2530 HydrophobicContact CG1-CD2 4.27Å; V2493-L2530 HydrophobicContact CG2-CD1 4.06Å; R2496-L2530 HydrophobicContact CB-CD2 4.08Å; R2496-L2530 HydrophobicContact CG-CD2 3.84Å; D2528-L2530 HydrophobicContact CB-CD2 4.25Å; D2528-L2530 HydrophobicContact CB-CG 4.46Å; L2530-S2545 VanDerWaalsContact O-CA 3.28Å; L2530-S2545 WeakPolarHBondContact O-CA 3.36Å; L2530-S2545 WeakPolarHBondContact O-CB 3.47Å; L2530-S2546 PolarHBondContact N-O 3.31Å; L2530-S2546 PolarHBondContact O-N 3.18Å; L2530-V2548 HydrophobicContact CD1-CG2 3.93Å
2531	T	89.2	Confident	85	Confident	45.2 Å²	45.2	28.6 Å²	28.6	28%	0.277	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	133.2	168.4	-57.9	0	0	0	0	109.5	A2494 E2495 N2497	A2494-T2531 WeakPolarHBondContact CB-O 3.26Å; A2494-T2531 PolarHBondContact N-O 3.41Å; E2495-T2531 PolarHBondContact N-O 3.17Å; E2495-T2531 PolarHBondContact O-N 3.13Å; N2497-T2531 VanDerWaalsContact CG-OG1 3.28Å; N2497-T2531 PolarHBondContact ND2-N 2.77Å; N2497-T2531 PolarHBondContact ND2-OG1 3.12Å; N2497-T2531 PolarHBondContact OD1-OG1 3.31Å; N2497-T2531 VanDerWaalsContact OD1-OG1 3.04Å
2532	H	88.7	Confident	84.4	Confident	6 Å²	6	29.2 Å²	29.2	3%	0.028	15%	0.153	C	C	.	.			trans	-110.3	162.4	173.6	-59.1	-76.6	0	0	0	111	S2491 L2492 K2544 S2546	S2491-H2532 WeakPolarHBondContact CB-ND1 3.47Å; S2491-H2532 VanDerWaalsContact OG-CG 3.23Å; S2491-H2532 PolarHBondContact OG-ND1 3.13Å; L2492-H2532 PolarHBondContact O-ND1 3.02Å; H2532-K2544 HydrophobicContact CB-CB 4.04Å; H2532-K2544 HydrophobicContact CB-CD 3.92Å; H2532-K2544 HydrophobicContact CB-CG 3.93Å; H2532-K2544 WeakPolarHBondContact CB-O 3.34Å; H2532-K2544 PolarHBondContact N-O 3.08Å; H2532-S2546 VanDerWaalsContact NE2-CB 3.28Å; H2532-S2546 WeakPolarHBondContact NE2-CB 3.41Å; H2532-S2546 PolarHBondContact NE2-OG 3.1Å; H2532-S2546 VanDerWaalsContact NE2-OG 3.07Å
2533	P	83.6	Confident	84.1	Confident	31.6 Å²	31.6	31.9 Å²	31.9	21%	0.205	17%	0.167	C	C	.	.			trans	-53.1	140.5	165.7	-24.2	34.5	0	0	0	111.2	L2492 L2736	L2492-P2533 HydrophobicContact CB-CG 4.33Å; L2492-P2533 VanDerWaalsContact O-CD 3.23Å; L2492-P2533 WeakPolarHBondContact O-CD 3.35Å; P2533-L2736 HydrophobicContact CB-CD2 4.39Å; P2533-L2736 HydrophobicContact CG-CD2 4.18Å
2534	P	83.3	Confident	84	Confident	5 Å²	5	31.6 Å²	31.6	3%	0.032	16%	0.164	C	C	.	.			trans	-68.4	154.4	180	30.9	-37.8	0	0	0	111.5	L2541 L2542 P2732 L2736 I2737 P2738	P2534-L2541 HydrophobicContact CB-CD1 3.95Å; P2534-L2541 HydrophobicContact CB-CD2 4.43Å; P2534-L2541 HydrophobicContact CB-CG 4.1Å; P2534-L2541 HydrophobicContact CG-CD1 4.27Å; P2534-L2541 HydrophobicContact CG-CD2 4.48Å; P2534-L2542 CarbonylContact C-O 3.55Å; P2534-L2542 VanDerWaalsContact CA-O 3.23Å; P2534-L2542 WeakPolarHBondContact CA-O 3.41Å; P2534-L2542 VanDerWaalsContact CB-O 3.3Å; P2534-L2542 WeakPolarHBondContact CB-O 3.38Å; P2534-P2732 HydrophobicContact CG-CG 3.8Å; P2534-L2736 WeakPolarHBondContact CD-O 3.35Å; P2534-I2737 HydrophobicContact CG-CG1 4.36Å; P2534-P2738 WeakPolarHBondContact O-CD 3.3Å; P2534-P2738 VanDerWaalsContact O-CG 3.22Å; P2534-P2738 WeakPolarHBondContact O-CG 3.39Å
2535	I	80.3	Confident	83.9	Confident	27 Å²	27	30.1 Å²	30.1	14%	0.138	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	155.6	-178.4	65.6	163.7	0	0	0	112	L2542 K2544 Y2723 E2752	I2535-L2542 HydrophobicContact CG1-CB 4.26Å; I2535-L2542 PolarHBondContact N-O 3.01Å; I2535-L2542 PolarHBondContact O-N 2.89Å; I2535-K2544 HydrophobicContact CG2-CD 4.44Å; I2535-Y2723 HydrophobicContact CD1-CD1 3.9Å; I2535-Y2723 HydrophobicContact CD1-CE1 3.47Å; I2535-Y2723 VanDerWaalsContact CD1-CE1 3.48Å; I2535-Y2723 HydrophobicContact CG1-CD1 4.24Å; I2535-Y2723 HydrophobicContact CG1-CE1 4.14Å; I2535-E2752 HydrophobicContact CD1-CB 3.75Å; I2535-E2752 HydrophobicContact CD1-CG 4.04Å
2536	W	73.2	Confident	83.8	Confident	38.4 Å²	38.4	30 Å²	30	15%	0.145	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	126.6	170.6	-76.5	107.3	0	0	0	110.8	L2273 S2539 Q2540 L2541 P2738 L2740 V2747 N2750 I2927	L2273-W2536 HydrophobicContact CD1-CH2 3.73Å; L2273-W2536 HydrophobicContact CD1-CZ2 3.55Å; L2273-W2536 HydrophobicContact CD2-CZ2 4.03Å; L2273-W2536 HydrophobicContact CG-CZ2 4.4Å; W2536-S2539 WeakPolarHBondContact CZ3-O 3.29Å; W2536-Q2540 WeakPolarHBondContact CA-O 3.47Å; W2536-Q2540 VanDerWaalsContact CE3-C 3.41Å; W2536-Q2540 VanDerWaalsContact CE3-O 3.26Å; W2536-Q2540 VanDerWaalsContact CZ3-C 3.46Å; W2536-L2541 HydrophobicContact CD2-CB 4.47Å; W2536-L2541 HydrophobicContact CD2-CD1 4.06Å; W2536-L2541 HydrophobicContact CE3-CB 4.22Å; W2536-L2541 HydrophobicContact CG-CD1 4.4Å; W2536-L2541 HydrophobicContact CH2-CB 3.92Å; W2536-L2541 HydrophobicContact CH2-CD1 4.47Å; W2536-L2541 HydrophobicContact CZ2-CB 4.24Å; W2536-L2541 HydrophobicContact CZ2-CD1 4.05Å; W2536-L2541 HydrophobicContact CZ2-CG 4.49Å; W2536-L2541 HydrophobicContact CZ3-CB 3.92Å; W2536-P2738 VanDerWaalsContact CD1-O 3.29Å; W2536-P2738 PolarHBondContact NE1-O 3.14Å; W2536-L2740 HydrophobicContact CD2-CD1 3.69Å; W2536-L2740 HydrophobicContact CE3-CD1 3.68Å; W2536-L2740 HydrophobicContact CG-CD1 4.23Å; W2536-L2740 HydrophobicContact CH2-CD1 4.07Å; W2536-L2740 HydrophobicContact CZ2-CB 4.29Å; W2536-L2740 HydrophobicContact CZ2-CD1 4.06Å; W2536-L2740 HydrophobicContact CZ3-CD1 3.87Å; W2536-V2747 HydrophobicContact CB-CG1 4.04Å; W2536-V2747 HydrophobicContact CB-CG2 4.36Å; W2536-N2750 PolarHBondContact O-ND2 3.21Å; W2536-I2927 HydrophobicContact CH2-CD1 4.46Å; W2536-I2927 HydrophobicContact CH2-CG2 4.4Å; W2536-I2927 HydrophobicContact CZ3-CD1 4.15Å; W2536-I2927 HydrophobicContact CZ3-CG1 4.47Å; W2536-I2927 HydrophobicContact CZ3-CG2 4.17Å
2537	K	70.3	Confident	83.8	Confident	32.6 Å²	32.6	29.6 Å²	29.6	14%	0.142	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	134.2	172.6	-170.1	-173.8	-178	-174.4	0	109.8	S2539 Q2540 L2542 E2752 G2753 E3060	K2537-S2539 PolarHBondContact O-N 3.14Å; K2537-S2539 VanDerWaalsContact O-N 3.16Å; K2537-Q2540 PolarHBondContact N-O 3.14Å; K2537-Q2540 WeakPolarHBondContact O-CA 3.38Å; K2537-Q2540 WeakPolarHBondContact O-CB 3.21Å; K2537-Q2540 PolarHBondContact O-N 2.98Å; K2537-Q2540 VanDerWaalsContact O-O 3.09Å; K2537-L2542 HydrophobicContact CB-CD1 3.8Å; K2537-L2542 HydrophobicContact CB-CG 4.36Å; K2537-L2542 HydrophobicContact CD-CD1 4.1Å; K2537-L2542 HydrophobicContact CG-CD1 4.41Å; K2537-E2752 WeakPolarHBondContact CD-O 3.4Å; K2537-E2752 PolarHBondContact NZ-O 2.96Å; K2537-E2752 VanDerWaalsContact NZ-O 3.16Å; K2537-G2753 VanDerWaalsContact CD-O 3.26Å; K2537-G2753 WeakPolarHBondContact CD-O 3.28Å; K2537-G2753 VanDerWaalsContact CE-O 3.31Å; K2537-G2753 WeakPolarHBondContact CE-O 3.48Å; K2537-G2753 VanDerWaalsContact NZ-C 3.28Å; K2537-G2753 PolarHBondContact NZ-O 2.99Å; K2537-E3060 WeakPolarHBondContact CE-OE1 3.35Å; K2537-E3060 WeakPolarHBondContact CE-OE2 3.3Å; K2537-E3060 VanDerWaalsContact NZ-CD 3.26Å; K2537-E3060 IonicContact NZ-OE1 3.03Å; K2537-E3060 PolarHBondContact NZ-OE1 3.29Å; K2537-E3060 IonicContact NZ-OE2 2.83Å; K2537-E3060 PolarHBondContact NZ-OE2 3.42Å
2538	D	65.8	Low	83.7	Confident	70.6 Å²	70.6	28 Å²	28	38%	0.378	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.8	33.9	178.9	-65.6	-44.5	0	0	0	115.8	Q2540 V2747 Q2924	D2538-Q2540 VanDerWaalsContact C-N 3.33Å; D2538-Q2540 PolarHBondContact O-N 3.1Å; D2538-Q2540 VanDerWaalsContact O-N 3.14Å; D2538-V2747 VanDerWaalsContact N-CG1 3.32Å; D2538-V2747 PolarHBondContact N-O 2.86Å; D2538-Q2924 PolarHBondContact O-NE2 3.22Å; D2538-Q2924 VanDerWaalsContact O-NE2 3.11Å
2539	S	67.8	Low	83.6	Confident	30.6 Å²	30.6	27.8 Å²	27.8	21%	0.214	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.1	18.9	-173.2	-24.9	0	0	0	0	115.3	W2536 K2537 I2927 R2931	W2536-S2539 WeakPolarHBondContact CZ3-O 3.29Å; K2537-S2539 PolarHBondContact O-N 3.14Å; K2537-S2539 VanDerWaalsContact O-N 3.16Å; S2539-I2927 WeakPolarHBondContact O-CB 3.41Å; S2539-I2927 WeakPolarHBondContact O-CD1 3.38Å; S2539-I2927 VanDerWaalsContact O-CG2 3.24Å; S2539-I2927 WeakPolarHBondContact O-CG2 3.34Å; S2539-R2931 PolarHBondContact OG-NH1 3.39Å; S2539-R2931 VanDerWaalsContact OG-NH1 3.16Å
2540	Q	70.4	Confident	83.6	Confident	61 Å²	61	29.4 Å²	29.4	29%	0.285	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	145.2	170.6	-154.1	173.6	29.7	0	0	110.2	W2536 K2537 D2538 L2542	W2536-Q2540 WeakPolarHBondContact CA-O 3.47Å; W2536-Q2540 VanDerWaalsContact CE3-C 3.41Å; W2536-Q2540 VanDerWaalsContact CE3-O 3.26Å; W2536-Q2540 VanDerWaalsContact CZ3-C 3.46Å; K2537-Q2540 PolarHBondContact N-O 3.14Å; K2537-Q2540 WeakPolarHBondContact O-CA 3.38Å; K2537-Q2540 WeakPolarHBondContact O-CB 3.21Å; K2537-Q2540 PolarHBondContact O-N 2.98Å; K2537-Q2540 VanDerWaalsContact O-O 3.09Å; D2538-Q2540 VanDerWaalsContact C-N 3.33Å; D2538-Q2540 PolarHBondContact O-N 3.1Å; D2538-Q2540 VanDerWaalsContact O-N 3.14Å; Q2540-L2542 HydrophobicContact CB-CD2 4.35Å; Q2540-L2542 HydrophobicContact CG-CD2 4.07Å
2541	L	78	Confident	83.7	Confident	4.8 Å²	4.8	30.9 Å²	30.9	3%	0.025	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	121.6	171.6	-172.6	71.1	0	0	0	108.4	F2271 P2534 W2536 A2726 L2731 I2737	F2271-L2541 HydrophobicContact CD1-CD2 4.49Å; F2271-L2541 HydrophobicContact CE1-CB 4.26Å; F2271-L2541 HydrophobicContact CE1-CD2 4.25Å; F2271-L2541 HydrophobicContact CZ-CB 4.45Å; P2534-L2541 HydrophobicContact CB-CD1 3.95Å; P2534-L2541 HydrophobicContact CB-CD2 4.43Å; P2534-L2541 HydrophobicContact CB-CG 4.1Å; P2534-L2541 HydrophobicContact CG-CD1 4.27Å; P2534-L2541 HydrophobicContact CG-CD2 4.48Å; W2536-L2541 HydrophobicContact CD2-CB 4.47Å; W2536-L2541 HydrophobicContact CD2-CD1 4.06Å; W2536-L2541 HydrophobicContact CE3-CB 4.22Å; W2536-L2541 HydrophobicContact CG-CD1 4.4Å; W2536-L2541 HydrophobicContact CH2-CB 3.92Å; W2536-L2541 HydrophobicContact CH2-CD1 4.47Å; W2536-L2541 HydrophobicContact CZ2-CB 4.24Å; W2536-L2541 HydrophobicContact CZ2-CD1 4.05Å; W2536-L2541 HydrophobicContact CZ2-CG 4.49Å; W2536-L2541 HydrophobicContact CZ3-CB 3.92Å; L2541-A2726 HydrophobicContact CB-CB 4.32Å; L2541-A2726 HydrophobicContact CD2-CB 4.12Å; L2541-A2726 HydrophobicContact CG-CB 4.13Å; L2541-A2726 VanDerWaalsContact O-CB 3.3Å; L2541-A2726 WeakPolarHBondContact O-CB 3.34Å; L2541-A2726 PolarHBondContact O-N 3.2Å; L2541-L2731 HydrophobicContact CD2-CD2 3.62Å; L2541-I2737 HydrophobicContact CD1-CG2 4.08Å; L2541-I2737 HydrophobicContact CD2-CG2 4.15Å
2542	L	80.8	Confident	83.8	Confident	16 Å²	16	30.8 Å²	30.8	8%	0.084	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	129.4	-179.8	-56.2	-178.1	0	0	0	109.8	P2534 I2535 K2537 Q2540 K2544 Y2723 E2724 P2725	P2534-L2542 CarbonylContact C-O 3.55Å; P2534-L2542 VanDerWaalsContact CA-O 3.23Å; P2534-L2542 WeakPolarHBondContact CA-O 3.41Å; P2534-L2542 VanDerWaalsContact CB-O 3.3Å; P2534-L2542 WeakPolarHBondContact CB-O 3.38Å; I2535-L2542 HydrophobicContact CG1-CB 4.26Å; I2535-L2542 PolarHBondContact N-O 3.01Å; I2535-L2542 PolarHBondContact O-N 2.89Å; K2537-L2542 HydrophobicContact CB-CD1 3.8Å; K2537-L2542 HydrophobicContact CB-CG 4.36Å; K2537-L2542 HydrophobicContact CD-CD1 4.1Å; K2537-L2542 HydrophobicContact CG-CD1 4.41Å; Q2540-L2542 HydrophobicContact CB-CD2 4.35Å; Q2540-L2542 HydrophobicContact CG-CD2 4.07Å; L2542-K2544 PolarHBondContact O-N 2.96Å; L2542-Y2723 HydrophobicContact CB-CD1 4.41Å; L2542-E2724 CarbonylContact C-O 3.51Å; L2542-E2724 WeakPolarHBondContact CA-O 3.31Å; L2542-P2725 HydrophobicContact CD2-CB 4.38Å; L2542-P2725 HydrophobicContact CD2-CG 4.17Å
2543	N	86.7	Confident	83.9	Confident	58.4 Å²	58.4	31.8 Å²	31.8	31%	0.312	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	127.4	165	-72.6	-13.6	0	0	0	108.2	Y2723 E2724 A2726	N2543-Y2723 WeakPolarHBondContact O-CA 3.43Å; N2543-E2724 PolarHBondContact N-O 3.05Å; N2543-E2724 PolarHBondContact O-N 3.01Å; N2543-E2724 VanDerWaalsContact O-N 3.11Å; N2543-A2726 VanDerWaalsContact OD1-CB 3.26Å; N2543-A2726 WeakPolarHBondContact OD1-CB 3.36Å
2544	K	89.1	Confident	84.2	Confident	5.2 Å²	5.2	30.9 Å²	30.9	2%	0.023	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	126.3	176.8	179.2	-176.7	179.1	-179	0	109.3	I2487 S2491 H2532 I2535 L2542 I2721 Y2723 E2752	I2487-K2544 VanDerWaalsContact CG2-NZ 3.35Å; I2487-K2544 PolarHBondContact O-NZ 2.94Å; S2491-K2544 WeakPolarHBondContact OG-CE 3.4Å; S2491-K2544 PolarHBondContact OG-NZ 3.23Å; H2532-K2544 HydrophobicContact CB-CB 4.04Å; H2532-K2544 HydrophobicContact CB-CD 3.92Å; H2532-K2544 HydrophobicContact CB-CG 3.93Å; H2532-K2544 WeakPolarHBondContact CB-O 3.34Å; H2532-K2544 PolarHBondContact N-O 3.08Å; I2535-K2544 HydrophobicContact CG2-CD 4.44Å; L2542-K2544 PolarHBondContact O-N 2.96Å; K2544-I2721 HydrophobicContact CG-CG2 4.38Å; K2544-Y2723 HydrophobicContact CB-CD1 4.03Å; K2544-Y2723 HydrophobicContact CB-CE1 3.86Å; K2544-Y2723 HydrophobicContact CD-CE1 3.92Å; K2544-Y2723 HydrophobicContact CG-CD1 4.17Å; K2544-Y2723 HydrophobicContact CG-CE1 3.58Å; K2544-E2752 WeakPolarHBondContact CE-OE1 3.31Å; K2544-E2752 WeakPolarHBondContact CE-OE2 3.42Å; K2544-E2752 IonicContact NZ-OE1 3.36Å; K2544-E2752 PolarHBondContact NZ-OE1 3Å; K2544-E2752 IonicContact NZ-OE2 3.65Å; K2544-E2752 PolarHBondContact NZ-OE2 2.84Å
2545	S	91.2	Very high	84.6	Confident	43.8 Å²	43.8	30.6 Å²	30.6	31%	0.306	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	148.8	172.1	54	0	0	0	0	110	L2530 I2721 H2722	L2530-S2545 VanDerWaalsContact O-CA 3.28Å; L2530-S2545 WeakPolarHBondContact O-CA 3.36Å; L2530-S2545 WeakPolarHBondContact O-CB 3.47Å; S2545-I2721 WeakPolarHBondContact O-CA 3.48Å; S2545-H2722 PolarHBondContact N-O 2.92Å; S2545-H2722 PolarHBondContact O-N 3.23Å; S2545-H2722 PolarHBondContact OG-O 3.14Å
2546	S	92.5	Very high	85.1	Confident	5.6 Å²	5.6	31.8 Å²	31.8	4%	0.039	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	157.9	169.6	72.8	0	0	0	0	111.7	A2529 L2530 H2532 Y2720	A2529-S2546 CarbonylContact C-O 3.59Å; A2529-S2546 WeakPolarHBondContact CA-O 3.38Å; L2530-S2546 PolarHBondContact N-O 3.31Å; L2530-S2546 PolarHBondContact O-N 3.18Å; H2532-S2546 VanDerWaalsContact NE2-CB 3.28Å; H2532-S2546 WeakPolarHBondContact NE2-CB 3.41Å; H2532-S2546 PolarHBondContact NE2-OG 3.1Å; H2532-S2546 VanDerWaalsContact NE2-OG 3.07Å; S2546-Y2720 CarbonylContact C-O 3.54Å; S2546-Y2720 VanDerWaalsContact CA-O 3.26Å; S2546-Y2720 WeakPolarHBondContact CA-O 3.33Å
2547	L	93.1	Very high	86	Confident	55.4 Å²	55.4	30 Å²	30	29%	0.29	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	116.6	171	-173.1	70.2	0	0	0	106.6	L2527 D2528 A2529 F2719 Y2720	L2527-L2547 HydrophobicContact CB-CD1 4.33Å; L2527-L2547 HydrophobicContact CD1-CD1 3.95Å; L2527-L2547 HydrophobicContact CD1-CD2 3.94Å; L2527-L2547 HydrophobicContact CD1-CG 3.65Å; L2527-L2547 HydrophobicContact CD2-CD1 4.06Å; L2527-L2547 HydrophobicContact CD2-CD2 4.19Å; L2527-L2547 HydrophobicContact CD2-CG 4.28Å; L2527-L2547 HydrophobicContact CG-CD1 3.77Å; L2527-L2547 HydrophobicContact CG-CD2 4.39Å; L2527-L2547 HydrophobicContact CG-CG 4.05Å; D2528-L2547 CarbonylContact O-C 3.55Å; D2528-L2547 WeakPolarHBondContact O-CA 3.43Å; A2529-L2547 HydrophobicContact CB-CD1 4.05Å; L2547-F2719 WeakPolarHBondContact O-CA 3.38Å; L2547-Y2720 HydrophobicContact CB-CD1 4.42Å; L2547-Y2720 HydrophobicContact CD2-CD1 4.47Å; L2547-Y2720 PolarHBondContact N-O 3.08Å; L2547-Y2720 PolarHBondContact O-N 3.05Å
2548	V	93.2	Very high	86.9	Confident	17.2 Å²	17.2	28.4 Å²	28.4	10%	0.104	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	120.9	-178.7	-179.3	0	0	0	0	107.8	V2098 L2527 D2528 L2530 V2718 F2719	V2098-V2548 HydrophobicContact CG1-CG1 4.3Å; V2098-V2548 HydrophobicContact CG1-CG2 3.74Å; L2527-V2548 CarbonylContact C-O 3.49Å; L2527-V2548 WeakPolarHBondContact CA-O 3.37Å; D2528-V2548 PolarHBondContact N-O 2.9Å; D2528-V2548 PolarHBondContact O-N 3.14Å; L2530-V2548 HydrophobicContact CD1-CG2 3.93Å; V2548-V2718 CarbonylContact C-O 3.6Å; V2548-V2718 WeakPolarHBondContact CA-O 3.5Å; V2548-F2719 HydrophobicContact CG1-CD1 4.19Å; V2548-F2719 HydrophobicContact CG1-CE1 3.85Å; V2548-F2719 HydrophobicContact CG2-CD1 4.3Å
2549	G	93	Very high	88	Confident	2.6 Å²	2.6	25.3 Å²	25.3	3%	0.027	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	138.9	-176.4	0	0	0	0	0	112.3	K2526 E2717 V2718	K2526-G2549 CarbonylContact O-C 3.56Å; K2526-G2549 VanDerWaalsContact O-CA 3.26Å; K2526-G2549 WeakPolarHBondContact O-CA 3.34Å; G2549-E2717 CarbonylContact O-C 3.6Å; G2549-E2717 VanDerWaalsContact O-CA 3.31Å; G2549-E2717 WeakPolarHBondContact O-CA 3.31Å; G2549-V2718 PolarHBondContact N-O 3.29Å; G2549-V2718 PolarHBondContact O-N 3.06Å
2550	H	93.7	Very high	88.4	Confident	56.6 Å²	56.6	25.4 Å²	25.4	26%	0.262	13%	0.134	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	122.3	175	-173	84.4	0	0	0	109.4	A2525 K2526 E2552 C2716 E2717	A2525-H2550 CarbonylContact C-O 3.5Å; A2525-H2550 WeakPolarHBondContact CA-O 3.41Å; K2526-H2550 PolarHBondContact N-O 3.06Å; K2526-H2550 PolarHBondContact O-N 3.14Å; H2550-E2552 VanDerWaalsContact CD2-CG 3.46Å; H2550-E2552 WeakPolarHBondContact CD2-CG 3.43Å; H2550-E2552 IonicContact CD2-OE1 2.93Å; H2550-E2552 PolarHBondContact CD2-OE1 3.02Å; H2550-E2552 VanDerWaalsContact NE2-CG 3.31Å; H2550-E2552 WeakPolarHBondContact NE2-CG 3.46Å; H2550-E2552 IonicContact NE2-OE1 3.45Å; H2550-C2716 CarbonylContact C-O 3.59Å; H2550-C2716 WeakPolarHBondContact CA-O 3.22Å; H2550-E2717 IonicContact CE1-OE1 2.99Å; H2550-E2717 PolarHBondContact CE1-OE1 3.1Å; H2550-E2717 VanDerWaalsContact CE1-OE1 3.32Å; H2550-E2717 VanDerWaalsContact ND1-CG 3.33Å; H2550-E2717 WeakPolarHBondContact ND1-CG 3.32Å; H2550-E2717 IonicContact ND1-OE1 3.37Å; H2550-E2717 PolarHBondContact ND1-OE1 3.11Å
2551	L	93.4	Very high	88.1	Confident	34.8 Å²	34.8	23.8 Å²	23.8	18%	0.182	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	118.5	-178.7	-61.4	89.6	0	0	0	109.8	A2522 R2524 A2525 M2554 S2715 C2716 V2718	A2522-L2551 HydrophobicContact CB-CB 4.46Å; A2522-L2551 HydrophobicContact CB-CD2 4.43Å; R2524-L2551 CarbonylContact O-C 3.59Å; R2524-L2551 WeakPolarHBondContact O-CA 3.33Å; A2525-L2551 HydrophobicContact CB-CB 4.45Å; A2525-L2551 HydrophobicContact CB-CD2 4.04Å; A2525-L2551 HydrophobicContact CB-CG 3.83Å; L2551-M2554 HydrophobicContact CB-CB 4.34Å; L2551-M2554 HydrophobicContact CB-SD 4.3Å; L2551-M2554 HydrophobicContact CD2-CE 4.12Å; L2551-M2554 HydrophobicContact CD2-CG 4.4Å; L2551-M2554 HydrophobicContact CD2-SD 3.93Å; L2551-S2715 WeakPolarHBondContact O-CA 3.32Å; L2551-C2716 HydrophobicContact CB-CB 4.22Å; L2551-C2716 HydrophobicContact CD1-CB 4.29Å; L2551-C2716 PolarHBondContact N-O 3.12Å; L2551-C2716 PolarHBondContact O-N 3.14Å; L2551-C2716 VanDerWaalsContact O-N 3.1Å; L2551-V2718 HydrophobicContact CD1-CG2 3.76Å
2552	E	91.3	Very high	86.8	Confident	43 Å²	43	29.8 Å²	29.8	20%	0.201	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	134.1	-176.5	-64.6	165.1	-159.1	0	0	110.3	A2523 R2524 K2526 H2550 M2554	A2523-E2552 PolarHBondContact N-O 3.03Å; A2523-E2552 VanDerWaalsContact N-O 3.11Å; R2524-E2552 HydrophobicContact CB-CB 4.21Å; R2524-E2552 WeakPolarHBondContact CB-OE2 3.41Å; R2524-E2552 VanDerWaalsContact CD-OE2 3.23Å; R2524-E2552 WeakPolarHBondContact CD-OE2 3.41Å; R2524-E2552 PolarHBondContact N-O 3.39Å; R2524-E2552 IonicContact NE-OE2 3.2Å; R2524-E2552 PolarHBondContact NE-OE2 2.79Å; R2524-E2552 PolarHBondContact O-N 3.35Å; K2526-E2552 WeakPolarHBondContact CE-OE1 3.43Å; K2526-E2552 IonicContact NZ-OE1 2.87Å; K2526-E2552 PolarHBondContact NZ-OE1 3.12Å; K2526-E2552 IonicContact NZ-OE2 3.76Å; H2550-E2552 VanDerWaalsContact CD2-CG 3.46Å; H2550-E2552 WeakPolarHBondContact CD2-CG 3.43Å; H2550-E2552 IonicContact CD2-OE1 2.93Å; H2550-E2552 PolarHBondContact CD2-OE1 3.02Å; H2550-E2552 VanDerWaalsContact NE2-CG 3.31Å; H2550-E2552 WeakPolarHBondContact NE2-CG 3.46Å; H2550-E2552 IonicContact NE2-OE1 3.45Å; E2552-M2554 VanDerWaalsContact C-N 3.28Å; E2552-M2554 PolarHBondContact O-N 3.02Å; E2552-M2554 VanDerWaalsContact O-N 3.14Å
2553	C	90.2	Very high	84.9	Confident	28.2 Å²	28.2	32.6 Å²	32.6	19%	0.191	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	50.6	41.3	179.3	-72	0	0	0	0	113.5	A2523 Q2555 D2598 R2713 C2714	A2523-C2553 HydrophobicContact CB-CB 3.9Å; C2553-Q2555 WeakPolarHBondContact O-CG 3.32Å; C2553-Q2555 PolarHBondContact O-NE2 3.13Å; C2553-Q2555 VanDerWaalsContact O-NE2 3.1Å; C2553-D2598 HydrophobicContact CB-CB 4.44Å; C2553-D2598 VanDerWaalsContact SG-CG 3.52Å; C2553-D2598 PolarHBondContact SG-OD2 3.13Å; C2553-D2598 VanDerWaalsContact SG-OD2 3.4Å; C2553-R2713 HydrophobicContact CB-CB 4.26Å; C2553-R2713 HydrophobicContact CB-CG 4Å; C2553-C2714 CarbonylContact C-O 3.55Å; C2553-C2714 PolarHBondContact N-O 2.99Å
2554	M	91.6	Very high	82.5	Confident	11.2 Å²	11.2	33.6 Å²	33.6	6%	0.055	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	141	175.1	-168.5	176.9	106	0	0	111	V2520 S2521 A2522 L2551 E2552 Y2556 S2712 R2713 C2714 C2716 H2761	V2520-M2554 HydrophobicContact CG1-CE 3.32Å; V2520-M2554 HydrophobicContact CG1-CG 4.06Å; V2520-M2554 HydrophobicContact CG1-SD 3.86Å; S2521-M2554 CarbonylContact O-C 3.55Å; S2521-M2554 VanDerWaalsContact O-CA 3.28Å; S2521-M2554 WeakPolarHBondContact O-CA 3.38Å; S2521-M2554 WeakPolarHBondContact O-CG 3.4Å; A2522-M2554 HydrophobicContact CB-CB 4.19Å; A2522-M2554 HydrophobicContact CB-CG 4.31Å; L2551-M2554 HydrophobicContact CB-CB 4.34Å; L2551-M2554 HydrophobicContact CB-SD 4.3Å; L2551-M2554 HydrophobicContact CD2-CE 4.12Å; L2551-M2554 HydrophobicContact CD2-CG 4.4Å; L2551-M2554 HydrophobicContact CD2-SD 3.93Å; E2552-M2554 VanDerWaalsContact C-N 3.28Å; E2552-M2554 PolarHBondContact O-N 3.02Å; E2552-M2554 VanDerWaalsContact O-N 3.14Å; M2554-Y2556 HydrophobicContact CE-CD2 4.39Å; M2554-Y2556 HydrophobicContact CE-CE1 4.34Å; M2554-Y2556 HydrophobicContact CE-CE2 3.84Å; M2554-Y2556 VanDerWaalsContact CE-CE2 3.44Å; M2554-Y2556 VanDerWaalsContact CE-CZ 3.49Å; M2554-Y2556 WeakPolarHBondContact CE-OH 3.4Å; M2554-Y2556 HydrophobicContact CG-CE2 4.14Å; M2554-Y2556 HydrophobicContact SD-CE2 4.29Å; M2554-S2712 VanDerWaalsContact O-O 3.1Å; M2554-R2713 CarbonylContact O-C 3.56Å; M2554-R2713 VanDerWaalsContact O-CA 3.26Å; M2554-R2713 WeakPolarHBondContact O-CA 3.28Å; M2554-C2714 WeakPolarHBondContact CB-O 3.37Å; M2554-C2714 VanDerWaalsContact CE-SG 3.56Å; M2554-C2714 PolarHBondContact N-O 3.13Å; M2554-C2714 PolarHBondContact O-N 3.08Å; M2554-C2714 PolarHBondContact O-SG 3.34Å; M2554-C2716 HydrophobicContact CE-CB 3.52Å; M2554-C2716 HydrophobicContact SD-CB 3.62Å; M2554-C2716 WeakPolarHBondContact SD-CB 3.46Å; M2554-H2761 WeakPolarHBondContact CE-CE1 3.43Å
2555	Q	90.5	Very high	79.7	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	151.3	-169.9	-64	156.8	46.6	0	0	109.5	V2520 S2521 C2553 Y2557 D2595 V2596 R2709 R2713	V2520-Q2555 WeakPolarHBondContact CA-O 3.29Å; S2521-Q2555 PolarHBondContact N-O 3.1Å; S2521-Q2555 PolarHBondContact O-N 3.11Å; C2553-Q2555 WeakPolarHBondContact O-CG 3.32Å; C2553-Q2555 PolarHBondContact O-NE2 3.13Å; C2553-Q2555 VanDerWaalsContact O-NE2 3.1Å; Q2555-Y2557 HydrophobicContact CB-CD2 4.43Å; Q2555-Y2557 HydrophobicContact CB-CE2 3.73Å; Q2555-Y2557 PolarHBondContact OE1-OH 3.13Å; Q2555-D2595 PolarHBondContact OE1-O 3.1Å; Q2555-V2596 PolarHBondContact NE2-O 3.12Å; Q2555-V2596 VanDerWaalsContact NE2-O 3.11Å; Q2555-R2709 VanDerWaalsContact CD-NH1 3.28Å; Q2555-R2713 HydrophobicContact CG-CB 4.42Å; Q2555-R2713 HydrophobicContact CG-CG 3.72Å
2556	Y	92.3	Very high	76.8	Confident	51.8 Å²	51.8	44.2 Å²	44.2	20%	0.203	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	136.6	175.9	-63.1	-109.3	0	0	0	110	V2518 L2519 V2520 M2554 R2709 M2710 I2711 H2761	V2518-Y2556 HydrophobicContact CG1-CD1 4.38Å; L2519-Y2556 CarbonylContact O-C 3.41Å; L2519-Y2556 WeakPolarHBondContact O-CA 3.37Å; V2520-Y2556 HydrophobicContact CB-CD1 4.33Å; V2520-Y2556 HydrophobicContact CB-CE1 4.3Å; V2520-Y2556 HydrophobicContact CG1-CD1 4.07Å; V2520-Y2556 HydrophobicContact CG1-CD2 4.47Å; V2520-Y2556 HydrophobicContact CG1-CE1 3.74Å; V2520-Y2556 HydrophobicContact CG1-CE2 4.34Å; V2520-Y2556 HydrophobicContact CG1-CG 4.42Å; V2520-Y2556 HydrophobicContact CG2-CD1 3.71Å; V2520-Y2556 HydrophobicContact CG2-CE1 3.68Å; M2554-Y2556 HydrophobicContact CE-CD2 4.39Å; M2554-Y2556 HydrophobicContact CE-CE1 4.34Å; M2554-Y2556 HydrophobicContact CE-CE2 3.84Å; M2554-Y2556 VanDerWaalsContact CE-CE2 3.44Å; M2554-Y2556 VanDerWaalsContact CE-CZ 3.49Å; M2554-Y2556 WeakPolarHBondContact CE-OH 3.4Å; M2554-Y2556 HydrophobicContact CG-CE2 4.14Å; M2554-Y2556 HydrophobicContact SD-CE2 4.29Å; Y2556-R2709 CarbonylContact O-C 3.55Å; Y2556-M2710 PolarHBondContact O-N 3Å; Y2556-I2711 HydrophobicContact CD1-CD1 4.38Å; Y2556-I2711 HydrophobicContact CD2-CB 3.81Å; Y2556-I2711 HydrophobicContact CD2-CD1 3.68Å; Y2556-I2711 HydrophobicContact CD2-CG1 4.09Å; Y2556-I2711 HydrophobicContact CD2-CG2 4.13Å; Y2556-I2711 HydrophobicContact CE2-CD1 4.17Å; Y2556-I2711 HydrophobicContact CG-CB 4.27Å; Y2556-I2711 HydrophobicContact CG-CD1 3.91Å; Y2556-I2711 HydrophobicContact CG-CG1 4.24Å; Y2556-I2711 PolarHBondContact N-O 2.76Å; Y2556-I2711 PolarHBondContact O-N 3.04Å; Y2556-I2711 VanDerWaalsContact O-N 3.13Å; Y2556-H2761 PolarHBondContact OH-CE1 2.84Å; Y2556-H2761 PolarHBondContact OH-NE2 3.1Å; Y2556-H2761 VanDerWaalsContact OH-NE2 3.16Å
2557	Y	91.1	Very high	73.9	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	150.7	178.8	-56.9	-105.3	0	0	0	109.8	V2518 L2519 Q2555 L2591 D2595 V2628 Q2708 R2709	V2518-Y2557 CarbonylContact C-O 3.58Å; V2518-Y2557 VanDerWaalsContact CA-O 3.28Å; V2518-Y2557 WeakPolarHBondContact CA-O 3.26Å; V2518-Y2557 WeakPolarHBondContact CG1-O 3.27Å; L2519-Y2557 PolarHBondContact N-O 3.26Å; L2519-Y2557 PolarHBondContact O-N 2.99Å; Q2555-Y2557 HydrophobicContact CB-CD2 4.43Å; Q2555-Y2557 HydrophobicContact CB-CE2 3.73Å; Q2555-Y2557 PolarHBondContact OE1-OH 3.13Å; Y2557-L2591 HydrophobicContact CD1-CD2 4.12Å; Y2557-L2591 HydrophobicContact CD2-CD1 3.53Å; Y2557-L2591 VanDerWaalsContact CD2-CD1 3.48Å; Y2557-L2591 HydrophobicContact CD2-CD2 4.35Å; Y2557-L2591 HydrophobicContact CE1-CD1 4.41Å; Y2557-L2591 HydrophobicContact CE1-CD2 3.99Å; Y2557-L2591 HydrophobicContact CE2-CD1 3.32Å; Y2557-L2591 HydrophobicContact CE2-CD2 4.2Å; Y2557-L2591 HydrophobicContact CE2-CG 4.39Å; Y2557-L2591 HydrophobicContact CG-CD1 4.18Å; Y2557-L2591 HydrophobicContact CG-CD2 4.3Å; Y2557-D2595 PolarHBondContact OH-O 2.91Å; Y2557-V2628 HydrophobicContact CD1-CG2 3.86Å; Y2557-V2628 VanDerWaalsContact CD1-CG2 3.44Å; Y2557-V2628 HydrophobicContact CE1-CG2 3.59Å; Y2557-V2628 VanDerWaalsContact CE1-CG2 3.41Å; Y2557-Q2708 CarbonylContact C-O 3.58Å; Y2557-Q2708 WeakPolarHBondContact CA-O 3.38Å; Y2557-R2709 HydrophobicContact CD1-CB 3.84Å; Y2557-R2709 HydrophobicContact CD1-CG 4.26Å; Y2557-R2709 HydrophobicContact CE1-CB 3.88Å; Y2557-R2709 HydrophobicContact CE1-CG 4.18Å; Y2557-R2709 VanDerWaalsContact CE1-CZ 3.48Å; Y2557-R2709 HydrophobicContact CE2-CG 4.38Å; Y2557-R2709 HydrophobicContact CG-CB 4.43Å; Y2557-R2709 HydrophobicContact CG-CG 4.46Å; Y2557-R2709 VanDerWaalsContact CZ-NE 3.31Å; Y2557-R2709 VanDerWaalsContact CZ-NH1 3.25Å; Y2557-R2709 VanDerWaalsContact OH-CZ 3.28Å; Y2557-R2709 PolarHBondContact OH-NE 3Å; Y2557-R2709 PolarHBondContact OH-NH1 3.07Å; Y2557-R2709 VanDerWaalsContact OH-NH1 3.09Å; Y2557-R2709 PolarHBondContact OH-NH2 3.16Å
2558	A	89.9	Confident	71	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	160.2	171	0	0	0	0	0	112.4	Y2517 V2518 V2560 L2707 Q2708 M2710 Q2772 M2775	Y2517-A2558 WeakPolarHBondContact O-CA 3.31Å; Y2517-A2558 VanDerWaalsContact O-CB 3.31Å; Y2517-A2558 WeakPolarHBondContact O-CB 3.41Å; V2518-A2558 HydrophobicContact CB-CB 4.43Å; V2518-A2558 HydrophobicContact CG2-CB 4.1Å; A2558-V2560 PolarHBondContact O-N 3.14Å; A2558-L2707 CarbonylContact O-C 3.49Å; A2558-L2707 WeakPolarHBondContact O-CA 3.35Å; A2558-Q2708 PolarHBondContact N-O 2.86Å; A2558-Q2708 PolarHBondContact O-N 3.26Å; A2558-M2710 HydrophobicContact CB-CE 4Å; A2558-M2710 HydrophobicContact CB-CG 4Å; A2558-M2710 HydrophobicContact CB-SD 3.28Å; A2558-M2710 WeakPolarHBondContact CB-SD 3.28Å; A2558-Q2772 HydrophobicContact CB-CG 4.16Å; A2558-M2775 HydrophobicContact CB-CE 3.84Å; A2558-M2775 HydrophobicContact CB-SD 4.13Å
2559	T	87.4	Confident	68.1	Low	5.4 Å²	5.4	58.5 Å²	58.5	3%	0.033	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	134.1	175.4	53.8	0	0	0	0	111.8	G2516 Y2517 G2561 I2705 Q2706 L2707 M2775	G2516-T2559 VanDerWaalsContact CA-OG1 3.26Å; G2516-T2559 WeakPolarHBondContact CA-OG1 3.28Å; Y2517-T2559 HydrophobicContact CD1-CG2 3.75Å; Y2517-T2559 HydrophobicContact CD2-CG2 4.26Å; Y2517-T2559 HydrophobicContact CE1-CG2 3.64Å; Y2517-T2559 HydrophobicContact CE2-CG2 4.17Å; Y2517-T2559 HydrophobicContact CG-CG2 4.06Å; Y2517-T2559 PolarHBondContact N-OG1 2.9Å; Y2517-T2559 VanDerWaalsContact N-OG1 3.09Å; Y2517-T2559 PolarHBondContact O-N 3.09Å; Y2517-T2559 VanDerWaalsContact O-N 3.14Å; Y2517-T2559 PolarHBondContact O-OG1 3.24Å; T2559-G2561 PolarHBondContact O-N 3.44Å; T2559-I2705 HydrophobicContact CG2-CG2 3.55Å; T2559-I2705 VanDerWaalsContact CG2-CG2 3.45Å; T2559-Q2706 CarbonylContact C-O 3.54Å; T2559-Q2706 WeakPolarHBondContact CA-O 3.37Å; T2559-L2707 HydrophobicContact CG2-CD2 3.97Å; T2559-M2775 WeakPolarHBondContact O-CE 3.47Å; T2559-M2775 VanDerWaalsContact OG1-CE 3.32Å; T2559-M2775 WeakPolarHBondContact OG1-CE 3.23Å
2560	V	76.5	Confident	65.4	Low	32.4 Å²	32.4	62.4 Å²	62.4	20%	0.196	35%	0.351	C	S	.	.			trans	-94.7	107.9	172	-170.5	0	0	0	0	108.4	A2558 Q2562 V2627 Q2706 Q2708	A2558-V2560 PolarHBondContact O-N 3.14Å; V2560-Q2562 PolarHBondContact O-N 3.36Å; V2560-V2627 HydrophobicContact CG2-CG2 4.46Å; V2560-Q2706 HydrophobicContact CB-CB 4.39Å; V2560-Q2706 HydrophobicContact CB-CG 4.27Å; V2560-Q2706 HydrophobicContact CG2-CG 4.24Å; V2560-Q2706 PolarHBondContact N-O 3.04Å; V2560-Q2708 HydrophobicContact CG2-CB 3.43Å; V2560-Q2708 VanDerWaalsContact CG2-CB 3.46Å; V2560-Q2708 HydrophobicContact CG2-CG 4.38Å
2561	G	64.2	Low	62.7	Low	27 Å²	27	69.5 Å²	69.5	28%	0.278	39%	0.385	S	S	.	.	S	Bend	trans	-51.5	139	179.3	0	0	0	0	0	111.4	T2559 V2563 L2771	T2559-G2561 PolarHBondContact O-N 3.44Å; G2561-V2563 PolarHBondContact O-N 2.98Å; G2561-V2563 VanDerWaalsContact O-N 3.12Å; G2561-L2771 WeakPolarHBondContact O-CD2 3.47Å
2562	Q	49.9	Very low	60	Low	130.4 Å²	130.4	73.2 Å²	73.2	61%	0.609	41%	0.413	S	S	*	.			trans	-75.1	124	172.5	-94.2	173	-32.7	0	0	109.8	A2515 V2560 S2564 R2703 L2771	A2515-Q2562 HydrophobicContact CB-CB 4.26Å; A2515-Q2562 HydrophobicContact CB-CG 4.32Å; V2560-Q2562 PolarHBondContact O-N 3.36Å; Q2562-S2564 PolarHBondContact O-N 2.95Å; Q2562-R2703 VanDerWaalsContact CD-NH1 3.26Å; Q2562-R2703 VanDerWaalsContact OE1-CD 3.3Å; Q2562-L2771 HydrophobicContact CG-CD1 4.14Å; Q2562-L2771 HydrophobicContact CG-CD2 4.06Å
2563	V	42.5	Very low	57.2	Low	76.4 Å²	76.4	73.3 Å²	73.3	46%	0.463	43%	0.427	S	S	.	.			trans	-72.5	93	162.5	-178.3	0	0	0	0	107.7	A2515 G2561 N2565 T2586 I2705	A2515-V2563 HydrophobicContact CB-CB 4.36Å; A2515-V2563 WeakPolarHBondContact O-CB 3.33Å; A2515-V2563 WeakPolarHBondContact O-CG2 3.42Å; A2515-V2563 PolarHBondContact O-N 2.87Å; G2561-V2563 PolarHBondContact O-N 2.98Å; G2561-V2563 VanDerWaalsContact O-N 3.12Å; V2563-N2565 VanDerWaalsContact C-N 3.27Å; V2563-N2565 PolarHBondContact O-N 3.39Å; V2563-N2565 VanDerWaalsContact O-N 3.16Å; V2563-T2586 HydrophobicContact CG1-CG2 4.29Å; V2563-I2705 HydrophobicContact CG2-CD1 3.88Å; V2563-I2705 HydrophobicContact CG2-CG1 4.05Å; V2563-I2705 HydrophobicContact CG2-CG2 4.22Å
2564	S	34.7	Very low	54.5	Low	77.6 Å²	77.6	76.6 Å²	76.6	54%	0.543	45%	0.45	S	S	.	.			trans	-69.9	114.7	168.9	54.3	0	0	0	0	109.1	Q2562 L2566 D2567	Q2562-S2564 PolarHBondContact O-N 2.95Å; S2564-L2566 VanDerWaalsContact C-N 3.26Å; S2564-L2566 PolarHBondContact O-N 3.29Å; S2564-D2567 WeakPolarHBondContact CB-OD2 3.35Å; S2564-D2567 PolarHBondContact OG-OD2 3.43Å
2565	N	30.5	Very low	51.8	Low	126 Å²	126	81.7 Å²	81.7	67%	0.674	48%	0.482	S	S	*	.			trans	-44.6	101.9	160.9	-86.7	1.6	0	0	0	107.7	V2563 D2567	V2563-N2565 VanDerWaalsContact C-N 3.27Å; V2563-N2565 PolarHBondContact O-N 3.39Å; V2563-N2565 VanDerWaalsContact O-N 3.16Å; N2565-D2567 PolarHBondContact O-N 3.1Å
2566	L	31.9	Very low	49	Very low	145.6 Å²	145.6	89 Å²	89	76%	0.762	51%	0.513	S	S	*	.			trans	-73.4	118.1	171.1	-115.5	70.4	0	0	0	108.3	S2564 C2568	S2564-L2566 VanDerWaalsContact C-N 3.26Å; S2564-L2566 PolarHBondContact O-N 3.29Å; L2566-C2568 VanDerWaalsContact C-N 3.28Å; L2566-C2568 PolarHBondContact O-N 2.91Å; L2566-C2568 PolarHBondContact O-SG 3.4Å
2567	D	29.8	Very low	46.3	Very low	136.4 Å²	136.4	91.8 Å²	91.8	73%	0.729	53%	0.531	S	S	*	.			trans	-59.9	95.9	168	-59	-56.9	0	0	0	108.5	S2564 N2565 D2569	S2564-D2567 WeakPolarHBondContact CB-OD2 3.35Å; S2564-D2567 PolarHBondContact OG-OD2 3.43Å; N2565-D2567 PolarHBondContact O-N 3.1Å; D2567-D2569 VanDerWaalsContact C-N 3.26Å; D2567-D2569 PolarHBondContact O-N 3.01Å; D2567-D2569 VanDerWaalsContact O-N 3.12Å
2568	C	33.4	Very low	43.6	Very low	79.6 Å²	79.6	100.9 Å²	100.9	54%	0.538	57%	0.567	S	S	.	*			trans	-92.7	73.2	-178.4	39.7	0	0	0	0	110.4	L2566 S2570	L2566-C2568 VanDerWaalsContact C-N 3.28Å; L2566-C2568 PolarHBondContact O-N 2.91Å; L2566-C2568 PolarHBondContact O-SG 3.4Å; C2568-S2570 PolarHBondContact O-N 3.03Å; C2568-S2570 VanDerWaalsContact O-N 3.09Å
2569	D	31.8	Very low	40.9	Very low	163.2 Å²	163.2	106.8 Å²	106.8	87%	0.873	60%	0.597	S	S	*	*			trans	-70	61.3	165	-74	-24.1	0	0	0	110.5	D2567	D2567-D2569 VanDerWaalsContact C-N 3.26Å; D2567-D2569 PolarHBondContact O-N 3.01Å; D2567-D2569 VanDerWaalsContact O-N 3.12Å
2570	S	37	Very low	38.3	Very low	83.8 Å²	83.8	112.1 Å²	112.1	59%	0.586	62%	0.62	S	S	*	*			trans	-152.2	110.1	176.7	-31.1	0	0	0	0	109.2	C2568 S2572 G2573	C2568-S2570 PolarHBondContact O-N 3.03Å; C2568-S2570 VanDerWaalsContact O-N 3.09Å; S2570-S2572 PolarHBondContact O-N 3.16Å; S2570-G2573 PolarHBondContact O-N 3.33Å
2571	E	36.9	Very low	36.3	Very low	206.4 Å²	206.4	115.5 Å²	115.5	96%	0.964	64%	0.637	S	S	*	*			trans	-66.4	21.9	-172.8	-61.7	-174.8	130.6	0	0	114.5	G2573	E2571-G2573 VanDerWaalsContact C-N 3.31Å; E2571-G2573 PolarHBondContact O-N 2.92Å; E2571-G2573 VanDerWaalsContact O-N 3.14Å
2572	S	35.8	Very low	35.1	Very low	111.8 Å²	111.8	117.8 Å²	117.8	78%	0.782	65%	0.646	S	S	*	*			trans	-108	44.1	177.7	-43.8	0	0	0	0	112.9	S2570 S2574	S2570-S2572 PolarHBondContact O-N 3.16Å; S2572-S2574 PolarHBondContact O-N 3.37Å
2573	G	32.4	Very low	34.5	Very low	46.4 Å²	46.4	116.2 Å²	116.2	48%	0.478	64%	0.641	S	S	.	*			trans	-81	28.9	-179.4	0	0	0	0	0	117.1	S2570 E2571 V2575 F2576	S2570-G2573 PolarHBondContact O-N 3.33Å; E2571-G2573 VanDerWaalsContact C-N 3.31Å; E2571-G2573 PolarHBondContact O-N 2.92Å; E2571-G2573 VanDerWaalsContact O-N 3.14Å; G2573-V2575 VanDerWaalsContact C-N 3.29Å; G2573-V2575 PolarHBondContact O-N 3.04Å; G2573-V2575 VanDerWaalsContact O-N 3.15Å; G2573-F2576 PolarHBondContact O-N 3.21Å
2574	S	33.6	Very low	34.5	Very low	97.2 Å²	97.2	118.3 Å²	118.3	68%	0.68	66%	0.656	S	S	*	*			trans	-66	31.8	176.3	59.9	0	0	0	0	114.9	S2572 F2576	S2572-S2574 PolarHBondContact O-N 3.37Å; S2574-F2576 VanDerWaalsContact C-N 3.33Å; S2574-F2576 PolarHBondContact O-N 3.12Å
2575	V	35.3	Very low	35	Very low	118.8 Å²	118.8	121.7 Å²	121.7	72%	0.72	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.1	-10.6	170.6	178.5	0	0	0	0	111.8	G2573 I2577	G2573-V2575 VanDerWaalsContact C-N 3.29Å; G2573-V2575 PolarHBondContact O-N 3.04Å; G2573-V2575 VanDerWaalsContact O-N 3.15Å; V2575-I2577 VanDerWaalsContact C-N 3.34Å; V2575-I2577 HydrophobicContact CG1-CD1 4.04Å; V2575-I2577 HydrophobicContact CG1-CG1 3.84Å; V2575-I2577 PolarHBondContact O-N 2.78Å
2576	F	32.2	Very low	35.9	Very low	151.8 Å²	151.8	117.4 Å²	117.4	67%	0.666	64%	0.642	S	S	*	*	H	α-helix	trans	-80.9	-4.2	-177.5	-107.2	-90.8	0	0	0	113.8	G2573 S2574 Y2578 L2579 F2580	G2573-F2576 PolarHBondContact O-N 3.21Å; S2574-F2576 VanDerWaalsContact C-N 3.33Å; S2574-F2576 PolarHBondContact O-N 3.12Å; F2576-Y2578 VanDerWaalsContact C-N 3.28Å; F2576-Y2578 HydrophobicContact CB-CD2 4.11Å; F2576-Y2578 HydrophobicContact CB-CE2 4.04Å; F2576-Y2578 HydrophobicContact CD1-CE2 4.27Å; F2576-Y2578 HydrophobicContact CG-CE2 4.45Å; F2576-Y2578 PolarHBondContact O-N 2.9Å; F2576-L2579 PolarHBondContact O-N 2.86Å; F2576-F2580 AromaticContact CD1-CD2 3.8Å; F2576-F2580 HydrophobicContact CD1-CD2 3.8Å; F2576-F2580 AromaticContact CD1-CE2 3.9Å; F2576-F2580 HydrophobicContact CD1-CE2 4.1Å; F2576-F2580 AromaticContact CE1-CD2 3.86Å; F2576-F2580 HydrophobicContact CE1-CD2 3.86Å; F2576-F2580 AromaticContact CE1-CE2 3.68Å; F2576-F2580 HydrophobicContact CE1-CE2 3.68Å; F2576-F2580 PolarHBondContact O-N 2.95Å; F2576-F2580 VanDerWaalsContact O-N 3.14Å
2577	I	35.8	Very low	37.3	Very low	112 Å²	112	115.2 Å²	115.2	57%	0.574	64%	0.636	S	S	*	*	H	α-helix	trans	-74.5	-14.5	-177.9	-63	176.3	0	0	0	111.6	V2575 L2579 F2580 N2581	V2575-I2577 VanDerWaalsContact C-N 3.34Å; V2575-I2577 HydrophobicContact CG1-CD1 4.04Å; V2575-I2577 HydrophobicContact CG1-CG1 3.84Å; V2575-I2577 PolarHBondContact O-N 2.78Å; I2577-L2579 VanDerWaalsContact C-N 3.29Å; I2577-L2579 HydrophobicContact CG2-CD1 4.46Å; I2577-L2579 PolarHBondContact O-N 3.19Å; I2577-F2580 PolarHBondContact O-N 3.16Å; I2577-N2581 VanDerWaalsContact O-CG 3.26Å; I2577-N2581 PolarHBondContact O-N 2.98Å; I2577-N2581 PolarHBondContact O-ND2 3.3Å
2578	Y	33.4	Very low	39.3	Very low	191.2 Å²	191.2	109.6 Å²	109.6	75%	0.75	61%	0.606	S	S	*	*	H	α-helix	trans	-75.6	1.5	175.6	-78.2	-78.4	0	0	0	113	F2576 F2580	F2576-Y2578 VanDerWaalsContact C-N 3.28Å; F2576-Y2578 HydrophobicContact CB-CD2 4.11Å; F2576-Y2578 HydrophobicContact CB-CE2 4.04Å; F2576-Y2578 HydrophobicContact CD1-CE2 4.27Å; F2576-Y2578 HydrophobicContact CG-CE2 4.45Å; F2576-Y2578 PolarHBondContact O-N 2.9Å; Y2578-F2580 VanDerWaalsContact O-CD2 3.31Å; Y2578-F2580 WeakPolarHBondContact O-CD2 3.29Å; Y2578-F2580 PolarHBondContact O-N 2.77Å
2579	L	33.2	Very low	41.5	Very low	123.4 Å²	123.4	108.1 Å²	108.1	65%	0.646	59%	0.591	S	S	*	*	H	α-helix	trans	-89.6	1.2	-178.8	-149.5	73.1	0	0	0	112.9	F2576 I2577 N2581 V2582	F2576-L2579 PolarHBondContact O-N 2.86Å; I2577-L2579 VanDerWaalsContact C-N 3.29Å; I2577-L2579 HydrophobicContact CG2-CD1 4.46Å; I2577-L2579 PolarHBondContact O-N 3.19Å; L2579-N2581 PolarHBondContact O-N 3.22Å; L2579-V2582 PolarHBondContact O-N 2.79Å
2580	F	33.7	Very low	44.1	Very low	116.2 Å²	116.2	102.9 Å²	102.9	51%	0.51	56%	0.56	S	S	.	*			trans	-93	1.2	-178.4	-97	-84.9	0	0	0	115.2	F2576 I2577 Y2578 V2582 L2583	F2576-F2580 AromaticContact CD1-CD2 3.8Å; F2576-F2580 HydrophobicContact CD1-CD2 3.8Å; F2576-F2580 AromaticContact CD1-CE2 3.9Å; F2576-F2580 HydrophobicContact CD1-CE2 4.1Å; F2576-F2580 AromaticContact CE1-CD2 3.86Å; F2576-F2580 HydrophobicContact CE1-CD2 3.86Å; F2576-F2580 AromaticContact CE1-CE2 3.68Å; F2576-F2580 HydrophobicContact CE1-CE2 3.68Å; F2576-F2580 PolarHBondContact O-N 2.95Å; F2576-F2580 VanDerWaalsContact O-N 3.14Å; I2577-F2580 PolarHBondContact O-N 3.16Å; Y2578-F2580 VanDerWaalsContact O-CD2 3.31Å; Y2578-F2580 WeakPolarHBondContact O-CD2 3.29Å; Y2578-F2580 PolarHBondContact O-N 2.77Å; F2580-V2582 PolarHBondContact O-N 3.12Å; F2580-V2582 VanDerWaalsContact O-N 3.14Å; F2580-L2583 HydrophobicContact CD1-CB 4.31Å; F2580-L2583 HydrophobicContact CD1-CD2 4.37Å; F2580-L2583 HydrophobicContact CE1-CD2 4.01Å; F2580-L2583 HydrophobicContact CZ-CD2 4.05Å; F2580-L2583 PolarHBondContact O-N 2.9Å
2581	N	34.5	Very low	46.4	Very low	103.8 Å²	103.8	99.3 Å²	99.3	56%	0.555	53%	0.533	S	S	*	.	S	Bend	trans	-65.9	94	161.6	-73.1	-19.8	0	0	0	110.4	A2515 I2577 L2579 L2583	A2515-N2581 HydrophobicContact CB-CB 3.82Å; I2577-N2581 VanDerWaalsContact O-CG 3.26Å; I2577-N2581 PolarHBondContact O-N 2.98Å; I2577-N2581 PolarHBondContact O-ND2 3.3Å; L2579-N2581 PolarHBondContact O-N 3.22Å; N2581-L2583 PolarHBondContact O-N 3.16Å; N2581-L2583 VanDerWaalsContact O-N 3.07Å
2582	V	39	Very low	48.7	Very low	76.4 Å²	76.4	92.2 Å²	92.2	46%	0.463	51%	0.507	S	S	.	.			trans	-77.9	67.7	171.5	-174.6	0	0	0	0	108.8	A2515 L2579 F2580 P2584 T2586 I2705	A2515-V2582 HydrophobicContact CB-CB 4.36Å; A2515-V2582 HydrophobicContact CB-CG2 4.44Å; L2579-V2582 PolarHBondContact O-N 2.79Å; F2580-V2582 PolarHBondContact O-N 3.12Å; F2580-V2582 VanDerWaalsContact O-N 3.14Å; V2582-P2584 VanDerWaalsContact O-CD 3.29Å; V2582-P2584 WeakPolarHBondContact O-CD 3.38Å; V2582-T2586 HydrophobicContact CG1-CG2 4.05Å; V2582-T2586 WeakPolarHBondContact CG1-OG1 3.29Å; V2582-I2705 HydrophobicContact CG1-CD1 3.96Å; V2582-I2705 HydrophobicContact CG1-CG1 4.36Å
2583	L	36.8	Very low	50.8	Low	97 Å²	97	89.9 Å²	89.9	51%	0.508	49%	0.488	S	S	.	.			trans	-72.7	130.7	175.6	-107.4	80.7	0	0	0	108.9	F2580 N2581 E2585 T2586	F2580-L2583 HydrophobicContact CD1-CB 4.31Å; F2580-L2583 HydrophobicContact CD1-CD2 4.37Å; F2580-L2583 HydrophobicContact CE1-CD2 4.01Å; F2580-L2583 HydrophobicContact CZ-CD2 4.05Å; F2580-L2583 PolarHBondContact O-N 2.9Å; N2581-L2583 PolarHBondContact O-N 3.16Å; N2581-L2583 VanDerWaalsContact O-N 3.07Å; L2583-E2585 PolarHBondContact O-N 3.17Å; L2583-T2586 HydrophobicContact CB-CG2 4.17Å; L2583-T2586 PolarHBondContact O-N 3.15Å; L2583-T2586 VanDerWaalsContact O-N 3.08Å; L2583-T2586 PolarHBondContact O-OG1 3.06Å
2584	P	42	Very low	52.8	Low	119.6 Å²	119.6	89.4 Å²	89.4	78%	0.777	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-20.8	175.8	6.6	-8.3	0	0	0	112.7	V2582 T2586	V2582-P2584 VanDerWaalsContact O-CD 3.29Å; V2582-P2584 WeakPolarHBondContact O-CD 3.38Å; P2584-T2586 PolarHBondContact O-N 3.09Å
2585	E	45.3	Very low	55	Low	149.6 Å²	149.6	86.1 Å²	86.1	70%	0.699	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	32	-179.8	-56.6	-165.5	162.7	0	0	114	K2510 L2583 P2587	K2510-E2585 WeakPolarHBondContact CE-OE1 3.41Å; K2510-E2585 IonicContact NZ-OE1 4Å; K2510-E2585 PolarHBondContact NZ-OE1 3.17Å; K2510-E2585 IonicContact NZ-OE2 3.5Å; K2510-E2585 PolarHBondContact NZ-OE2 3.05Å; L2583-E2585 PolarHBondContact O-N 3.17Å; E2585-P2587 WeakPolarHBondContact O-CD 3.29Å; E2585-P2587 VanDerWaalsContact O-N 3.14Å
2586	T	50.7	Low	57.3	Low	35.8 Å²	35.8	80.4 Å²	80.4	22%	0.22	42%	0.42	C	S	.	.	S	Bend	trans	-61.2	127.6	166	50.8	0	0	0	0	109.3	V2563 V2582 L2583 P2584 D2588 I2702 I2705	V2563-T2586 HydrophobicContact CG1-CG2 4.29Å; V2582-T2586 HydrophobicContact CG1-CG2 4.05Å; V2582-T2586 WeakPolarHBondContact CG1-OG1 3.29Å; L2583-T2586 HydrophobicContact CB-CG2 4.17Å; L2583-T2586 PolarHBondContact O-N 3.15Å; L2583-T2586 VanDerWaalsContact O-N 3.08Å; L2583-T2586 PolarHBondContact O-OG1 3.06Å; P2584-T2586 PolarHBondContact O-N 3.09Å; T2586-D2588 PolarHBondContact O-N 3.17Å; T2586-D2588 VanDerWaalsContact O-N 3.13Å; T2586-I2702 HydrophobicContact CG2-CG2 4.05Å; T2586-I2705 HydrophobicContact CG2-CD1 4.44Å; T2586-I2705 VanDerWaalsContact OG1-CD1 3.26Å; T2586-I2705 WeakPolarHBondContact OG1-CD1 3.38Å
2587	P	59.8	Low	59.5	Low	98.6 Å²	98.6	74.1 Å²	74.1	64%	0.64	39%	0.394	S	S	*	.	P	Polyproline II helix	trans	-64.3	123.3	-170.5	23.8	-33.4	0	0	0	111.1	E2585 Q2589	E2585-P2587 WeakPolarHBondContact O-CD 3.29Å; E2585-P2587 VanDerWaalsContact O-N 3.14Å; P2587-Q2589 PolarHBondContact O-N 3.12Å
2588	D	72.4	Confident	61.3	Low	19.8 Å²	19.8	69.9 Å²	69.9	11%	0.106	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-58.3	126.9	-179.1	-72.6	-29	0	0	0	111.2	R2237 M2508 K2510 Y2517 T2586 W2590	R2237-D2588 IonicContact CZ-OD2 3.25Å; R2237-D2588 VanDerWaalsContact CZ-OD2 3.23Å; R2237-D2588 IonicContact NE-OD2 3.01Å; R2237-D2588 PolarHBondContact NE-OD2 2.88Å; R2237-D2588 VanDerWaalsContact NE-OD2 3.08Å; R2237-D2588 IonicContact NH2-OD2 3.1Å; R2237-D2588 PolarHBondContact NH2-OD2 3.07Å; R2237-D2588 VanDerWaalsContact NH2-OD2 3.09Å; M2508-D2588 HydrophobicContact CE-CB 3.98Å; M2508-D2588 WeakPolarHBondContact CE-OD1 3.11Å; M2508-D2588 VanDerWaalsContact CE-OD2 3.29Å; M2508-D2588 WeakPolarHBondContact CE-OD2 3.33Å; M2508-D2588 HydrophobicContact SD-CB 3.91Å; K2510-D2588 VanDerWaalsContact CE-CG 3.4Å; K2510-D2588 WeakPolarHBondContact CE-OD1 3.33Å; K2510-D2588 WeakPolarHBondContact CE-OD2 3.03Å; K2510-D2588 VanDerWaalsContact NZ-CG 3.29Å; K2510-D2588 IonicContact NZ-OD1 2.98Å; K2510-D2588 PolarHBondContact NZ-OD1 3.14Å; K2510-D2588 IonicContact NZ-OD2 3.4Å; K2510-D2588 PolarHBondContact NZ-OD2 3.09Å; Y2517-D2588 HydrophobicContact CE1-CB 4.46Å; Y2517-D2588 WeakPolarHBondContact CE1-OD1 3.26Å; T2586-D2588 PolarHBondContact O-N 3.17Å; T2586-D2588 VanDerWaalsContact O-N 3.13Å; D2588-W2590 PolarHBondContact O-N 2.98Å
2589	Q	79.4	Confident	62.6	Low	47.6 Å²	47.6	65.1 Å²	65.1	22%	0.222	35%	0.354	C	S	.	.			trans	-94.2	111.6	-175.4	-174.6	179.7	-12.3	0	0	111.2	Y2517 L2519 P2587 T2629 I2705 L2707	Y2517-Q2589 WeakPolarHBondContact OH-CA 3.44Å; Y2517-Q2589 WeakPolarHBondContact OH-CB 3.35Å; Y2517-Q2589 PolarHBondContact OH-N 3.2Å; Y2517-Q2589 VanDerWaalsContact OH-N 3.1Å; Y2517-Q2589 PolarHBondContact OH-O 3.18Å; L2519-Q2589 VanDerWaalsContact CD1-O 3.28Å; L2519-Q2589 WeakPolarHBondContact CD1-O 3.24Å; P2587-Q2589 PolarHBondContact O-N 3.12Å; Q2589-T2629 VanDerWaalsContact NE2-CG2 3.27Å; Q2589-T2629 PolarHBondContact NE2-OG1 2.84Å; Q2589-T2629 PolarHBondContact OE1-OG1 3.02Å; Q2589-I2705 PolarHBondContact OE1-O 2.86Å; Q2589-L2707 HydrophobicContact CB-CD1 4.21Å; Q2589-L2707 HydrophobicContact CG-CD1 4.17Å; Q2589-L2707 WeakPolarHBondContact O-CD1 3.37Å
2590	W	86.8	Confident	63.8	Low	54.4 Å²	54.4	63.6 Å²	63.6	21%	0.206	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-77.5	153.8	167.9	-61.8	96.7	0	0	0	111.6	K2235 M2236 R2237 Q2506 M2508 L2519 D2588	K2235-W2590 HydrophobicContact CB-CD2 4.26Å; K2235-W2590 HydrophobicContact CB-CE3 4.1Å; K2235-W2590 HydrophobicContact CB-CH2 3.99Å; K2235-W2590 HydrophobicContact CB-CZ2 4.06Å; K2235-W2590 HydrophobicContact CB-CZ3 3.94Å; K2235-W2590 HydrophobicContact CD-CB 4.38Å; K2235-W2590 HydrophobicContact CD-CD2 4.04Å; K2235-W2590 HydrophobicContact CD-CE3 4.22Å; K2235-W2590 HydrophobicContact CD-CG 4.02Å; K2235-W2590 HydrophobicContact CG-CD2 4.12Å; K2235-W2590 HydrophobicContact CG-CE3 3.85Å; K2235-W2590 HydrophobicContact CG-CZ3 4.12Å; M2236-W2590 WeakPolarHBondContact O-CH2 3.49Å; R2237-W2590 HydrophobicContact CG-CH2 3.97Å; R2237-W2590 HydrophobicContact CG-CZ2 3.61Å; Q2506-W2590 HydrophobicContact CB-CE3 3.94Å; Q2506-W2590 HydrophobicContact CB-CZ3 3.97Å; M2508-W2590 HydrophobicContact CB-CH2 3.84Å; M2508-W2590 HydrophobicContact CB-CZ3 4.03Å; M2508-W2590 HydrophobicContact CE-CH2 4.06Å; M2508-W2590 HydrophobicContact CE-CZ2 3.77Å; L2519-W2590 HydrophobicContact CD1-CE3 4.1Å; L2519-W2590 HydrophobicContact CD1-CZ3 4.43Å; L2519-W2590 HydrophobicContact CD2-CE3 3.89Å; L2519-W2590 HydrophobicContact CD2-CZ3 3.84Å; D2588-W2590 PolarHBondContact O-N 2.98Å
2591	L	86.1	Confident	64.5	Low	6.6 Å²	6.6	65.1 Å²	65.1	4%	0.035	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-74.2	150.5	175.1	-63.9	163	0	0	0	110.7	Q2506 L2519 Y2557 D2595 V2596 V2628 L2707	Q2506-L2591 PolarHBondContact NE2-O 3.18Å; L2519-L2591 HydrophobicContact CB-CD1 4.45Å; L2519-L2591 HydrophobicContact CD1-CD1 4.4Å; L2519-L2591 HydrophobicContact CD1-CG 4.16Å; L2519-L2591 HydrophobicContact CD2-CD1 3.69Å; L2519-L2591 HydrophobicContact CD2-CG 4.05Å; Y2557-L2591 HydrophobicContact CD1-CD2 4.12Å; Y2557-L2591 HydrophobicContact CD2-CD1 3.53Å; Y2557-L2591 VanDerWaalsContact CD2-CD1 3.48Å; Y2557-L2591 HydrophobicContact CD2-CD2 4.35Å; Y2557-L2591 HydrophobicContact CE1-CD1 4.41Å; Y2557-L2591 HydrophobicContact CE1-CD2 3.99Å; Y2557-L2591 HydrophobicContact CE2-CD1 3.32Å; Y2557-L2591 HydrophobicContact CE2-CD2 4.2Å; Y2557-L2591 HydrophobicContact CE2-CG 4.39Å; Y2557-L2591 HydrophobicContact CG-CD1 4.18Å; Y2557-L2591 HydrophobicContact CG-CD2 4.3Å; L2591-D2595 HydrophobicContact CB-CB 4.33Å; L2591-D2595 HydrophobicContact CD2-CB 4.37Å; L2591-V2596 HydrophobicContact CB-CG2 3.72Å; L2591-V2596 HydrophobicContact CD1-CG2 3.91Å; L2591-V2596 HydrophobicContact CG-CG2 4.45Å; L2591-V2628 HydrophobicContact CD2-CG1 4.27Å; L2591-V2628 HydrophobicContact CD2-CG2 4.45Å; L2591-L2707 HydrophobicContact CD2-CD1 4.24Å
2592	S	83.6	Confident	65.1	Low	57.4 Å²	57.4	67.5 Å²	67.5	40%	0.401	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-70.4	154.5	169.8	83.2	0	0	0	0	110.3	A2594 D2595 V2596	S2592-A2594 PolarHBondContact O-N 3Å; S2592-A2594 VanDerWaalsContact O-N 3.14Å; S2592-A2594 PolarHBondContact OG-N 2.95Å; S2592-D2595 VanDerWaalsContact CB-OD2 3.3Å; S2592-D2595 WeakPolarHBondContact CB-OD2 3.38Å; S2592-D2595 PolarHBondContact N-OD2 2.95Å; S2592-D2595 VanDerWaalsContact N-OD2 3.15Å; S2592-D2595 PolarHBondContact O-N 3.3Å; S2592-D2595 VanDerWaalsContact O-N 3.14Å; S2592-D2595 VanDerWaalsContact OG-CG 3.28Å; S2592-D2595 PolarHBondContact OG-N 3.01Å; S2592-D2595 PolarHBondContact OG-OD2 3.11Å; S2592-V2596 PolarHBondContact O-N 3Å
2593	T	80.3	Confident	65.2	Low	64.2 Å²	64.2	68.1 Å²	68.1	39%	0.394	37%	0.367	S	S	.	.	H	α-helix	trans	-57.2	-31.8	174.7	-34.2	0	0	0	0	111.7	E2233 N2504 D2595 V2596 S2597	E2233-T2593 VanDerWaalsContact CD-CG2 3.41Å; E2233-T2593 VanDerWaalsContact CD-OG1 3.31Å; E2233-T2593 WeakPolarHBondContact OE1-CB 3.44Å; E2233-T2593 VanDerWaalsContact OE1-CG2 3.22Å; E2233-T2593 WeakPolarHBondContact OE1-CG2 3.29Å; E2233-T2593 PolarHBondContact OE1-OG1 2.82Å; E2233-T2593 WeakPolarHBondContact OE2-CG2 3.31Å; E2233-T2593 PolarHBondContact OE2-OG1 2.84Å; N2504-T2593 VanDerWaalsContact ND2-CG2 3.35Å; N2504-T2593 WeakPolarHBondContact ND2-CG2 3.33Å; T2593-D2595 VanDerWaalsContact C-N 3.33Å; T2593-D2595 PolarHBondContact O-N 2.98Å; T2593-V2596 PolarHBondContact O-N 3Å; T2593-S2597 WeakPolarHBondContact O-CB 3.36Å; T2593-S2597 PolarHBondContact O-N 2.96Å; T2593-S2597 PolarHBondContact O-OG 3.12Å; T2593-S2597 VanDerWaalsContact O-OG 3.05Å
2594	A	75.5	Confident	65.7	Low	36.8 Å²	36.8	71.8 Å²	71.8	30%	0.304	39%	0.386	S	S	.	.	H	α-helix	trans	-67.7	-29.6	178.3	0	0	0	0	0	114	S2592 W2599 E2616	S2592-A2594 PolarHBondContact O-N 3Å; S2592-A2594 VanDerWaalsContact O-N 3.14Å; S2592-A2594 PolarHBondContact OG-N 2.95Å; A2594-W2599 HydrophobicContact CB-CZ2 3.91Å; A2594-W2599 PolarHBondContact O-NE1 2.86Å; A2594-E2616 HydrophobicContact CB-CB 4.23Å
2595	D	79.8	Confident	65.7	Low	26.6 Å²	26.6	72.5 Å²	72.5	14%	0.142	38%	0.383	C	S	.	.	H	α-helix	trans	-77.8	-39.3	177.9	-60.5	-60.6	0	0	0	111.7	Q2555 Y2557 L2591 S2592 T2593 C2620 R2713	Q2555-D2595 PolarHBondContact OE1-O 3.1Å; Y2557-D2595 PolarHBondContact OH-O 2.91Å; L2591-D2595 HydrophobicContact CB-CB 4.33Å; L2591-D2595 HydrophobicContact CD2-CB 4.37Å; S2592-D2595 VanDerWaalsContact CB-OD2 3.3Å; S2592-D2595 WeakPolarHBondContact CB-OD2 3.38Å; S2592-D2595 PolarHBondContact N-OD2 2.95Å; S2592-D2595 VanDerWaalsContact N-OD2 3.15Å; S2592-D2595 PolarHBondContact O-N 3.3Å; S2592-D2595 VanDerWaalsContact O-N 3.14Å; S2592-D2595 VanDerWaalsContact OG-CG 3.28Å; S2592-D2595 PolarHBondContact OG-N 3.01Å; S2592-D2595 PolarHBondContact OG-OD2 3.11Å; T2593-D2595 VanDerWaalsContact C-N 3.33Å; T2593-D2595 PolarHBondContact O-N 2.98Å; D2595-C2620 VanDerWaalsContact OD1-CA 3.32Å; D2595-C2620 WeakPolarHBondContact OD1-CA 3.47Å; D2595-C2620 VanDerWaalsContact OD1-CB 3.28Å; D2595-C2620 WeakPolarHBondContact OD1-CB 3Å; D2595-R2713 PolarHBondContact O-NH2 3.16Å
2596	V	82.5	Confident	65.6	Low	0 Å²	0	67 Å²	67	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-77.9	-47	-177	179.1	0	0	0	0	111.9	N2504 Q2506 A2522 Q2555 L2591 S2592 T2593	N2504-V2596 HydrophobicContact CB-CG1 3.93Å; Q2506-V2596 HydrophobicContact CG-CG2 4.07Å; A2522-V2596 VanDerWaalsContact O-CG1 3.25Å; A2522-V2596 WeakPolarHBondContact O-CG1 3.32Å; Q2555-V2596 PolarHBondContact NE2-O 3.12Å; Q2555-V2596 VanDerWaalsContact NE2-O 3.11Å; L2591-V2596 HydrophobicContact CB-CG2 3.72Å; L2591-V2596 HydrophobicContact CD1-CG2 3.91Å; L2591-V2596 HydrophobicContact CG-CG2 4.45Å; S2592-V2596 PolarHBondContact O-N 3Å; T2593-V2596 PolarHBondContact O-N 3Å
2597	S	78.2	Confident	65.2	Low	18.4 Å²	18.4	71.2 Å²	71.2	13%	0.129	38%	0.384	C	S	.	.	S	Bend	trans	-59.8	152.5	-171.6	56.2	0	0	0	0	113.7	N2504 T2593 W2599 R2713	N2504-S2597 WeakPolarHBondContact OD1-CA 3.39Å; T2593-S2597 WeakPolarHBondContact O-CB 3.36Å; T2593-S2597 PolarHBondContact O-N 2.96Å; T2593-S2597 PolarHBondContact O-OG 3.12Å; T2593-S2597 VanDerWaalsContact O-OG 3.05Å; S2597-W2599 VanDerWaalsContact O-CD1 3.29Å; S2597-W2599 PolarHBondContact OG-NE1 3Å; S2597-R2713 PolarHBondContact O-NH2 3.26Å
2598	D	73.5	Confident	64.6	Low	25 Å²	25	72.8 Å²	72.8	13%	0.134	38%	0.383	C	S	.	.			trans	-88.2	118.9	169.8	-165.5	-10.8	0	0	0	110.6	A2523 C2553 T2600 H2601	A2523-D2598 HydrophobicContact CB-CB 3.8Å; C2553-D2598 HydrophobicContact CB-CB 4.44Å; C2553-D2598 VanDerWaalsContact SG-CG 3.52Å; C2553-D2598 PolarHBondContact SG-OD2 3.13Å; C2553-D2598 VanDerWaalsContact SG-OD2 3.4Å; D2598-T2600 VanDerWaalsContact C-N 3.29Å; D2598-T2600 VanDerWaalsContact CG-OG1 3.23Å; D2598-T2600 PolarHBondContact O-N 2.88Å; D2598-T2600 WeakPolarHBondContact OD1-CB 3.32Å; D2598-T2600 WeakPolarHBondContact OD1-CG2 3.37Å; D2598-T2600 PolarHBondContact OD1-N 2.97Å; D2598-T2600 PolarHBondContact OD1-OG1 3Å; D2598-T2600 PolarHBondContact OD2-OG1 3.06Å; D2598-T2600 VanDerWaalsContact OD2-OG1 3.06Å; D2598-H2601 IonicContact OD2-CD2 3.88Å
2599	W	62.5	Low	63.3	Low	89.8 Å²	89.8	77.1 Å²	77.1	34%	0.34	41%	0.406	S	S	.	.	S	Bend	trans	-83.2	-20.2	179.4	-69	81.3	0	0	0	112.6	A2594 S2597 H2601 H2602 N2603 L2611 R2622	A2594-W2599 HydrophobicContact CB-CZ2 3.91Å; A2594-W2599 PolarHBondContact O-NE1 2.86Å; S2597-W2599 VanDerWaalsContact O-CD1 3.29Å; S2597-W2599 PolarHBondContact OG-NE1 3Å; W2599-H2601 VanDerWaalsContact C-N 3.3Å; W2599-H2601 PolarHBondContact O-N 3.29Å; W2599-H2602 PolarHBondContact O-N 3.11Å; W2599-N2603 PolarHBondContact O-N 2.78Å; W2599-L2611 HydrophobicContact CB-CD1 4.11Å; W2599-L2611 HydrophobicContact CD2-CD2 4.48Å; W2599-L2611 HydrophobicContact CE3-CD2 3.94Å; W2599-L2611 HydrophobicContact CZ3-CD2 4.46Å; W2599-R2622 VanDerWaalsContact NE1-NH2 3.18Å
2600	T	57.1	Low	61.6	Low	91 Å²	91	78.2 Å²	78.2	56%	0.558	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-36.4	-177.8	64.4	0	0	0	0	112	D2598 H2602	D2598-T2600 VanDerWaalsContact C-N 3.29Å; D2598-T2600 VanDerWaalsContact CG-OG1 3.23Å; D2598-T2600 PolarHBondContact O-N 2.88Å; D2598-T2600 WeakPolarHBondContact OD1-CB 3.32Å; D2598-T2600 WeakPolarHBondContact OD1-CG2 3.37Å; D2598-T2600 PolarHBondContact OD1-N 2.97Å; D2598-T2600 PolarHBondContact OD1-OG1 3Å; D2598-T2600 PolarHBondContact OD2-OG1 3.06Å; D2598-T2600 VanDerWaalsContact OD2-OG1 3.06Å; T2600-H2602 VanDerWaalsContact C-N 3.34Å; T2600-H2602 PolarHBondContact O-N 3.1Å
2601	H	48.1	Very low	59.5	Low	149.6 Å²	149.6	80.1 Å²	80.1	69%	0.693	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-15.7	178.8	-81.4	-73.9	0	0	0	114.8	D2598 W2599	D2598-H2601 IonicContact OD2-CD2 3.88Å; W2599-H2601 VanDerWaalsContact C-N 3.3Å; W2599-H2601 PolarHBondContact O-N 3.29Å
2602	H	46.8	Very low	57.6	Low	153.4 Å²	153.4	83.2 Å²	83.2	71%	0.71	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	-9.5	-174.6	-80.7	-56.5	0	0	0	115	W2599 T2600	W2599-H2602 PolarHBondContact O-N 3.11Å; T2600-H2602 VanDerWaalsContact C-N 3.34Å; T2600-H2602 PolarHBondContact O-N 3.1Å
2603	N	41.6	Very low	55.5	Low	89.6 Å²	89.6	83.6 Å²	83.6	48%	0.479	47%	0.473	S	S	.	.			trans	-148.6	107.8	174	-118.9	-32.9	0	0	0	112.2	W2599 N2605 A2606	W2599-N2603 PolarHBondContact O-N 2.78Å; N2603-N2605 PolarHBondContact O-N 3.03Å; N2603-N2605 VanDerWaalsContact O-N 3.1Å; N2603-N2605 PolarHBondContact OD1-N 2.79Å; N2603-N2605 VanDerWaalsContact OD1-N 3.07Å; N2603-N2605 PolarHBondContact OD1-ND2 2.86Å; N2603-A2606 HydrophobicContact CB-CB 3.97Å; N2603-A2606 WeakPolarHBondContact O-CB 3.44Å; N2603-A2606 PolarHBondContact O-N 3.06Å
2604	L	46.6	Very low	53.7	Low	174.2 Å²	174.2	87.3 Å²	87.3	91%	0.912	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-5.6	171.7	-77.5	162.7	0	0	0	114.3
2605	N	43.1	Very low	52.1	Low	134.4 Å²	134.4	91 Å²	91	72%	0.719	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115	11.8	178.2	-55.9	-43.2	0	0	0	112.8	N2603 D2607 E2608	N2603-N2605 PolarHBondContact O-N 3.03Å; N2603-N2605 VanDerWaalsContact O-N 3.1Å; N2603-N2605 PolarHBondContact OD1-N 2.79Å; N2603-N2605 VanDerWaalsContact OD1-N 3.07Å; N2603-N2605 PolarHBondContact OD1-ND2 2.86Å; N2605-D2607 VanDerWaalsContact C-N 3.27Å; N2605-D2607 PolarHBondContact O-N 3.09Å; N2605-E2608 PolarHBondContact O-N 3.14Å
2606	A	43.5	Very low	50.3	Low	34.6 Å²	34.6	96.5 Å²	96.5	29%	0.286	53%	0.525	S	S	.	.			trans	-84.2	33.9	179.9	0	0	0	0	0	111.8	N2603 E2608 D2609 A2610 L2611	N2603-A2606 HydrophobicContact CB-CB 3.97Å; N2603-A2606 WeakPolarHBondContact O-CB 3.44Å; N2603-A2606 PolarHBondContact O-N 3.06Å; A2606-E2608 PolarHBondContact O-N 3.08Å; A2606-D2609 PolarHBondContact O-N 2.89Å; A2606-D2609 VanDerWaalsContact O-N 3.14Å; A2606-A2610 HydrophobicContact CB-CB 4.44Å; A2606-A2610 PolarHBondContact O-N 3.3Å; A2606-L2611 HydrophobicContact CB-CD1 4.45Å; A2606-L2611 HydrophobicContact CB-CG 4.24Å
2607	D	42	Very low	48.5	Very low	122.4 Å²	122.4	98.7 Å²	98.7	66%	0.655	54%	0.538	S	S	*	.			trans	-61.8	103.5	173.6	-82.7	-34.4	0	0	0	111.6	N2605 D2609 A2610 L2611	N2605-D2607 VanDerWaalsContact C-N 3.27Å; N2605-D2607 PolarHBondContact O-N 3.09Å; D2607-D2609 VanDerWaalsContact C-N 3.32Å; D2607-D2609 PolarHBondContact O-N 2.87Å; D2607-A2610 HydrophobicContact CB-CB 3.97Å; D2607-A2610 WeakPolarHBondContact O-CB 3.22Å; D2607-A2610 PolarHBondContact O-N 3.11Å; D2607-L2611 VanDerWaalsContact O-CB 3.28Å; D2607-L2611 WeakPolarHBondContact O-CB 3.38Å; D2607-L2611 VanDerWaalsContact O-CG 3.3Å; D2607-L2611 WeakPolarHBondContact O-CG 3.48Å; D2607-L2611 PolarHBondContact O-N 3.09Å
2608	E	46.4	Very low	46.7	Very low	134 Å²	134	103.5 Å²	103.5	63%	0.626	57%	0.567	S	S	*	*	H	α-helix	trans	-48.2	-27.5	172.2	-73.2	-93.4	122.6	0	0	113.2	N2605 A2606 A2610 L2611 S2612 R2622 R2713	N2605-E2608 PolarHBondContact O-N 3.14Å; A2606-E2608 PolarHBondContact O-N 3.08Å; E2608-A2610 VanDerWaalsContact C-N 3.33Å; E2608-A2610 PolarHBondContact O-N 3.07Å; E2608-A2610 VanDerWaalsContact O-N 3.14Å; E2608-L2611 PolarHBondContact O-N 3.26Å; E2608-L2611 VanDerWaalsContact O-N 3.1Å; E2608-S2612 WeakPolarHBondContact O-CB 3.3Å; E2608-S2612 PolarHBondContact O-N 3.28Å; E2608-R2622 IonicContact OE1-CZ 3.9Å; E2608-R2622 IonicContact OE1-NH1 3.15Å; E2608-R2622 PolarHBondContact OE1-NH1 2.96Å; E2608-R2622 IonicContact OE1-NH2 3.68Å; E2608-R2622 IonicContact OE2-NH1 3.7Å; E2608-R2622 PolarHBondContact OE2-NH1 3.45Å; E2608-R2713 IonicContact OE1-CZ 3.8Å; E2608-R2713 IonicContact OE1-NH1 3.05Å; E2608-R2713 PolarHBondContact OE1-NH1 2.92Å; E2608-R2713 IonicContact OE2-CZ 2.77Å; E2608-R2713 IonicContact OE2-NH1 2.76Å; E2608-R2713 PolarHBondContact OE2-NH1 2.68Å
2609	D	45.8	Very low	45.5	Very low	109.2 Å²	109.2	104.5 Å²	104.5	58%	0.584	58%	0.582	S	S	*	*	H	α-helix	trans	-57.5	-20.7	172.3	-103.8	-1.6	0	0	0	113.7	A2606 D2607 L2611 S2612 R2614	A2606-D2609 PolarHBondContact O-N 2.89Å; A2606-D2609 VanDerWaalsContact O-N 3.14Å; D2607-D2609 VanDerWaalsContact C-N 3.32Å; D2607-D2609 PolarHBondContact O-N 2.87Å; D2609-L2611 VanDerWaalsContact C-N 3.35Å; D2609-L2611 PolarHBondContact O-N 3.06Å; D2609-S2612 VanDerWaalsContact CG-OG 3.27Å; D2609-S2612 VanDerWaalsContact O-CB 3.29Å; D2609-S2612 WeakPolarHBondContact O-CB 3.41Å; D2609-S2612 PolarHBondContact O-N 3.13Å; D2609-S2612 VanDerWaalsContact O-N 3.12Å; D2609-S2612 PolarHBondContact O-OG 2.89Å; D2609-S2612 VanDerWaalsContact OD1-CB 3.26Å; D2609-S2612 WeakPolarHBondContact OD1-CB 3.18Å; D2609-S2612 PolarHBondContact OD1-OG 3.34Å; D2609-S2612 WeakPolarHBondContact OD2-CB 3.19Å; D2609-S2612 PolarHBondContact OD2-OG 2.94Å; D2609-R2614 VanDerWaalsContact CG-NH1 3.33Å; D2609-R2614 IonicContact OD1-CZ 3.21Å; D2609-R2614 IonicContact OD1-NE 3.57Å; D2609-R2614 IonicContact OD1-NH1 3.19Å; D2609-R2614 PolarHBondContact OD1-NH1 2.77Å; D2609-R2614 IonicContact OD1-NH2 3.59Å; D2609-R2614 IonicContact OD2-CZ 3.44Å; D2609-R2614 IonicContact OD2-NH1 2.71Å; D2609-R2614 PolarHBondContact OD2-NH1 2.87Å; D2609-R2614 IonicContact OD2-NH2 3.73Å
2610	A	44.2	Very low	44.9	Very low	69.8 Å²	69.8	102.1 Å²	102.1	58%	0.577	58%	0.579	S	S	*	*	H	α-helix	trans	-67.7	-24.4	175.3	0	0	0	0	0	113.5	A2606 D2607 E2608 S2612	A2606-A2610 HydrophobicContact CB-CB 4.44Å; A2606-A2610 PolarHBondContact O-N 3.3Å; D2607-A2610 HydrophobicContact CB-CB 3.97Å; D2607-A2610 WeakPolarHBondContact O-CB 3.22Å; D2607-A2610 PolarHBondContact O-N 3.11Å; E2608-A2610 VanDerWaalsContact C-N 3.33Å; E2608-A2610 PolarHBondContact O-N 3.07Å; E2608-A2610 VanDerWaalsContact O-N 3.14Å; A2610-S2612 VanDerWaalsContact C-N 3.31Å
2611	L	42.7	Very low	45	Very low	95.8 Å²	95.8	98.2 Å²	98.2	50%	0.502	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.8	-15.5	174	-66.6	174.3	0	0	0	113.1	W2599 A2606 D2607 E2608 D2609 G2613 R2614 V2617 R2622	W2599-L2611 HydrophobicContact CB-CD1 4.11Å; W2599-L2611 HydrophobicContact CD2-CD2 4.48Å; W2599-L2611 HydrophobicContact CE3-CD2 3.94Å; W2599-L2611 HydrophobicContact CZ3-CD2 4.46Å; A2606-L2611 HydrophobicContact CB-CD1 4.45Å; A2606-L2611 HydrophobicContact CB-CG 4.24Å; D2607-L2611 VanDerWaalsContact O-CB 3.28Å; D2607-L2611 WeakPolarHBondContact O-CB 3.38Å; D2607-L2611 VanDerWaalsContact O-CG 3.3Å; D2607-L2611 WeakPolarHBondContact O-CG 3.48Å; D2607-L2611 PolarHBondContact O-N 3.09Å; E2608-L2611 PolarHBondContact O-N 3.26Å; E2608-L2611 VanDerWaalsContact O-N 3.1Å; D2609-L2611 VanDerWaalsContact C-N 3.35Å; D2609-L2611 PolarHBondContact O-N 3.06Å; L2611-G2613 VanDerWaalsContact C-N 3.35Å; L2611-G2613 PolarHBondContact O-N 2.97Å; L2611-G2613 VanDerWaalsContact O-N 3.11Å; L2611-R2614 PolarHBondContact O-N 2.94Å; L2611-R2614 VanDerWaalsContact O-N 3.09Å; L2611-V2617 HydrophobicContact CB-CG1 4.38Å; L2611-V2617 HydrophobicContact CB-CG2 4.16Å; L2611-V2617 HydrophobicContact CD2-CG2 4.41Å; L2611-V2617 WeakPolarHBondContact O-CB 3.26Å; L2611-V2617 VanDerWaalsContact O-CG2 3.3Å; L2611-V2617 WeakPolarHBondContact O-CG2 3.32Å; L2611-R2622 VanDerWaalsContact CD1-NH2 3.32Å
2612	S	46.6	Very low	45.8	Very low	71 Å²	71	96.2 Å²	96.2	50%	0.497	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-18.7	-179.3	174.2	0	0	0	0	114.2	E2608 D2609 A2610 R2614	E2608-S2612 WeakPolarHBondContact O-CB 3.3Å; E2608-S2612 PolarHBondContact O-N 3.28Å; D2609-S2612 VanDerWaalsContact CG-OG 3.27Å; D2609-S2612 VanDerWaalsContact O-CB 3.29Å; D2609-S2612 WeakPolarHBondContact O-CB 3.41Å; D2609-S2612 PolarHBondContact O-N 3.13Å; D2609-S2612 VanDerWaalsContact O-N 3.12Å; D2609-S2612 PolarHBondContact O-OG 2.89Å; D2609-S2612 VanDerWaalsContact OD1-CB 3.26Å; D2609-S2612 WeakPolarHBondContact OD1-CB 3.18Å; D2609-S2612 PolarHBondContact OD1-OG 3.34Å; D2609-S2612 WeakPolarHBondContact OD2-CB 3.19Å; D2609-S2612 PolarHBondContact OD2-OG 2.94Å; A2610-S2612 VanDerWaalsContact C-N 3.31Å; S2612-R2614 PolarHBondContact O-N 2.78Å; S2612-R2614 VanDerWaalsContact O-N 3.09Å
2613	G	38.1	Very low	46.9	Very low	66.6 Å²	66.6	91.8 Å²	91.8	69%	0.687	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	2.8	177	0	0	0	0	0	115.9	L2611 P2615	L2611-G2613 VanDerWaalsContact C-N 3.35Å; L2611-G2613 PolarHBondContact O-N 2.97Å; L2611-G2613 VanDerWaalsContact O-N 3.11Å; G2613-P2615 WeakPolarHBondContact O-CD 3.32Å
2614	R	42.7	Very low	48.6	Very low	142 Å²	142	89.8 Å²	89.8	54%	0.536	52%	0.521	S	S	.	.			trans	-84.2	127.6	179.2	-75.1	-171.5	175.3	-174.5	3.2	111.7	D2609 L2611 S2612 E2616 V2617 V2618	D2609-R2614 VanDerWaalsContact CG-NH1 3.33Å; D2609-R2614 IonicContact OD1-CZ 3.21Å; D2609-R2614 IonicContact OD1-NE 3.57Å; D2609-R2614 IonicContact OD1-NH1 3.19Å; D2609-R2614 PolarHBondContact OD1-NH1 2.77Å; D2609-R2614 IonicContact OD1-NH2 3.59Å; D2609-R2614 IonicContact OD2-CZ 3.44Å; D2609-R2614 IonicContact OD2-NH1 2.71Å; D2609-R2614 PolarHBondContact OD2-NH1 2.87Å; D2609-R2614 IonicContact OD2-NH2 3.73Å; L2611-R2614 PolarHBondContact O-N 2.94Å; L2611-R2614 VanDerWaalsContact O-N 3.09Å; S2612-R2614 PolarHBondContact O-N 2.78Å; S2612-R2614 VanDerWaalsContact O-N 3.09Å; R2614-E2616 PolarHBondContact O-N 3.12Å; R2614-E2616 VanDerWaalsContact O-N 3.11Å; R2614-V2617 HydrophobicContact CB-CB 4.25Å; R2614-V2617 HydrophobicContact CB-CG2 4.1Å; R2614-V2617 WeakPolarHBondContact O-CB 3.42Å; R2614-V2617 PolarHBondContact O-N 3.13Å; R2614-V2617 VanDerWaalsContact O-N 3.08Å; R2614-V2618 PolarHBondContact O-N 3.29Å; R2614-V2618 VanDerWaalsContact O-N 3.12Å
2615	P	41.3	Very low	50.1	Low	112.8 Å²	112.8	82.4 Å²	82.4	73%	0.732	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-27.5	173.4	-25.1	34.6	0	0	0	113.6	G2613 V2617 V2618	G2613-P2615 WeakPolarHBondContact O-CD 3.32Å; P2615-V2617 VanDerWaalsContact C-N 3.29Å; P2615-V2617 PolarHBondContact O-N 2.92Å; P2615-V2618 WeakPolarHBondContact O-CG2 3.4Å; P2615-V2618 PolarHBondContact O-N 3.01Å
2616	E	41.9	Very low	51.8	Low	143.2 Å²	143.2	76.6 Å²	76.6	67%	0.669	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-2.3	173.3	-66.2	177.3	157.5	0	0	112.4	A2594 R2614 V2618 S2623	A2594-E2616 HydrophobicContact CB-CB 4.23Å; R2614-E2616 PolarHBondContact O-N 3.12Å; R2614-E2616 VanDerWaalsContact O-N 3.11Å; E2616-V2618 VanDerWaalsContact C-N 3.32Å; E2616-V2618 PolarHBondContact O-N 3.03Å; E2616-S2623 VanDerWaalsContact CD-CB 3.47Å; E2616-S2623 VanDerWaalsContact OE1-CA 3.3Å; E2616-S2623 WeakPolarHBondContact OE1-CA 3.37Å; E2616-S2623 VanDerWaalsContact OE1-CB 3.29Å; E2616-S2623 WeakPolarHBondContact OE1-CB 3.39Å; E2616-S2623 PolarHBondContact OE1-N 2.75Å; E2616-S2623 VanDerWaalsContact OE2-CB 3.32Å; E2616-S2623 WeakPolarHBondContact OE2-CB 3.41Å
2617	V	44.6	Very low	53.5	Low	45.4 Å²	45.4	76.5 Å²	76.5	28%	0.275	45%	0.454	S	S	.	.	G	3₁₀ helix	trans	-88.3	10.5	-178.8	-172.6	0	0	0	0	110.6	L2611 R2614 P2615 G2619 C2620	L2611-V2617 HydrophobicContact CB-CG1 4.38Å; L2611-V2617 HydrophobicContact CB-CG2 4.16Å; L2611-V2617 HydrophobicContact CD2-CG2 4.41Å; L2611-V2617 WeakPolarHBondContact O-CB 3.26Å; L2611-V2617 VanDerWaalsContact O-CG2 3.3Å; L2611-V2617 WeakPolarHBondContact O-CG2 3.32Å; R2614-V2617 HydrophobicContact CB-CB 4.25Å; R2614-V2617 HydrophobicContact CB-CG2 4.1Å; R2614-V2617 WeakPolarHBondContact O-CB 3.42Å; R2614-V2617 PolarHBondContact O-N 3.13Å; R2614-V2617 VanDerWaalsContact O-N 3.08Å; P2615-V2617 VanDerWaalsContact C-N 3.29Å; P2615-V2617 PolarHBondContact O-N 2.92Å; V2617-G2619 VanDerWaalsContact C-N 3.28Å; V2617-G2619 PolarHBondContact O-N 3.23Å; V2617-C2620 HydrophobicContact CG1-CB 3.61Å; V2617-C2620 WeakPolarHBondContact CG1-SG 3.34Å; V2617-C2620 PolarHBondContact O-N 2.87Å; V2617-C2620 PolarHBondContact O-SG 3.13Å
2618	V	42.3	Very low	55	Low	120.2 Å²	120.2	71.6 Å²	71.6	73%	0.728	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	91.3	179.6	-173.1	0	0	0	0	109.9	R2614 P2615 E2616	R2614-V2618 PolarHBondContact O-N 3.29Å; R2614-V2618 VanDerWaalsContact O-N 3.12Å; P2615-V2618 WeakPolarHBondContact O-CG2 3.4Å; P2615-V2618 PolarHBondContact O-N 3.01Å; E2616-V2618 VanDerWaalsContact C-N 3.32Å; E2616-V2618 PolarHBondContact O-N 3.03Å
2619	G	47.8	Very low	55.7	Low	45 Å²	45	67 Å²	67	46%	0.464	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	130.7	-6.8	-178.3	0	0	0	0	0	115.5	V2617 G2621 V2628 T2629	V2617-G2619 VanDerWaalsContact C-N 3.28Å; V2617-G2619 PolarHBondContact O-N 3.23Å; G2619-G2621 PolarHBondContact O-N 3.1Å; G2619-V2628 WeakPolarHBondContact O-CA 3.29Å; G2619-T2629 PolarHBondContact O-N 3.3Å
2620	C	49.9	Very low	55.7	Low	39 Å²	39	65.3 Å²	65.3	26%	0.264	41%	0.411	S	S	.	.	S	Bend	trans	-78.5	44.1	175.7	57	0	0	0	0	113.3	D2595 V2617 R2622 R2709	D2595-C2620 VanDerWaalsContact OD1-CA 3.32Å; D2595-C2620 WeakPolarHBondContact OD1-CA 3.47Å; D2595-C2620 VanDerWaalsContact OD1-CB 3.28Å; D2595-C2620 WeakPolarHBondContact OD1-CB 3Å; V2617-C2620 HydrophobicContact CG1-CB 3.61Å; V2617-C2620 WeakPolarHBondContact CG1-SG 3.34Å; V2617-C2620 PolarHBondContact O-N 2.87Å; V2617-C2620 PolarHBondContact O-SG 3.13Å; C2620-R2622 VanDerWaalsContact C-N 3.32Å; C2620-R2622 PolarHBondContact O-N 3.04Å; C2620-R2622 VanDerWaalsContact SG-CG 3.5Å; C2620-R2709 PolarHBondContact O-NH2 3Å
2621	G	58.2	Low	55.5	Low	10.2 Å²	10.2	65.8 Å²	65.8	11%	0.105	41%	0.409	C	S	.	.			trans	13.3	24.6	179.6	0	0	0	0	0	116.2	G2619 S2623 V2627 R2709	G2619-G2621 PolarHBondContact O-N 3.1Å; G2621-S2623 PolarHBondContact O-N 2.9Å; G2621-V2627 WeakPolarHBondContact CA-O 3.29Å; G2621-V2627 PolarHBondContact N-O 2.96Å; G2621-V2627 VanDerWaalsContact N-O 3.11Å; G2621-R2709 VanDerWaalsContact O-CZ 3.29Å; G2621-R2709 PolarHBondContact O-NE 3.23Å; G2621-R2709 PolarHBondContact O-NH1 3.48Å; G2621-R2709 PolarHBondContact O-NH2 2.93Å
2622	R	65.4	Low	54.8	Low	107 Å²	107	66.9 Å²	66.9	40%	0.404	42%	0.419	S	S	.	.			trans	-71.5	-36.1	-175.6	-86	-179.1	177.2	-159	-4.1	114.2	W2599 E2608 L2611 C2620 R2709	W2599-R2622 VanDerWaalsContact NE1-NH2 3.18Å; E2608-R2622 IonicContact OE1-CZ 3.9Å; E2608-R2622 IonicContact OE1-NH1 3.15Å; E2608-R2622 PolarHBondContact OE1-NH1 2.96Å; E2608-R2622 IonicContact OE1-NH2 3.68Å; E2608-R2622 IonicContact OE2-NH1 3.7Å; E2608-R2622 PolarHBondContact OE2-NH1 3.45Å; L2611-R2622 VanDerWaalsContact CD1-NH2 3.32Å; C2620-R2622 VanDerWaalsContact C-N 3.32Å; C2620-R2622 PolarHBondContact O-N 3.04Å; C2620-R2622 VanDerWaalsContact SG-CG 3.5Å; R2622-R2709 VanDerWaalsContact O-CD 3.32Å; R2622-R2709 WeakPolarHBondContact O-CD 3.27Å; R2622-R2709 PolarHBondContact O-NE 3.09Å; R2622-R2709 VanDerWaalsContact O-NE 3.08Å; R2622-R2709 PolarHBondContact O-NH1 3.28Å; R2622-R2709 VanDerWaalsContact O-NH1 3.09Å
2623	S	71	Confident	53.9	Low	61.6 Å²	61.6	68.4 Å²	68.4	43%	0.431	43%	0.429	S	S	.	.	S	Bend	trans	-75.4	158.6	176.3	18.3	0	0	0	0	112.6	E2616 G2621 G2625 G2626 R2709	E2616-S2623 VanDerWaalsContact CD-CB 3.47Å; E2616-S2623 VanDerWaalsContact OE1-CA 3.3Å; E2616-S2623 WeakPolarHBondContact OE1-CA 3.37Å; E2616-S2623 VanDerWaalsContact OE1-CB 3.29Å; E2616-S2623 WeakPolarHBondContact OE1-CB 3.39Å; E2616-S2623 PolarHBondContact OE1-N 2.75Å; E2616-S2623 VanDerWaalsContact OE2-CB 3.32Å; E2616-S2623 WeakPolarHBondContact OE2-CB 3.41Å; G2621-S2623 PolarHBondContact O-N 2.9Å; S2623-G2625 PolarHBondContact O-N 3.3Å; S2623-G2626 WeakPolarHBondContact O-CA 3.3Å; S2623-G2626 PolarHBondContact O-N 2.89Å; S2623-R2709 WeakPolarHBondContact O-CD 3.4Å; S2623-R2709 PolarHBondContact O-NH1 3.44Å
2624	V	77.1	Confident	53.4	Low	47.6 Å²	47.6	74.1 Å²	74.1	29%	0.288	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	136.7	169.3	-166.9	0	0	0	0	109.2	G2626 M2710 N2765 S2767	V2624-G2626 PolarHBondContact O-N 2.96Å; V2624-M2710 VanDerWaalsContact CG1-O 3.31Å; V2624-M2710 WeakPolarHBondContact CG1-O 3.37Å; V2624-N2765 WeakPolarHBondContact CG1-O 3.41Å; V2624-N2765 HydrophobicContact CG2-CB 4.24Å; V2624-S2767 WeakPolarHBondContact CG1-OG 3.39Å
2625	G	78	Confident	52.8	Low	19 Å²	19	72.4 Å²	72.4	20%	0.196	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.6	-5.6	-168.9	0	0	0	0	0	114	S2623 Q2708 R2709 S2767	S2623-G2625 PolarHBondContact O-N 3.3Å; G2625-Q2708 WeakPolarHBondContact O-CG 3.43Å; G2625-Q2708 PolarHBondContact O-NE2 3.14Å; G2625-R2709 WeakPolarHBondContact CA-O 3.42Å; G2625-R2709 PolarHBondContact N-O 3.27Å; G2625-S2767 VanDerWaalsContact CA-OG 3.32Å; G2625-S2767 WeakPolarHBondContact CA-OG 3.5Å; G2625-S2767 PolarHBondContact N-OG 3.09Å; G2625-S2767 VanDerWaalsContact N-OG 3.16Å
2626	G	78.8	Confident	52.1	Low	11.6 Å²	11.6	76.6 Å²	76.6	12%	0.12	45%	0.449	C	S	.	.			trans	-69.3	139.1	176.3	0	0	0	0	0	112.7	S2623 V2624 Q2708 R2709	S2623-G2626 WeakPolarHBondContact O-CA 3.3Å; S2623-G2626 PolarHBondContact O-N 2.89Å; V2624-G2626 PolarHBondContact O-N 2.96Å; G2626-Q2708 WeakPolarHBondContact O-CA 3.34Å; G2626-R2709 PolarHBondContact O-N 2.95Å
2627	V	78.2	Confident	51.4	Low	34 Å²	34	75.6 Å²	75.6	21%	0.206	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	131.3	176.3	178.2	0	0	0	0	110	V2560 G2621 T2629 A2630 Q2706 L2707 Q2708	V2560-V2627 HydrophobicContact CG2-CG2 4.46Å; G2621-V2627 WeakPolarHBondContact CA-O 3.29Å; G2621-V2627 PolarHBondContact N-O 2.96Å; G2621-V2627 VanDerWaalsContact N-O 3.11Å; V2627-T2629 HydrophobicContact CG1-CG2 4.13Å; V2627-T2629 WeakPolarHBondContact CG1-OG1 3.39Å; V2627-A2630 HydrophobicContact CG1-CB 4.14Å; V2627-Q2706 HydrophobicContact CG1-CB 3.91Å; V2627-Q2706 HydrophobicContact CG1-CG 3.89Å; V2627-Q2706 VanDerWaalsContact CG1-CG 3.5Å; V2627-Q2706 HydrophobicContact CG2-CG 4.44Å; V2627-Q2706 VanDerWaalsContact CG2-NE2 3.33Å; V2627-L2707 CarbonylContact C-O 3.51Å; V2627-L2707 WeakPolarHBondContact CA-O 3.34Å; V2627-Q2708 HydrophobicContact CG2-CB 4.39Å; V2627-Q2708 HydrophobicContact CG2-CG 4.47Å
2628	V	74	Confident	50.7	Low	18.6 Å²	18.6	79.4 Å²	79.4	11%	0.113	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	88.6	173.9	-173.2	0	0	0	0	109.2	Y2557 L2591 G2619 L2707	Y2557-V2628 HydrophobicContact CD1-CG2 3.86Å; Y2557-V2628 VanDerWaalsContact CD1-CG2 3.44Å; Y2557-V2628 HydrophobicContact CE1-CG2 3.59Å; Y2557-V2628 VanDerWaalsContact CE1-CG2 3.41Å; L2591-V2628 HydrophobicContact CD2-CG1 4.27Å; L2591-V2628 HydrophobicContact CD2-CG2 4.45Å; G2619-V2628 WeakPolarHBondContact O-CA 3.29Å; V2628-L2707 HydrophobicContact CB-CB 4.41Å; V2628-L2707 HydrophobicContact CG2-CB 4.47Å; V2628-L2707 PolarHBondContact N-O 3Å; V2628-L2707 PolarHBondContact O-N 3.36Å
2629	T	60.5	Low	50.1	Low	38.2 Å²	38.2	78.5 Å²	78.5	23%	0.234	48%	0.478	C	S	.	.			trans	-129.1	109.4	-179.1	-35.1	0	0	0	0	110.7	Q2589 G2619 V2627 C2631 P2704 Q2706	Q2589-T2629 VanDerWaalsContact NE2-CG2 3.27Å; Q2589-T2629 PolarHBondContact NE2-OG1 2.84Å; Q2589-T2629 PolarHBondContact OE1-OG1 3.02Å; G2619-T2629 PolarHBondContact O-N 3.3Å; V2627-T2629 HydrophobicContact CG1-CG2 4.13Å; V2627-T2629 WeakPolarHBondContact CG1-OG1 3.39Å; T2629-C2631 VanDerWaalsContact C-N 3.26Å; T2629-C2631 PolarHBondContact O-N 3.12Å; T2629-C2631 VanDerWaalsContact O-N 3.17Å; T2629-P2704 HydrophobicContact CG2-CG 4.4Å; T2629-Q2706 HydrophobicContact CG2-CG 3.79Å
2630	A	46.8	Very low	49.3	Very low	72.6 Å²	72.6	83 Å²	83	60%	0.6	49%	0.491	S	S	*	.	S	Bend	trans	-81.8	35.6	178.9	0	0	0	0	0	113.1	V2627 V2632	V2627-A2630 HydrophobicContact CG1-CB 4.14Å; A2630-V2632 HydrophobicContact CB-CG2 4.06Å; A2630-V2632 PolarHBondContact O-N 2.93Å; A2630-V2632 VanDerWaalsContact O-N 3.13Å
2631	C	38.9	Very low	48.6	Very low	79.8 Å²	79.8	87.9 Å²	87.9	54%	0.539	52%	0.515	S	S	.	.			trans	-116.7	92	177.4	-135.1	0	0	0	0	111.3	T2629 C2633 P2704	T2629-C2631 VanDerWaalsContact C-N 3.26Å; T2629-C2631 PolarHBondContact O-N 3.12Å; T2629-C2631 VanDerWaalsContact O-N 3.17Å; C2631-C2633 VanDerWaalsContact C-N 3.34Å; C2631-C2633 PolarHBondContact O-N 3.08Å; C2631-C2633 VanDerWaalsContact SG-SG 3.66Å; C2631-P2704 HydrophobicContact CB-CB 4.14Å; C2631-P2704 HydrophobicContact CB-CG 3.83Å; C2631-P2704 VanDerWaalsContact CB-CG 3.46Å
2632	V	29.8	Very low	47.3	Very low	118.8 Å²	118.8	94 Å²	94	72%	0.72	55%	0.545	S	S	*	.			trans	-92.9	60.4	172.7	-168.3	0	0	0	0	109.8	A2630 F2634	A2630-V2632 HydrophobicContact CB-CG2 4.06Å; A2630-V2632 PolarHBondContact O-N 2.93Å; A2630-V2632 VanDerWaalsContact O-N 3.13Å; V2632-F2634 VanDerWaalsContact C-N 3.3Å; V2632-F2634 HydrophobicContact CG1-CD2 3.91Å; V2632-F2634 HydrophobicContact CG1-CE2 3.59Å; V2632-F2634 HydrophobicContact CG1-CZ 4.24Å; V2632-F2634 PolarHBondContact O-N 2.84Å
2633	C	26.7	Very low	45.8	Very low	104 Å²	104	95.9 Å²	95.9	70%	0.703	56%	0.563	S	S	*	*			trans	-136.1	100.3	173.5	-104.7	0	0	0	0	111.2	C2631 P2635	C2631-C2633 VanDerWaalsContact C-N 3.34Å; C2631-C2633 PolarHBondContact O-N 3.08Å; C2631-C2633 VanDerWaalsContact SG-SG 3.66Å; C2633-P2635 VanDerWaalsContact O-CD 3.28Å; C2633-P2635 WeakPolarHBondContact O-CD 3.28Å
2634	F	27.9	Very low	44	Very low	185.2 Å²	185.2	100.2 Å²	100.2	81%	0.812	58%	0.58	S	S	*	*			trans	-73.9	118.1	159.3	-72.8	-84.4	0	0	0	108.4	V2632 K2636	V2632-F2634 VanDerWaalsContact C-N 3.3Å; V2632-F2634 HydrophobicContact CG1-CD2 3.91Å; V2632-F2634 HydrophobicContact CG1-CE2 3.59Å; V2632-F2634 HydrophobicContact CG1-CZ 4.24Å; V2632-F2634 PolarHBondContact O-N 2.84Å; F2634-K2636 PolarHBondContact O-N 3.01Å; F2634-K2636 VanDerWaalsContact O-N 3.14Å
2635	P	28.9	Very low	41.9	Very low	106.4 Å²	106.4	102.6 Å²	102.6	69%	0.691	60%	0.599	S	S	*	*			trans	-68.5	103.6	170	28.8	-32.5	0	0	0	108.4	C2633 T2637	C2633-P2635 VanDerWaalsContact O-CD 3.28Å; C2633-P2635 WeakPolarHBondContact O-CD 3.28Å; P2635-T2637 VanDerWaalsContact C-N 3.29Å; P2635-T2637 PolarHBondContact O-N 3.04Å; P2635-T2637 VanDerWaalsContact O-N 3.08Å
2636	K	27.4	Very low	39.6	Very low	201.2 Å²	201.2	108.5 Å²	108.5	88%	0.875	63%	0.626	S	S	*	*			trans	-66.3	103	171.3	-117.6	-179.3	-180	177.9	0	108.2	F2634 P2638	F2634-K2636 PolarHBondContact O-N 3.01Å; F2634-K2636 VanDerWaalsContact O-N 3.14Å; K2636-P2638 WeakPolarHBondContact O-CD 3.22Å
2637	T	28.1	Very low	37.5	Very low	121.6 Å²	121.6	114.6 Å²	114.6	75%	0.746	66%	0.656	S	S	*	*			trans	-57.4	125.2	173	41.9	0	0	0	0	109.4	P2635 S2639	P2635-T2637 VanDerWaalsContact C-N 3.29Å; P2635-T2637 PolarHBondContact O-N 3.04Å; P2635-T2637 VanDerWaalsContact O-N 3.08Å; T2637-S2639 VanDerWaalsContact C-N 3.27Å; T2637-S2639 PolarHBondContact O-N 3.07Å; T2637-S2639 VanDerWaalsContact O-N 3.1Å
2638	P	29.7	Very low	35.4	Very low	124.8 Å²	124.8	121.7 Å²	121.7	81%	0.81	68%	0.684	S	S	*	*			trans	-72.8	99.3	175.2	28.8	-32	0	0	0	108.7	K2636 N2640	K2636-P2638 WeakPolarHBondContact O-CD 3.22Å; P2638-N2640 PolarHBondContact O-N 2.95Å; P2638-N2640 VanDerWaalsContact O-N 3.08Å
2639	S	30	Very low	33.3	Very low	102.4 Å²	102.4	128.1 Å²	128.1	72%	0.716	72%	0.718	S	S	*	*			trans	-64	106.3	173.4	140.7	0	0	0	0	109.5	T2637 N2641	T2637-S2639 VanDerWaalsContact C-N 3.27Å; T2637-S2639 PolarHBondContact O-N 3.07Å; T2637-S2639 VanDerWaalsContact O-N 3.1Å; S2639-N2641 VanDerWaalsContact C-N 3.25Å; S2639-N2641 PolarHBondContact O-N 3.23Å; S2639-N2641 VanDerWaalsContact O-N 3.09Å; S2639-N2641 PolarHBondContact OG-OD1 3.24Å
2640	N	30.6	Very low	32.1	Very low	139 Å²	139	131.9 Å²	131.9	74%	0.743	74%	0.743	S	S	*	*			trans	-85.9	79	175.9	-154.1	8.2	0	0	0	111.3	P2638 N2642	P2638-N2640 PolarHBondContact O-N 2.95Å; P2638-N2640 VanDerWaalsContact O-N 3.08Å; N2640-N2642 PolarHBondContact O-N 3.04Å; N2640-N2642 VanDerWaalsContact O-N 3.1Å; N2640-N2642 PolarHBondContact OD1-ND2 3.06Å
2641	N	34.1	Very low	31.2	Very low	143 Å²	143	135.7 Å²	135.7	77%	0.765	75%	0.752	S	S	*	*			trans	-93.2	88.2	172.4	-85	-8.8	0	0	0	110.1	S2639 N2643	S2639-N2641 VanDerWaalsContact C-N 3.25Å; S2639-N2641 PolarHBondContact O-N 3.23Å; S2639-N2641 VanDerWaalsContact O-N 3.09Å; S2639-N2641 PolarHBondContact OG-OD1 3.24Å; N2641-N2643 PolarHBondContact O-N 3.03Å; N2641-N2643 VanDerWaalsContact O-N 3.16Å
2642	N	32.2	Very low	30.6	Very low	136.8 Å²	136.8	138.1 Å²	138.1	73%	0.732	77%	0.765	S	S	*	*			trans	-52.3	99	158.7	-73.8	-31.2	0	0	0	111.1	N2640	N2640-N2642 PolarHBondContact O-N 3.04Å; N2640-N2642 VanDerWaalsContact O-N 3.1Å; N2640-N2642 PolarHBondContact OD1-ND2 3.06Å
2643	N	34.1	Very low	30.4	Very low	147.2 Å²	147.2	143.8 Å²	143.8	79%	0.787	77%	0.773	S	S	*	*			trans	-167	128.8	142.3	-101.2	-35.8	0	0	0	114.2	N2641	N2641-N2643 PolarHBondContact O-N 3.03Å; N2641-N2643 VanDerWaalsContact O-N 3.16Å
2644	I	32.6	Very low	30.3	Very low	151.8 Å²	151.8	145.2 Å²	145.2	78%	0.778	78%	0.778	S	S	*	*			trans	66.6	120.9	153.2	-62.3	166.2	0	0	0	117
2645	S	31.9	Very low	30.2	Very low	99 Å²	99	141.6 Å²	141.6	69%	0.692	78%	0.776	S	S	*	*			trans	124.1	132.1	149.5	77.8	0	0	0	0	117.8	N2647	S2645-N2647 PolarHBondContact O-N 3.42Å
2646	N	31.2	Very low	30	Very low	142 Å²	142	142.4 Å²	142.4	76%	0.759	78%	0.779	S	S	*	*			trans	26.5	114	148.7	-56.3	-32	0	0	0	117.2
2647	N	33.8	Very low	29.9	Very low	141.2 Å²	141.2	140.1 Å²	140.1	76%	0.755	78%	0.776	S	S	*	*				171.7	145.9	111.3	-99.5	-57.1	0	0	0	116	S2645	S2645-N2647 PolarHBondContact O-N 3.42Å
2648	K	33.4	Very low	29.7	Very low	182.2 Å²	182.2	140.2 Å²	140.2	79%	0.792	78%	0.777	S	S	*	*			trans	14.5	122.5	159.5	-61.8	171.2	-177.1	174.1	0	117.5
2649	N	30.3	Very low	29.6	Very low	153.8 Å²	153.8	143.7 Å²	143.7	82%	0.822	78%	0.779	S	S	*	*			trans	10	138.7	142.1	-67.5	-7	0	0	0	115.9
2650	P	34.9	Very low	29.4	Very low	116.2 Å²	116.2	142 Å²	142	76%	0.755	78%	0.778	S	S	*	*				-123.6	169.6	129.6	36.6	-23.6	0	0	0	113.5
2651	L	28.2	Very low	29.2	Very low	153.2 Å²	153.2	141.8 Å²	141.8	80%	0.802	78%	0.782	S	S	*	*			trans	-177.7	128.2	160.6	-90.6	87.1	0	0	0	115.1	R2653	L2651-R2653 PolarHBondContact O-N 2.94Å
2652	T	26.3	Very low	28.8	Very low	130.6 Å²	130.6	144.3 Å²	144.3	80%	0.801	79%	0.786	S	S	*	*			trans	111.5	135.5	147.5	33.6	0	0	0	0	114.9	T2654	T2652-T2654 PolarHBondContact O-N 2.9Å
2653	R	25.5	Very low	28.5	Very low	239.2 Å²	239.2	145 Å²	145	90%	0.903	79%	0.789	S	S	*	*			trans	-138.5	108.4	146.3	-91.2	175.2	67.3	-175.1	1	112.2	L2651 S2655	L2651-R2653 PolarHBondContact O-N 2.94Å; R2653-S2655 PolarHBondContact O-N 2.85Å; R2653-S2655 VanDerWaalsContact O-N 3.1Å
2654	T	24.7	Very low	28.2	Very low	131.8 Å²	131.8	146 Å²	146	81%	0.809	79%	0.791	S	S	*	*			trans	-105	120.2	162.3	-31.4	0	0	0	0	109.3	T2652 T2656	T2652-T2654 PolarHBondContact O-N 2.9Å; T2654-T2656 PolarHBondContact O-N 3.31Å; T2654-T2656 VanDerWaalsContact O-N 3.16Å
2655	S	26.2	Very low	28	Very low	109.4 Å²	109.4	143.6 Å²	143.6	77%	0.765	79%	0.788	S	S	*	*			trans	-105.4	96	-179.5	53.3	0	0	0	0	111.7	R2653 L2657	R2653-S2655 PolarHBondContact O-N 2.85Å; R2653-S2655 VanDerWaalsContact O-N 3.1Å; S2655-L2657 PolarHBondContact O-N 3.17Å
2656	T	24.2	Very low	28	Very low	123.8 Å²	123.8	146.4 Å²	146.4	76%	0.76	80%	0.795	S	S	*	*			trans	-75.8	118.2	165.5	4.5	0	0	0	0	110	T2654 T2658	T2654-T2656 PolarHBondContact O-N 3.31Å; T2654-T2656 VanDerWaalsContact O-N 3.16Å; T2656-T2658 PolarHBondContact O-N 3.08Å
2657	L	26.3	Very low	27.9	Very low	152.2 Å²	152.2	147 Å²	147	80%	0.797	80%	0.798	S	S	*	*			trans	-89.2	111	172.5	-79.4	170.9	0	0	0	110.8	S2655 F2659	S2655-L2657 PolarHBondContact O-N 3.17Å; L2657-F2659 PolarHBondContact O-N 3.09Å
2658	T	23.7	Very low	27.6	Very low	124.4 Å²	124.4	147.8 Å²	147.8	76%	0.763	80%	0.799	S	S	*	*			trans	-86.1	117.2	174.4	-56.7	0	0	0	0	109.9	T2656 G2660	T2656-T2658 PolarHBondContact O-N 3.08Å; T2658-G2660 VanDerWaalsContact C-N 3.31Å; T2658-G2660 PolarHBondContact O-N 2.89Å
2659	F	27.4	Very low	27.3	Very low	198 Å²	198	145 Å²	145	87%	0.868	80%	0.798	S	S	*	*			trans	-93.4	107.4	160.1	-82.7	-82.4	0	0	0	109.2	L2657 T2661	L2657-F2659 PolarHBondContact O-N 3.09Å; F2659-T2661 PolarHBondContact O-N 3.12Å; F2659-T2661 VanDerWaalsContact O-N 3.13Å
2660	G	24.9	Very low	27.3	Very low	67.4 Å²	67.4	145.3 Å²	145.3	70%	0.695	80%	0.799	S	S	*	*			trans	-105.7	103.2	173	0	0	0	0	0	112	T2658 K2662	T2658-G2660 VanDerWaalsContact C-N 3.31Å; T2658-G2660 PolarHBondContact O-N 2.89Å; G2660-K2662 VanDerWaalsContact C-N 3.28Å; G2660-K2662 PolarHBondContact O-N 3.09Å
2661	T	27.8	Very low	26.8	Very low	135.4 Å²	135.4	150.3 Å²	150.3	83%	0.831	80%	0.802	S	S	*	*			trans	-96.7	119.4	167.7	50.1	0	0	0	0	109.9	F2659 L2663	F2659-T2661 PolarHBondContact O-N 3.12Å; F2659-T2661 VanDerWaalsContact O-N 3.13Å; T2661-L2663 PolarHBondContact O-N 2.83Å; T2661-L2663 VanDerWaalsContact O-N 3.15Å
2662	K	25.9	Very low	26.9	Very low	194.6 Å²	194.6	149.8 Å²	149.8	85%	0.846	80%	0.8	S	S	*	*			trans	-121.3	111.4	176.1	-151.8	177.7	-176.9	179.4	0	111.5	G2660 M2664	G2660-K2662 VanDerWaalsContact C-N 3.28Å; G2660-K2662 PolarHBondContact O-N 3.09Å; K2662-M2664 PolarHBondContact O-N 3.46Å
2663	L	25.5	Very low	26.9	Very low	151.4 Å²	151.4	150.8 Å²	150.8	79%	0.793	80%	0.801	S	S	*	*			trans	-161.4	120.5	148.7	-108.2	104.3	0	0	0	111.2	T2661	T2661-L2663 PolarHBondContact O-N 2.83Å; T2661-L2663 VanDerWaalsContact O-N 3.15Å
2664	M	27.7	Very low	27.1	Very low	168 Å²	168	145.3 Å²	145.3	83%	0.828	79%	0.794	S	S	*	*			trans	-78	130.8	138.9	-64.3	-177.9	66.5	0	0	114	K2662 N2666	K2662-M2664 PolarHBondContact O-N 3.46Å; M2664-N2666 PolarHBondContact O-N 2.97Å
2665	S	29	Very low	27.1	Very low	102 Å²	102	144.8 Å²	144.8	71%	0.713	79%	0.791	S	S	*	*			trans	-120.9	127.9	150.5	-53.5	0	0	0	0	112.5	D2667	S2665-D2667 PolarHBondContact O-N 3.28Å
2666	N	30.6	Very low	27.1	Very low	157.6 Å²	157.6	147.4 Å²	147.4	84%	0.843	80%	0.795	S	S	*	*			trans	-103.7	136	149	-69.2	-14.8	0	0	0	111.3	M2664	M2664-N2666 PolarHBondContact O-N 2.97Å
2667	D	28.7	Very low	27.1	Very low	153.6 Å²	153.6	147.2 Å²	147.2	82%	0.821	79%	0.794	S	S	*	*				-145.3	162.5	125	-125.8	-42.8	0	0	0	111.9	S2665	S2665-D2667 PolarHBondContact O-N 3.28Å
2668	M	28.4	Very low	27.1	Very low	158.2 Å²	158.2	145.4 Å²	145.4	78%	0.779	79%	0.794	S	S	*	*			trans	-136.8	140.1	177.4	-155.5	177.9	-76.5	0	0	113.3
2669	T	27.2	Very low	27.2	Very low	123.8 Å²	123.8	145.3 Å²	145.3	76%	0.76	79%	0.793	S	S	*	*			trans	67.2	129.9	160.6	56.9	0	0	0	0	115.9
2670	L	29.7	Very low	27.1	Very low	160.2 Å²	160.2	144.1 Å²	144.1	84%	0.839	79%	0.793	S	S	*	*				-159	130.6	119.5	-106.1	151.3	0	0	0	113.2	N2672	L2670-N2672 WeakPolarHBondContact CD2-ND2 3.45Å; L2670-N2672 PolarHBondContact O-N 3.24Å; L2670-N2672 VanDerWaalsContact O-N 3.11Å
2671	R	24.8	Very low	27.2	Very low	221.8 Å²	221.8	146.6 Å²	146.6	84%	0.837	79%	0.794	S	S	*	*			trans	-56.7	126.7	159.2	-84.1	-178.9	-170.7	176.9	-3.6	112.5
2672	N	29.5	Very low	27.1	Very low	142 Å²	142	146.2 Å²	146.2	76%	0.759	79%	0.792	S	S	*	*			trans	-177	120.3	135.5	-86.2	-16	0	0	0	112.8	L2670 V2674	L2670-N2672 WeakPolarHBondContact CD2-ND2 3.45Å; L2670-N2672 PolarHBondContact O-N 3.24Å; L2670-N2672 VanDerWaalsContact O-N 3.11Å; N2672-V2674 PolarHBondContact O-N 3.43Å
2673	N	28.3	Very low	27.3	Very low	152 Å²	152	142.9 Å²	142.9	81%	0.813	79%	0.788	S	S	*	*			trans	-112.3	122.1	150.4	-67.3	-20.7	0	0	0	111.9	T2675	N2673-T2675 PolarHBondContact O-N 3.38Å
2674	V	28.4	Very low	27.4	Very low	123.4 Å²	123.4	141.2 Å²	141.2	75%	0.748	78%	0.784	S	S	*	*			trans	-116.9	112.9	145.3	173.4	0	0	0	0	110.1	N2672 L2676	N2672-V2674 PolarHBondContact O-N 3.43Å; V2674-L2676 VanDerWaalsContact C-N 3.33Å; V2674-L2676 HydrophobicContact CG1-CG 4.32Å; V2674-L2676 PolarHBondContact O-N 2.94Å
2675	T	25	Very low	27.5	Very low	122.6 Å²	122.6	139.1 Å²	139.1	75%	0.752	78%	0.783	S	S	*	*			trans	-71.3	115.5	165.5	-32.9	0	0	0	0	111.5	N2673 T2677	N2673-T2675 PolarHBondContact O-N 3.38Å; T2675-T2677 VanDerWaalsContact C-N 3.3Å; T2675-T2677 HydrophobicContact CG2-CG2 4.09Å; T2675-T2677 PolarHBondContact O-N 2.77Å; T2675-T2677 VanDerWaalsContact O-N 3.11Å
2676	L	25.5	Very low	27.4	Very low	163.2 Å²	163.2	140.2 Å²	140.2	85%	0.854	79%	0.786	S	S	*	*			trans	-98.7	99	167.6	-77.9	171.5	0	0	0	110	V2674 S2678	V2674-L2676 VanDerWaalsContact C-N 3.33Å; V2674-L2676 HydrophobicContact CG1-CG 4.32Å; V2674-L2676 PolarHBondContact O-N 2.94Å; L2676-S2678 PolarHBondContact O-N 3.08Å
2677	T	24.8	Very low	27.2	Very low	120 Å²	120	139 Å²	139	74%	0.736	78%	0.784	S	S	*	*			trans	-93.2	104.1	164.6	47.1	0	0	0	0	110	T2675 T2679	T2675-T2677 VanDerWaalsContact C-N 3.3Å; T2675-T2677 HydrophobicContact CG2-CG2 4.09Å; T2675-T2677 PolarHBondContact O-N 2.77Å; T2675-T2677 VanDerWaalsContact O-N 3.11Å; T2677-T2679 PolarHBondContact O-N 3.07Å
2678	S	26.3	Very low	27.2	Very low	113.6 Å²	113.6	137.4 Å²	137.4	79%	0.794	78%	0.78	S	S	*	*			trans	-98.6	104.9	166.3	-155.1	0	0	0	0	109.6	L2676 M2680	L2676-S2678 PolarHBondContact O-N 3.08Å; S2678-M2680 PolarHBondContact O-N 2.78Å; S2678-M2680 VanDerWaalsContact O-N 3.17Å
2679	T	26	Very low	27	Very low	122.8 Å²	122.8	135.9 Å²	135.9	75%	0.753	78%	0.78	S	S	*	*			trans	-69.5	108.3	169.9	3.3	0	0	0	0	112.1	T2677 V2681	T2677-T2679 PolarHBondContact O-N 3.07Å; T2679-V2681 HydrophobicContact CG2-CG2 4.25Å; T2679-V2681 PolarHBondContact O-N 3.34Å
2680	M	24.7	Very low	27.1	Very low	172.6 Å²	172.6	136.2 Å²	136.2	85%	0.85	78%	0.781	S	S	*	*			trans	-75.5	118.9	159.2	-80.9	-77	-177.1	0	0	109.1	S2678 T2682	S2678-M2680 PolarHBondContact O-N 2.78Å; S2678-M2680 VanDerWaalsContact O-N 3.17Å; M2680-T2682 PolarHBondContact O-N 2.93Å; M2680-T2682 VanDerWaalsContact O-N 3.17Å
2681	V	27.1	Very low	26.9	Very low	120.4 Å²	120.4	134.7 Å²	134.7	73%	0.73	78%	0.779	S	S	*	*			trans	-97.8	105.7	171.5	-179.5	0	0	0	0	108.8	T2679 T2683	T2679-V2681 HydrophobicContact CG2-CG2 4.25Å; T2679-V2681 PolarHBondContact O-N 3.34Å; V2681-T2683 HydrophobicContact CG1-CG2 4.22Å; V2681-T2683 PolarHBondContact O-N 3.35Å
2682	T	26.3	Very low	27	Very low	126.4 Å²	126.4	129.3 Å²	129.3	78%	0.775	78%	0.775	S	S	*	*			trans	-90.3	100.7	172.3	43.5	0	0	0	0	110.7	M2680 T2684	M2680-T2682 PolarHBondContact O-N 2.93Å; M2680-T2682 VanDerWaalsContact O-N 3.17Å; T2682-T2684 PolarHBondContact O-N 3.14Å; T2682-T2684 VanDerWaalsContact O-N 3.08Å
2683	T	29.3	Very low	26.8	Very low	125.4 Å²	125.4	128 Å²	128	77%	0.769	78%	0.777	S	S	*	*			trans	-92.1	110.6	162.1	42	0	0	0	0	109.9	V2681 P2685	V2681-T2683 HydrophobicContact CG1-CG2 4.22Å; V2681-T2683 PolarHBondContact O-N 3.35Å; T2683-P2685 WeakPolarHBondContact O-CD 3.16Å; T2683-P2685 VanDerWaalsContact O-N 3.11Å
2684	T	27.4	Very low	26.7	Very low	116.6 Å²	116.6	127.2 Å²	127.2	72%	0.715	78%	0.778	S	S	*	*			trans	-53.4	131.9	170.4	47.8	0	0	0	0	113	T2682 T2686	T2682-T2684 PolarHBondContact O-N 3.14Å; T2682-T2684 VanDerWaalsContact O-N 3.08Å; T2684-T2686 PolarHBondContact O-N 3.19Å
2685	P	30	Very low	26.6	Very low	122 Å²	122	126.5 Å²	126.5	79%	0.792	78%	0.779	S	S	*	*			trans	-76.7	134.2	168.5	25.3	-22.7	0	0	0	110	T2683 T2687	T2683-P2685 WeakPolarHBondContact O-CD 3.16Å; T2683-P2685 VanDerWaalsContact O-N 3.11Å; P2685-T2687 PolarHBondContact O-N 2.95Å
2686	T	27.7	Very low	26.6	Very low	126.8 Å²	126.8	129.3 Å²	129.3	78%	0.778	78%	0.783	S	S	*	*			trans	-96.1	113.7	173.7	46.6	0	0	0	0	110.8	T2684 T2688	T2684-T2686 PolarHBondContact O-N 3.19Å; T2686-T2688 PolarHBondContact O-N 3.07Å; T2686-T2688 VanDerWaalsContact O-N 3.16Å
2687	T	26.3	Very low	26.7	Very low	130.6 Å²	130.6	129.2 Å²	129.2	80%	0.801	78%	0.782	S	S	*	*			trans	-59.3	118.4	172.9	-52.4	0	0	0	0	110.5	P2685 T2689	P2685-T2687 PolarHBondContact O-N 2.95Å; T2687-T2689 VanDerWaalsContact C-N 3.31Å; T2687-T2689 PolarHBondContact O-N 3.37Å
2688	T	28.3	Very low	26.8	Very low	120.2 Å²	120.2	131.3 Å²	131.3	74%	0.737	78%	0.784	S	S	*	*			trans	-114.4	118.5	164.7	-48.9	0	0	0	0	109.4	T2686 V2690	T2686-T2688 PolarHBondContact O-N 3.07Å; T2686-T2688 VanDerWaalsContact O-N 3.16Å; T2688-V2690 HydrophobicContact CG2-CG2 4.16Å; T2688-V2690 PolarHBondContact O-N 3.49Å
2689	T	24.3	Very low	27	Very low	128.2 Å²	128.2	130.8 Å²	130.8	79%	0.787	78%	0.78	S	S	*	*			trans	-76.9	108.1	177.2	20.6	0	0	0	0	110.7	T2687 T2691	T2687-T2689 VanDerWaalsContact C-N 3.31Å; T2687-T2689 PolarHBondContact O-N 3.37Å; T2689-T2691 VanDerWaalsContact C-N 3.31Å; T2689-T2691 PolarHBondContact O-N 2.91Å
2690	V	28.7	Very low	27.3	Very low	129.2 Å²	129.2	130.7 Å²	130.7	78%	0.783	78%	0.775	S	S	*	*			trans	-108.2	125.1	163.3	-177.9	0	0	0	0	108	T2688 S2692	T2688-V2690 HydrophobicContact CG2-CG2 4.16Å; T2688-V2690 PolarHBondContact O-N 3.49Å; V2690-S2692 PolarHBondContact O-N 3.01Å
2691	T	25.4	Very low	27.8	Very low	128.2 Å²	128.2	132.4 Å²	132.4	79%	0.787	77%	0.774	S	S	*	*			trans	-81.9	123.1	-175.6	29.7	0	0	0	0	111.7	T2689 S2693	T2689-T2691 VanDerWaalsContact C-N 3.31Å; T2689-T2691 PolarHBondContact O-N 2.91Å; T2691-S2693 PolarHBondContact O-N 3.18Å
2692	S	27.3	Very low	28.8	Very low	109 Å²	109	132.2 Å²	132.2	76%	0.762	77%	0.767	S	S	*	*			trans	-69.9	110.3	160.4	59.2	0	0	0	0	114.6	V2690 T2694	V2690-S2692 PolarHBondContact O-N 3.01Å; S2692-T2694 PolarHBondContact O-N 2.8Å
2693	S	25.6	Very low	29.9	Very low	114.2 Å²	114.2	135.7 Å²	135.7	80%	0.799	77%	0.766	S	S	*	*			trans	-109.9	122.9	157.6	46.9	0	0	0	0	111.4	T2691 S2695	T2691-S2693 PolarHBondContact O-N 3.18Å; S2693-S2695 PolarHBondContact O-N 3.12Å
2694	T	26	Very low	31.3	Very low	136.6 Å²	136.6	133.1 Å²	133.1	84%	0.838	75%	0.751	S	S	*	*			trans	-65.2	117	169.2	47.4	0	0	0	0	113.3	S2692 E2696	S2692-T2694 PolarHBondContact O-N 2.8Å; T2694-E2696 PolarHBondContact O-N 2.81Å
2695	S	26.5	Very low	33.4	Very low	108.8 Å²	108.8	128.8 Å²	128.8	76%	0.761	72%	0.724	S	S	*	*			trans	-134.3	100.7	163.8	57.2	0	0	0	0	110	S2693 L2697	S2693-S2695 PolarHBondContact O-N 3.12Å; S2695-L2697 PolarHBondContact O-N 3.18Å
2696	E	25.8	Very low	35.8	Very low	180.4 Å²	180.4	126.4 Å²	126.4	84%	0.843	70%	0.702	S	S	*	*			trans	-83.6	101.2	178.9	-65.5	-174.1	153.4	0	0	111	T2694 H2698	T2694-E2696 PolarHBondContact O-N 2.81Å; E2696-H2698 PolarHBondContact O-N 3.23Å; E2696-H2698 PolarHBondContact O-ND1 2.85Å
2697	L	27.3	Very low	38.5	Very low	160.2 Å²	160.2	120.4 Å²	120.4	84%	0.839	67%	0.665	S	S	*	*			trans	-103.1	112.6	174.7	-76.2	168.8	0	0	0	110.9	S2695 S2699	S2695-L2697 PolarHBondContact O-N 3.18Å; L2697-S2699 PolarHBondContact O-N 3.04Å
2698	H	27.5	Very low	41.4	Very low	164.2 Å²	164.2	114.6 Å²	114.6	76%	0.76	63%	0.629	S	S	*	*			trans	-38.5	98.9	171.3	-77.1	67.8	0	0	0	113.5	E2696 N2700	E2696-H2698 PolarHBondContact O-N 3.23Å; E2696-H2698 PolarHBondContact O-ND1 2.85Å; H2698-N2700 VanDerWaalsContact C-N 3.35Å; H2698-N2700 PolarHBondContact O-N 3.33Å
2699	S	28.9	Very low	44.4	Very low	103.2 Å²	103.2	108.9 Å²	108.9	72%	0.722	59%	0.594	S	S	*	*			trans	-72.5	94.5	165.6	54.9	0	0	0	0	110.1	L2697 Y2701	L2697-S2699 PolarHBondContact O-N 3.04Å; S2699-Y2701 WeakPolarHBondContact O-CD2 3.36Å; S2699-Y2701 PolarHBondContact O-N 3.06Å; S2699-Y2701 VanDerWaalsContact O-N 3.15Å
2700	N	33	Very low	47.5	Very low	122 Å²	122	102.9 Å²	102.9	65%	0.652	56%	0.557	S	S	*	*			trans	-62.2	124.7	179.4	-77.2	-33.3	0	0	0	111.9	H2698 I2702	H2698-N2700 VanDerWaalsContact C-N 3.35Å; H2698-N2700 PolarHBondContact O-N 3.33Å; N2700-I2702 VanDerWaalsContact C-N 3.29Å; N2700-I2702 PolarHBondContact O-N 3.12Å
2701	Y	36.2	Very low	50.5	Low	207.6 Å²	207.6	97.6 Å²	97.6	81%	0.814	52%	0.524	S	S	*	.			trans	-71.6	88.2	178.3	-79.9	-96.3	0	0	0	111.4	S2699 R2703	S2699-Y2701 WeakPolarHBondContact O-CD2 3.36Å; S2699-Y2701 PolarHBondContact O-N 3.06Å; S2699-Y2701 VanDerWaalsContact O-N 3.15Å; Y2701-R2703 PolarHBondContact O-N 3.26Å; Y2701-R2703 VanDerWaalsContact O-N 3.1Å
2702	I	46.8	Very low	53.4	Low	116.2 Å²	116.2	92.4 Å²	92.4	60%	0.596	49%	0.493	S	S	*	.			trans	-65.8	117.1	165.2	-59.1	175.8	0	0	0	107.5	T2586 N2700 P2704	T2586-I2702 HydrophobicContact CG2-CG2 4.05Å; N2700-I2702 VanDerWaalsContact C-N 3.29Å; N2700-I2702 PolarHBondContact O-N 3.12Å; I2702-P2704 WeakPolarHBondContact O-CD 3.18Å
2703	R	50.5	Low	56.3	Low	199.6 Å²	199.6	90.4 Å²	90.4	75%	0.753	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-67.9	128.9	174.4	-86.8	-175	-178.5	-178.8	2.7	108.7	Q2562 Y2701 I2705	Q2562-R2703 VanDerWaalsContact CD-NH1 3.26Å; Q2562-R2703 VanDerWaalsContact OE1-CD 3.3Å; Y2701-R2703 PolarHBondContact O-N 3.26Å; Y2701-R2703 VanDerWaalsContact O-N 3.1Å; R2703-I2705 PolarHBondContact O-N 3.14Å
2704	P	59	Low	59.4	Low	71 Å²	71	85.4 Å²	85.4	46%	0.461	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-64.7	139.5	177.5	26.8	-33.7	0	0	0	110.3	T2629 C2631 I2702 Q2706	T2629-P2704 HydrophobicContact CG2-CG 4.4Å; C2631-P2704 HydrophobicContact CB-CB 4.14Å; C2631-P2704 HydrophobicContact CB-CG 3.83Å; C2631-P2704 VanDerWaalsContact CB-CG 3.46Å; I2702-P2704 WeakPolarHBondContact O-CD 3.18Å; P2704-Q2706 PolarHBondContact O-N 3.35Å
2705	I	71	Confident	62.5	Low	26.2 Å²	26.2	80.6 Å²	80.6	13%	0.134	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-66.9	130.1	178.1	-64.2	174.5	0	0	0	108.9	Y2517 T2559 V2563 V2582 T2586 Q2589 R2703 L2707	Y2517-I2705 HydrophobicContact CE1-CD1 4.37Å; Y2517-I2705 HydrophobicContact CE1-CG2 4.5Å; T2559-I2705 HydrophobicContact CG2-CG2 3.55Å; T2559-I2705 VanDerWaalsContact CG2-CG2 3.45Å; V2563-I2705 HydrophobicContact CG2-CD1 3.88Å; V2563-I2705 HydrophobicContact CG2-CG1 4.05Å; V2563-I2705 HydrophobicContact CG2-CG2 4.22Å; V2582-I2705 HydrophobicContact CG1-CD1 3.96Å; V2582-I2705 HydrophobicContact CG1-CG1 4.36Å; T2586-I2705 HydrophobicContact CG2-CD1 4.44Å; T2586-I2705 VanDerWaalsContact OG1-CD1 3.26Å; T2586-I2705 WeakPolarHBondContact OG1-CD1 3.38Å; Q2589-I2705 PolarHBondContact OE1-O 2.86Å; R2703-I2705 PolarHBondContact O-N 3.14Å; I2705-L2707 PolarHBondContact O-N 2.69Å
2706	Q	79.6	Confident	65.7	Low	72.8 Å²	72.8	75.6 Å²	75.6	34%	0.34	37%	0.371	S	S	.	.			trans	-91.5	119.4	179.1	-136	-177.7	-26.3	0	0	110.2	T2559 V2560 V2627 T2629 P2704	T2559-Q2706 CarbonylContact C-O 3.54Å; T2559-Q2706 WeakPolarHBondContact CA-O 3.37Å; V2560-Q2706 HydrophobicContact CB-CB 4.39Å; V2560-Q2706 HydrophobicContact CB-CG 4.27Å; V2560-Q2706 HydrophobicContact CG2-CG 4.24Å; V2560-Q2706 PolarHBondContact N-O 3.04Å; V2627-Q2706 HydrophobicContact CG1-CB 3.91Å; V2627-Q2706 HydrophobicContact CG1-CG 3.89Å; V2627-Q2706 VanDerWaalsContact CG1-CG 3.5Å; V2627-Q2706 HydrophobicContact CG2-CG 4.44Å; V2627-Q2706 VanDerWaalsContact CG2-NE2 3.33Å; T2629-Q2706 HydrophobicContact CG2-CG 3.79Å; P2704-Q2706 PolarHBondContact O-N 3.35Å
2707	L	85.5	Confident	68.9	Low	0.2 Å²	0.2	68.3 Å²	68.3	0%	0.001	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	131.3	175.6	-69.8	172.7	0	0	0	110.6	Y2517 L2519 A2558 T2559 Q2589 L2591 V2627 V2628 I2705	Y2517-L2707 HydrophobicContact CD2-CD2 4.49Å; Y2517-L2707 HydrophobicContact CE2-CD2 3.8Å; L2519-L2707 HydrophobicContact CD1-CD1 3.95Å; L2519-L2707 HydrophobicContact CD1-CD2 4.32Å; A2558-L2707 CarbonylContact O-C 3.49Å; A2558-L2707 WeakPolarHBondContact O-CA 3.35Å; T2559-L2707 HydrophobicContact CG2-CD2 3.97Å; Q2589-L2707 HydrophobicContact CB-CD1 4.21Å; Q2589-L2707 HydrophobicContact CG-CD1 4.17Å; Q2589-L2707 WeakPolarHBondContact O-CD1 3.37Å; L2591-L2707 HydrophobicContact CD2-CD1 4.24Å; V2627-L2707 CarbonylContact C-O 3.51Å; V2627-L2707 WeakPolarHBondContact CA-O 3.34Å; V2628-L2707 HydrophobicContact CB-CB 4.41Å; V2628-L2707 HydrophobicContact CG2-CB 4.47Å; V2628-L2707 PolarHBondContact N-O 3Å; V2628-L2707 PolarHBondContact O-N 3.36Å; I2705-L2707 PolarHBondContact O-N 2.69Å
2708	Q	87.4	Confident	72	Confident	7.6 Å²	7.6	62.4 Å²	62.4	4%	0.036	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	136.2	174.2	179.8	177.3	36.5	0	0	110.5	Y2557 A2558 V2560 G2625 G2626 V2627 M2710 G3081	Y2557-Q2708 CarbonylContact C-O 3.58Å; Y2557-Q2708 WeakPolarHBondContact CA-O 3.38Å; A2558-Q2708 PolarHBondContact N-O 2.86Å; A2558-Q2708 PolarHBondContact O-N 3.26Å; V2560-Q2708 HydrophobicContact CG2-CB 3.43Å; V2560-Q2708 VanDerWaalsContact CG2-CB 3.46Å; V2560-Q2708 HydrophobicContact CG2-CG 4.38Å; G2625-Q2708 WeakPolarHBondContact O-CG 3.43Å; G2625-Q2708 PolarHBondContact O-NE2 3.14Å; G2626-Q2708 WeakPolarHBondContact O-CA 3.34Å; V2627-Q2708 HydrophobicContact CG2-CB 4.39Å; V2627-Q2708 HydrophobicContact CG2-CG 4.47Å; Q2708-M2710 PolarHBondContact O-N 3.39Å; Q2708-M2710 VanDerWaalsContact O-N 3.12Å; Q2708-G3081 PolarHBondContact NE2-O 3.31Å
2709	R	89.6	Confident	75.1	Confident	1.8 Å²	1.8	55.1 Å²	55.1	1%	0.007	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	108	170.8	-175.1	-174.8	-56.2	-80.5	-1.1	109.6	Q2555 Y2556 Y2557 C2620 G2621 R2622 S2623 G2625 G2626 I2711	Q2555-R2709 VanDerWaalsContact CD-NH1 3.28Å; Y2556-R2709 CarbonylContact O-C 3.55Å; Y2557-R2709 HydrophobicContact CD1-CB 3.84Å; Y2557-R2709 HydrophobicContact CD1-CG 4.26Å; Y2557-R2709 HydrophobicContact CE1-CB 3.88Å; Y2557-R2709 HydrophobicContact CE1-CG 4.18Å; Y2557-R2709 VanDerWaalsContact CE1-CZ 3.48Å; Y2557-R2709 HydrophobicContact CE2-CG 4.38Å; Y2557-R2709 HydrophobicContact CG-CB 4.43Å; Y2557-R2709 HydrophobicContact CG-CG 4.46Å; Y2557-R2709 VanDerWaalsContact CZ-NE 3.31Å; Y2557-R2709 VanDerWaalsContact CZ-NH1 3.25Å; Y2557-R2709 VanDerWaalsContact OH-CZ 3.28Å; Y2557-R2709 PolarHBondContact OH-NE 3Å; Y2557-R2709 PolarHBondContact OH-NH1 3.07Å; Y2557-R2709 VanDerWaalsContact OH-NH1 3.09Å; Y2557-R2709 PolarHBondContact OH-NH2 3.16Å; C2620-R2709 PolarHBondContact O-NH2 3Å; G2621-R2709 VanDerWaalsContact O-CZ 3.29Å; G2621-R2709 PolarHBondContact O-NE 3.23Å; G2621-R2709 PolarHBondContact O-NH1 3.48Å; G2621-R2709 PolarHBondContact O-NH2 2.93Å; R2622-R2709 VanDerWaalsContact O-CD 3.32Å; R2622-R2709 WeakPolarHBondContact O-CD 3.27Å; R2622-R2709 PolarHBondContact O-NE 3.09Å; R2622-R2709 VanDerWaalsContact O-NE 3.08Å; R2622-R2709 PolarHBondContact O-NH1 3.28Å; R2622-R2709 VanDerWaalsContact O-NH1 3.09Å; S2623-R2709 WeakPolarHBondContact O-CD 3.4Å; S2623-R2709 PolarHBondContact O-NH1 3.44Å; G2625-R2709 WeakPolarHBondContact CA-O 3.42Å; G2625-R2709 PolarHBondContact N-O 3.27Å; G2626-R2709 PolarHBondContact O-N 2.95Å; R2709-I2711 VanDerWaalsContact CD-O 3.29Å; R2709-I2711 WeakPolarHBondContact CD-O 3.21Å; R2709-I2711 WeakPolarHBondContact CG-O 3.36Å
2710	M	90.5	Very high	78.2	Confident	1.4 Å²	1.4	53.1 Å²	53.1	1%	0.007	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	-31	178.2	-66.3	-179.4	53.3	0	0	113	V2518 Y2556 A2558 V2624 Q2708 V2766 S2767 T2768 Q2772 I2776	V2518-M2710 HydrophobicContact CG1-CE 3.81Å; V2518-M2710 HydrophobicContact CG2-CE 4.11Å; Y2556-M2710 PolarHBondContact O-N 3Å; A2558-M2710 HydrophobicContact CB-CE 4Å; A2558-M2710 HydrophobicContact CB-CG 4Å; A2558-M2710 HydrophobicContact CB-SD 3.28Å; A2558-M2710 WeakPolarHBondContact CB-SD 3.28Å; V2624-M2710 VanDerWaalsContact CG1-O 3.31Å; V2624-M2710 WeakPolarHBondContact CG1-O 3.37Å; Q2708-M2710 PolarHBondContact O-N 3.39Å; Q2708-M2710 VanDerWaalsContact O-N 3.12Å; M2710-V2766 CarbonylContact O-C 3.56Å; M2710-V2766 VanDerWaalsContact O-CA 3.28Å; M2710-V2766 WeakPolarHBondContact O-CA 3.33Å; M2710-S2767 VanDerWaalsContact CA-O 3.3Å; M2710-S2767 WeakPolarHBondContact CA-O 3.35Å; M2710-S2767 WeakPolarHBondContact CG-O 3.37Å; M2710-S2767 PolarHBondContact O-N 3.13Å; M2710-T2768 HydrophobicContact CB-CG2 4.23Å; M2710-T2768 HydrophobicContact CE-CG2 3.41Å; M2710-T2768 HydrophobicContact CG-CG2 4.36Å; M2710-T2768 HydrophobicContact SD-CG2 4.04Å; M2710-Q2772 HydrophobicContact CE-CB 3.67Å; M2710-Q2772 HydrophobicContact CE-CG 4.37Å; M2710-Q2772 HydrophobicContact CG-CG 4.48Å; M2710-Q2772 HydrophobicContact SD-CB 3.99Å; M2710-Q2772 HydrophobicContact SD-CG 4.12Å; M2710-I2776 HydrophobicContact CE-CD1 3.44Å; M2710-I2776 HydrophobicContact CE-CG1 4.08Å; M2710-I2776 HydrophobicContact SD-CD1 3.93Å; M2710-I2776 HydrophobicContact SD-CG1 4.45Å
2711	I	90.9	Very high	80.9	Confident	19.4 Å²	19.4	47.3 Å²	47.3	10%	0.099	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	140.7	-177	-55.7	-172.5	0	0	0	110.1	Y2556 R2709 L2764 N2765 V2766	Y2556-I2711 HydrophobicContact CD1-CD1 4.38Å; Y2556-I2711 HydrophobicContact CD2-CB 3.81Å; Y2556-I2711 HydrophobicContact CD2-CD1 3.68Å; Y2556-I2711 HydrophobicContact CD2-CG1 4.09Å; Y2556-I2711 HydrophobicContact CD2-CG2 4.13Å; Y2556-I2711 HydrophobicContact CE2-CD1 4.17Å; Y2556-I2711 HydrophobicContact CG-CB 4.27Å; Y2556-I2711 HydrophobicContact CG-CD1 3.91Å; Y2556-I2711 HydrophobicContact CG-CG1 4.24Å; Y2556-I2711 PolarHBondContact N-O 2.76Å; Y2556-I2711 PolarHBondContact O-N 3.04Å; Y2556-I2711 VanDerWaalsContact O-N 3.13Å; R2709-I2711 VanDerWaalsContact CD-O 3.29Å; R2709-I2711 WeakPolarHBondContact CD-O 3.21Å; R2709-I2711 WeakPolarHBondContact CG-O 3.36Å; I2711-L2764 HydrophobicContact CG2-CD2 4.1Å; I2711-N2765 CarbonylContact C-O 3.57Å; I2711-N2765 VanDerWaalsContact CA-O 3.29Å; I2711-N2765 WeakPolarHBondContact CA-O 3.45Å; I2711-V2766 HydrophobicContact CD1-CG1 4.35Å; I2711-V2766 HydrophobicContact CD1-CG2 4.04Å; I2711-V2766 HydrophobicContact CG1-CB 4.37Å; I2711-V2766 HydrophobicContact CG1-CG1 4.08Å; I2711-V2766 HydrophobicContact CG1-CG2 4.02Å; I2711-V2766 HydrophobicContact CG2-CG2 4.47Å
2712	S	86.8	Confident	83.4	Confident	19 Å²	19	39.9 Å²	39.9	13%	0.133	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	169.8	174.8	63.5	0	0	0	0	112.5	M2554 C2714 N2765	M2554-S2712 VanDerWaalsContact O-O 3.1Å; S2712-C2714 PolarHBondContact O-N 3.09Å; S2712-C2714 VanDerWaalsContact O-N 3.11Å; S2712-N2765 PolarHBondContact N-O 3.06Å; S2712-N2765 PolarHBondContact OG-N 3.44Å
2713	R	88.1	Confident	85.2	Confident	66.2 Å²	66.2	35.2 Å²	35.2	25%	0.25	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.1	125.8	155	-74.4	176.4	174.2	90.9	5.1	108.2	C2553 M2554 Q2555 D2595 S2597 E2608	C2553-R2713 HydrophobicContact CB-CB 4.26Å; C2553-R2713 HydrophobicContact CB-CG 4Å; M2554-R2713 CarbonylContact O-C 3.56Å; M2554-R2713 VanDerWaalsContact O-CA 3.26Å; M2554-R2713 WeakPolarHBondContact O-CA 3.28Å; Q2555-R2713 HydrophobicContact CG-CB 4.42Å; Q2555-R2713 HydrophobicContact CG-CG 3.72Å; D2595-R2713 PolarHBondContact O-NH2 3.16Å; S2597-R2713 PolarHBondContact O-NH2 3.26Å; E2608-R2713 IonicContact OE1-CZ 3.8Å; E2608-R2713 IonicContact OE1-NH1 3.05Å; E2608-R2713 PolarHBondContact OE1-NH1 2.92Å; E2608-R2713 IonicContact OE2-CZ 2.77Å; E2608-R2713 IonicContact OE2-NH1 2.76Å; E2608-R2713 PolarHBondContact OE2-NH1 2.68Å
2714	C	90.4	Very high	86.7	Confident	10 Å²	10	30.1 Å²	30.1	7%	0.068	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	160.9	177.6	61.6	0	0	0	0	110.2	C2553 M2554 S2712 T2763 L2764	C2553-C2714 CarbonylContact C-O 3.55Å; C2553-C2714 PolarHBondContact N-O 2.99Å; M2554-C2714 WeakPolarHBondContact CB-O 3.37Å; M2554-C2714 VanDerWaalsContact CE-SG 3.56Å; M2554-C2714 PolarHBondContact N-O 3.13Å; M2554-C2714 PolarHBondContact O-N 3.08Å; M2554-C2714 PolarHBondContact O-SG 3.34Å; S2712-C2714 PolarHBondContact O-N 3.09Å; S2712-C2714 VanDerWaalsContact O-N 3.11Å; C2714-T2763 VanDerWaalsContact CB-O 3.31Å; C2714-T2763 WeakPolarHBondContact CB-O 3.32Å; C2714-L2764 HydrophobicContact CB-CD2 4.26Å
2715	S	90.8	Very high	87.4	Confident	35.6 Å²	35.6	29.6 Å²	29.6	25%	0.249	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	146	167.1	75.1	0	0	0	0	110	L2551 H2761 H2762	L2551-S2715 WeakPolarHBondContact O-CA 3.32Å; S2715-H2761 PolarHBondContact O-ND1 2.88Å; S2715-H2761 VanDerWaalsContact O-ND1 3.09Å; S2715-H2762 PolarHBondContact OG-ND1 2.95Å; S2715-H2762 VanDerWaalsContact OG-ND1 3.14Å
2716	C	93.1	Very high	87.6	Confident	3 Å²	3	28.6 Å²	28.6	2%	0.02	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	134.3	170	-176.1	0	0	0	0	110.5	H2550 L2551 M2554 L2759 L2760 H2761	H2550-C2716 CarbonylContact C-O 3.59Å; H2550-C2716 WeakPolarHBondContact CA-O 3.22Å; L2551-C2716 HydrophobicContact CB-CB 4.22Å; L2551-C2716 HydrophobicContact CD1-CB 4.29Å; L2551-C2716 PolarHBondContact N-O 3.12Å; L2551-C2716 PolarHBondContact O-N 3.14Å; L2551-C2716 VanDerWaalsContact O-N 3.1Å; M2554-C2716 HydrophobicContact CE-CB 3.52Å; M2554-C2716 HydrophobicContact SD-CB 3.62Å; M2554-C2716 WeakPolarHBondContact SD-CB 3.46Å; C2716-L2759 VanDerWaalsContact SG-CD1 3.5Å; C2716-L2759 WeakPolarHBondContact SG-CD1 3.4Å; C2716-L2760 CarbonylContact C-O 3.51Å; C2716-L2760 VanDerWaalsContact CA-O 3.3Å; C2716-L2760 WeakPolarHBondContact CA-O 3.42Å; C2716-H2761 VanDerWaalsContact CB-CE1 3.46Å; C2716-H2761 WeakPolarHBondContact CB-CE1 3.41Å; C2716-H2761 WeakPolarHBondContact CB-ND1 3.34Å; C2716-H2761 WeakPolarHBondContact CB-NE2 3.37Å; C2716-H2761 PolarHBondContact SG-CE1 3.01Å; C2716-H2761 VanDerWaalsContact SG-CE1 3.55Å; C2716-H2761 PolarHBondContact SG-NE2 3.27Å
2717	E	93.7	Very high	87.1	Confident	26.4 Å²	26.4	28 Å²	28	12%	0.123	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	138.1	173.8	-65.4	-175	-178.1	0	0	110.7	P2101 G2549 H2550 F2719 L2759 L2760 H2762	P2101-E2717 WeakPolarHBondContact CB-OE1 3.36Å; P2101-E2717 VanDerWaalsContact CG-OE1 3.24Å; P2101-E2717 WeakPolarHBondContact CG-OE1 3.37Å; G2549-E2717 CarbonylContact O-C 3.6Å; G2549-E2717 VanDerWaalsContact O-CA 3.31Å; G2549-E2717 WeakPolarHBondContact O-CA 3.31Å; H2550-E2717 IonicContact CE1-OE1 2.99Å; H2550-E2717 PolarHBondContact CE1-OE1 3.1Å; H2550-E2717 VanDerWaalsContact CE1-OE1 3.32Å; H2550-E2717 VanDerWaalsContact ND1-CG 3.33Å; H2550-E2717 WeakPolarHBondContact ND1-CG 3.32Å; H2550-E2717 IonicContact ND1-OE1 3.37Å; H2550-E2717 PolarHBondContact ND1-OE1 3.11Å; E2717-F2719 HydrophobicContact CB-CE2 3.72Å; E2717-F2719 HydrophobicContact CB-CZ 4.16Å; E2717-F2719 WeakPolarHBondContact OE2-CZ 3.36Å; E2717-L2759 WeakPolarHBondContact O-CA 3.29Å; E2717-L2760 HydrophobicContact CB-CB 4.35Å; E2717-L2760 PolarHBondContact N-O 2.96Å; E2717-L2760 PolarHBondContact O-N 3.34Å; E2717-H2762 IonicContact OE1-CE1 3.28Å; E2717-H2762 IonicContact OE2-CE1 3.82Å
2718	V	93.1	Very high	86	Confident	37.2 Å²	37.2	30.3 Å²	30.3	23%	0.225	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	120.1	-174.3	-174.8	0	0	0	0	108.4	V2548 G2549 L2551 T2758 L2759	V2548-V2718 CarbonylContact C-O 3.6Å; V2548-V2718 WeakPolarHBondContact CA-O 3.5Å; G2549-V2718 PolarHBondContact N-O 3.29Å; G2549-V2718 PolarHBondContact O-N 3.06Å; L2551-V2718 HydrophobicContact CD1-CG2 3.76Å; V2718-T2758 WeakPolarHBondContact CA-O 3.39Å; V2718-L2759 HydrophobicContact CB-CD2 4.23Å; V2718-L2759 HydrophobicContact CG1-CD2 3.91Å; V2718-L2759 HydrophobicContact CG2-CD1 3.89Å; V2718-L2759 HydrophobicContact CG2-CD2 3.74Å; V2718-L2759 HydrophobicContact CG2-CG 4.38Å
2719	F	93	Very high	84.6	Confident	9.8 Å²	9.8	32.1 Å²	32.1	4%	0.043	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	119.2	173.5	-54.6	-89	0	0	0	108.2	V2098 I2100 L2485 C2488 L2547 V2548 E2717 V2757 T2758	V2098-F2719 HydrophobicContact CG1-CE1 4.5Å; I2100-F2719 HydrophobicContact CG1-CE1 4.49Å; L2485-F2719 HydrophobicContact CB-CD2 4.43Å; L2485-F2719 HydrophobicContact CD1-CD1 4.42Å; L2485-F2719 HydrophobicContact CD1-CD2 4.3Å; L2485-F2719 HydrophobicContact CD1-CE1 3.87Å; L2485-F2719 HydrophobicContact CD1-CE2 3.72Å; L2485-F2719 HydrophobicContact CD1-CZ 3.62Å; L2485-F2719 VanDerWaalsContact CD1-CZ 3.46Å; L2485-F2719 HydrophobicContact CG-CE2 4.35Å; L2485-F2719 HydrophobicContact CG-CZ 4.46Å; C2488-F2719 HydrophobicContact CB-CD1 4.18Å; L2547-F2719 WeakPolarHBondContact O-CA 3.38Å; V2548-F2719 HydrophobicContact CG1-CD1 4.19Å; V2548-F2719 HydrophobicContact CG1-CE1 3.85Å; V2548-F2719 HydrophobicContact CG2-CD1 4.3Å; E2717-F2719 HydrophobicContact CB-CE2 3.72Å; E2717-F2719 HydrophobicContact CB-CZ 4.16Å; E2717-F2719 WeakPolarHBondContact OE2-CZ 3.36Å; F2719-V2757 CarbonylContact O-C 3.52Å; F2719-V2757 WeakPolarHBondContact O-CA 3.4Å; F2719-T2758 HydrophobicContact CD2-CG2 4.45Å; F2719-T2758 PolarHBondContact N-O 3.06Å; F2719-T2758 PolarHBondContact O-N 3.07Å
2720	Y	92.3	Very high	83.5	Confident	63 Å²	63	37.8 Å²	37.8	25%	0.247	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	123.8	169.9	172.4	-121.2	0	0	0	109.7	S2546 L2547 H2722 D2755 T2756 V2757 I3357	S2546-Y2720 CarbonylContact C-O 3.54Å; S2546-Y2720 VanDerWaalsContact CA-O 3.26Å; S2546-Y2720 WeakPolarHBondContact CA-O 3.33Å; L2547-Y2720 HydrophobicContact CB-CD1 4.42Å; L2547-Y2720 HydrophobicContact CD2-CD1 4.47Å; L2547-Y2720 PolarHBondContact N-O 3.08Å; L2547-Y2720 PolarHBondContact O-N 3.05Å; Y2720-H2722 HydrophobicContact CE1-CB 3.89Å; Y2720-H2722 HydrophobicContact CE2-CB 4.48Å; Y2720-H2722 PolarHBondContact OH-ND1 3Å; Y2720-D2755 HydrophobicContact CE2-CB 4.35Å; Y2720-D2755 PolarHBondContact OH-OD2 3.02Å; Y2720-T2756 CarbonylContact C-O 3.56Å; Y2720-T2756 WeakPolarHBondContact CA-O 3.37Å; Y2720-T2756 WeakPolarHBondContact CD2-O 3.43Å; Y2720-V2757 HydrophobicContact CD2-CB 4.04Å; Y2720-V2757 HydrophobicContact CD2-CG2 3.84Å; Y2720-V2757 HydrophobicContact CE2-CG2 4.15Å; Y2720-V2757 HydrophobicContact CG-CG2 4.25Å; Y2720-I3357 HydrophobicContact CE1-CD1 3.86Å; Y2720-I3357 HydrophobicContact CE1-CG1 4.01Å; Y2720-I3357 HydrophobicContact CE1-CG2 4.17Å
2721	I	90.3	Very high	82.3	Confident	0.2 Å²	0.2	40.8 Å²	40.8	0%	0.001	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	128.9	177.4	-56.1	155.2	0	0	0	108.3	G2484 I2487 C2488 K2544 S2545 Y2723 D2755 T2756	G2484-I2721 VanDerWaalsContact O-CD1 3.31Å; G2484-I2721 WeakPolarHBondContact O-CD1 3.38Å; I2487-I2721 HydrophobicContact CB-CD1 3.67Å; I2487-I2721 HydrophobicContact CD1-CD1 4.48Å; I2487-I2721 HydrophobicContact CG2-CD1 3.53Å; I2487-I2721 VanDerWaalsContact CG2-CD1 3.48Å; I2487-I2721 HydrophobicContact CG2-CG1 4.35Å; I2487-I2721 HydrophobicContact CG2-CG2 4.36Å; C2488-I2721 VanDerWaalsContact SG-CG1 3.58Å; K2544-I2721 HydrophobicContact CG-CG2 4.38Å; S2545-I2721 WeakPolarHBondContact O-CA 3.48Å; I2721-Y2723 HydrophobicContact CB-CE2 4.41Å; I2721-Y2723 HydrophobicContact CG2-CD2 4.3Å; I2721-Y2723 HydrophobicContact CG2-CE1 4.42Å; I2721-Y2723 HydrophobicContact CG2-CE2 3.5Å; I2721-Y2723 VanDerWaalsContact CG2-CE2 3.47Å; I2721-Y2723 WeakPolarHBondContact CG2-OH 3.47Å; I2721-D2755 CarbonylContact O-C 3.38Å; I2721-D2755 WeakPolarHBondContact O-CA 3.38Å; I2721-T2756 PolarHBondContact N-O 3.12Å; I2721-T2756 PolarHBondContact O-N 2.93Å
2722	H	88.9	Confident	81	Confident	51 Å²	51	42 Å²	42	24%	0.236	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	142.1	-179.3	-177.1	46.8	0	0	0	111.5	S2545 Y2720 D2755	S2545-H2722 PolarHBondContact N-O 2.92Å; S2545-H2722 PolarHBondContact O-N 3.23Å; S2545-H2722 PolarHBondContact OG-O 3.14Å; Y2720-H2722 HydrophobicContact CE1-CB 3.89Å; Y2720-H2722 HydrophobicContact CE2-CB 4.48Å; Y2720-H2722 PolarHBondContact OH-ND1 3Å; H2722-D2755 VanDerWaalsContact CA-OD1 3.31Å; H2722-D2755 WeakPolarHBondContact CA-OD1 3.42Å; H2722-D2755 IonicContact CE1-OD1 3.02Å; H2722-D2755 IonicContact CE1-OD2 3.23Å; H2722-D2755 PolarHBondContact CE1-OD2 3.1Å; H2722-D2755 IonicContact CG-OD1 3.35Å; H2722-D2755 IonicContact CG-OD2 3.31Å; H2722-D2755 VanDerWaalsContact ND1-CG 3.32Å; H2722-D2755 IonicContact ND1-OD1 3.1Å; H2722-D2755 PolarHBondContact ND1-OD1 2.9Å; H2722-D2755 IonicContact ND1-OD2 3.33Å; H2722-D2755 PolarHBondContact ND1-OD2 2.89Å
2723	Y	85.3	Confident	80	Confident	16.8 Å²	16.8	46.1 Å²	46.1	7%	0.066	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	117.2	178.2	-60	-89.9	0	0	0	111.6	I2487 I2535 L2542 N2543 K2544 I2721 E2752 G2753 A2754 D2755	I2487-Y2723 WeakPolarHBondContact CG2-OH 3.39Å; I2535-Y2723 HydrophobicContact CD1-CD1 3.9Å; I2535-Y2723 HydrophobicContact CD1-CE1 3.47Å; I2535-Y2723 VanDerWaalsContact CD1-CE1 3.48Å; I2535-Y2723 HydrophobicContact CG1-CD1 4.24Å; I2535-Y2723 HydrophobicContact CG1-CE1 4.14Å; L2542-Y2723 HydrophobicContact CB-CD1 4.41Å; N2543-Y2723 WeakPolarHBondContact O-CA 3.43Å; K2544-Y2723 HydrophobicContact CB-CD1 4.03Å; K2544-Y2723 HydrophobicContact CB-CE1 3.86Å; K2544-Y2723 HydrophobicContact CD-CE1 3.92Å; K2544-Y2723 HydrophobicContact CG-CD1 4.17Å; K2544-Y2723 HydrophobicContact CG-CE1 3.58Å; I2721-Y2723 HydrophobicContact CB-CE2 4.41Å; I2721-Y2723 HydrophobicContact CG2-CD2 4.3Å; I2721-Y2723 HydrophobicContact CG2-CE1 4.42Å; I2721-Y2723 HydrophobicContact CG2-CE2 3.5Å; I2721-Y2723 VanDerWaalsContact CG2-CE2 3.47Å; I2721-Y2723 WeakPolarHBondContact CG2-OH 3.47Å; Y2723-E2752 HydrophobicContact CE1-CG 4.45Å; Y2723-E2752 VanDerWaalsContact OH-CG 3.27Å; Y2723-E2752 WeakPolarHBondContact OH-CG 3.46Å; Y2723-E2752 PolarHBondContact OH-OE1 3.15Å; Y2723-E2752 PolarHBondContact OH-OE2 2.81Å; Y2723-G2753 VanDerWaalsContact CE2-CA 3.48Å; Y2723-G2753 VanDerWaalsContact CE2-N 3.33Å; Y2723-G2753 VanDerWaalsContact CZ-CA 3.43Å; Y2723-G2753 VanDerWaalsContact CZ-N 3.28Å; Y2723-G2753 PolarHBondContact OH-N 3.1Å; Y2723-A2754 WeakPolarHBondContact CE2-O 3.34Å; Y2723-D2755 PolarHBondContact N-OD1 3.07Å; Y2723-D2755 VanDerWaalsContact N-OD1 3.1Å
2724	E	80.2	Confident	78.6	Confident	93 Å²	93	48.1 Å²	48.1	44%	0.435	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	138.8	173.4	-151.1	-166.1	155.2	0	0	111.2	K2261 L2542 N2543 A2726	K2261-E2724 IonicContact NZ-OE1 3.19Å; K2261-E2724 PolarHBondContact NZ-OE1 3.32Å; L2542-E2724 CarbonylContact C-O 3.51Å; L2542-E2724 WeakPolarHBondContact CA-O 3.31Å; N2543-E2724 PolarHBondContact N-O 3.05Å; N2543-E2724 PolarHBondContact O-N 3.01Å; N2543-E2724 VanDerWaalsContact O-N 3.11Å; E2724-A2726 PolarHBondContact O-N 3.08Å; E2724-A2726 VanDerWaalsContact O-N 3.09Å
2725	P	75.3	Confident	77.4	Confident	60.6 Å²	60.6	54.7 Å²	54.7	39%	0.394	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.9	117.1	167.4	-28.8	36.9	0	0	0	113.3	K2261 L2542 D2727	K2261-P2725 PolarHBondContact NZ-O 3.06Å; L2542-P2725 HydrophobicContact CD2-CB 4.38Å; L2542-P2725 HydrophobicContact CD2-CG 4.17Å; P2725-D2727 PolarHBondContact O-N 3.06Å
2726	A	74.1	Confident	76.2	Confident	5.2 Å²	5.2	55.8 Å²	55.8	4%	0.043	30%	0.303	C	S	.	.			trans	-60.7	135.2	-175.4	0	0	0	0	0	112.1	F2271 L2541 N2543 E2724 P2728 L2731	F2271-A2726 HydrophobicContact CE1-CB 4.35Å; F2271-A2726 WeakPolarHBondContact CE1-O 3.28Å; F2271-A2726 VanDerWaalsContact CZ-O 3.32Å; F2271-A2726 WeakPolarHBondContact CZ-O 3.13Å; L2541-A2726 HydrophobicContact CB-CB 4.32Å; L2541-A2726 HydrophobicContact CD2-CB 4.12Å; L2541-A2726 HydrophobicContact CG-CB 4.13Å; L2541-A2726 VanDerWaalsContact O-CB 3.3Å; L2541-A2726 WeakPolarHBondContact O-CB 3.34Å; L2541-A2726 PolarHBondContact O-N 3.2Å; N2543-A2726 VanDerWaalsContact OD1-CB 3.26Å; N2543-A2726 WeakPolarHBondContact OD1-CB 3.36Å; E2724-A2726 PolarHBondContact O-N 3.08Å; E2724-A2726 VanDerWaalsContact O-N 3.09Å; A2726-P2728 VanDerWaalsContact O-CD 3.28Å; A2726-P2728 WeakPolarHBondContact O-CD 3.32Å; A2726-L2731 HydrophobicContact CB-CD2 4.22Å
2727	D	69.3	Low	75.2	Confident	61.2 Å²	61.2	57.1 Å²	57.1	33%	0.327	31%	0.31	S	S	.	.			trans	-76.4	118.4	172.7	-172.7	-20.1	0	0	0	109.7	P2725 A2729 N2730	P2725-D2727 PolarHBondContact O-N 3.06Å; D2727-A2729 PolarHBondContact O-N 3.07Å; D2727-A2729 VanDerWaalsContact OD1-CB 3.27Å; D2727-A2729 WeakPolarHBondContact OD1-CB 3.35Å; D2727-A2729 PolarHBondContact OD1-N 3.03Å; D2727-N2730 HydrophobicContact CB-CB 4.44Å; D2727-N2730 CarbonylContact O-C 3.57Å; D2727-N2730 PolarHBondContact O-N 3.06Å; D2727-N2730 PolarHBondContact OD2-ND2 3.45Å
2728	P	63.3	Low	74	Confident	48 Å²	48	58.1 Å²	58.1	31%	0.312	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-12.1	177.9	25.6	-34.9	0	0	0	114	H2269 F2271 A2726	H2269-P2728 VanDerWaalsContact O-CG 3.25Å; H2269-P2728 WeakPolarHBondContact O-CG 3.45Å; F2271-P2728 HydrophobicContact CD1-CB 3.9Å; F2271-P2728 HydrophobicContact CD2-CB 4.47Å; F2271-P2728 HydrophobicContact CE1-CB 3.91Å; F2271-P2728 HydrophobicContact CE1-CG 4.34Å; F2271-P2728 HydrophobicContact CG-CB 4.22Å; F2271-P2728 HydrophobicContact CZ-CB 4.24Å; F2271-P2728 HydrophobicContact CZ-CG 4.47Å; A2726-P2728 VanDerWaalsContact O-CD 3.28Å; A2726-P2728 WeakPolarHBondContact O-CD 3.32Å
2729	A	58.1	Low	72.8	Confident	44.6 Å²	44.6	62 Å²	62	37%	0.369	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-23.5	172.4	0	0	0	0	0	114.3	D2727 P3412	D2727-A2729 PolarHBondContact O-N 3.07Å; D2727-A2729 VanDerWaalsContact OD1-CB 3.27Å; D2727-A2729 WeakPolarHBondContact OD1-CB 3.35Å; D2727-A2729 PolarHBondContact OD1-N 3.03Å; A2729-P3412 HydrophobicContact CB-CG 4.15Å
2730	N	64.8	Low	71.5	Confident	121.4 Å²	121.4	63.2 Å²	63.2	65%	0.649	35%	0.351	S	S	*	.	S	Bend	trans	-125.7	46.6	-173.1	-68.5	-15.1	0	0	0	111.3	D2727	D2727-N2730 HydrophobicContact CB-CB 4.44Å; D2727-N2730 CarbonylContact O-C 3.57Å; D2727-N2730 PolarHBondContact O-N 3.06Å; D2727-N2730 PolarHBondContact OD2-ND2 3.45Å
2731	L	66.2	Low	70	Confident	64.8 Å²	64.8	61.9 Å²	61.9	34%	0.339	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-73.6	144.1	176.5	-67.4	173.9	0	0	0	111.6	F2271 L2541 A2726 I2737	F2271-L2731 HydrophobicContact CD1-CD1 4.18Å; F2271-L2731 HydrophobicContact CD1-CD2 4.15Å; F2271-L2731 HydrophobicContact CE1-CD2 4.01Å; L2541-L2731 HydrophobicContact CD2-CD2 3.62Å; A2726-L2731 HydrophobicContact CB-CD2 4.22Å; L2731-I2737 HydrophobicContact CB-CD1 4.22Å; L2731-I2737 HydrophobicContact CD1-CD1 4.45Å; L2731-I2737 HydrophobicContact CD2-CD1 4.37Å
2732	P	64.6	Low	68.5	Low	44.2 Å²	44.2	65.7 Å²	65.7	29%	0.287	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-66.5	171.2	171.1	29.2	-34.1	0	0	0	111.5	P2534 L2736 I2737	P2534-P2732 HydrophobicContact CG-CG 3.8Å; P2732-L2736 HydrophobicContact CB-CB 4.36Å; P2732-L2736 HydrophobicContact CB-CD1 4.36Å; P2732-I2737 HydrophobicContact CG-CD1 4.46Å; P2732-I2737 HydrophobicContact CG-CG1 4.12Å
2733	L	64.6	Low	66.9	Low	106 Å²	106	67.3 Å²	67.3	56%	0.555	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-52.7	138	179.8	-73.6	139.7	0	0	0	111	A2320 H2735 L2736	A2320-L2733 HydrophobicContact CB-CD2 4.28Å; L2733-H2735 VanDerWaalsContact CB-CE1 3.43Å; L2733-H2735 WeakPolarHBondContact CB-CE1 3.43Å; L2733-H2735 WeakPolarHBondContact CB-ND1 3.32Å; L2733-H2735 PolarHBondContact O-N 3.04Å; L2733-H2735 PolarHBondContact O-ND1 2.88Å; L2733-L2736 HydrophobicContact CB-CD1 4.39Å; L2733-L2736 WeakPolarHBondContact O-CB 3.35Å; L2733-L2736 PolarHBondContact O-N 3.07Å
2734	P	58.5	Low	65.3	Low	108.4 Å²	108.4	72.2 Å²	72.2	70%	0.704	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-23.1	-168.5	-29.9	35.7	0	0	0	116.6	L2736 I2737	P2734-L2736 PolarHBondContact O-N 2.77Å; P2734-I2737 PolarHBondContact O-N 3.36Å
2735	H	66	Low	63.9	Low	147.8 Å²	147.8	71.5 Å²	71.5	68%	0.684	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-15.1	176.5	62	-66.8	0	0	0	114.4	L2733	L2733-H2735 VanDerWaalsContact CB-CE1 3.43Å; L2733-H2735 WeakPolarHBondContact CB-CE1 3.43Å; L2733-H2735 WeakPolarHBondContact CB-ND1 3.32Å; L2733-H2735 PolarHBondContact O-N 3.04Å; L2733-H2735 PolarHBondContact O-ND1 2.88Å
2736	L	65.6	Low	62.5	Low	59.2 Å²	59.2	74.2 Å²	74.2	31%	0.31	41%	0.414	S	S	.	.	S	Bend	trans	-89.8	-9.6	174.1	-80.5	147.5	0	0	0	112.4	P2533 P2534 P2732 L2733 P2734 P2738	P2533-L2736 HydrophobicContact CB-CD2 4.39Å; P2533-L2736 HydrophobicContact CG-CD2 4.18Å; P2534-L2736 WeakPolarHBondContact CD-O 3.35Å; P2732-L2736 HydrophobicContact CB-CB 4.36Å; P2732-L2736 HydrophobicContact CB-CD1 4.36Å; L2733-L2736 HydrophobicContact CB-CD1 4.39Å; L2733-L2736 WeakPolarHBondContact O-CB 3.35Å; L2733-L2736 PolarHBondContact O-N 3.07Å; P2734-L2736 PolarHBondContact O-N 2.77Å; L2736-P2738 WeakPolarHBondContact O-CD 3.21Å
2737	I	71.6	Confident	61.2	Low	30.4 Å²	30.4	74.8 Å²	74.8	16%	0.156	42%	0.417	C	S	.	.	S	Bend	trans	-90.5	117.3	178.5	-55.4	176.5	0	0	0	107.7	L2273 P2534 L2541 L2731 P2732 P2734	L2273-I2737 HydrophobicContact CD2-CG2 4.13Å; P2534-I2737 HydrophobicContact CG-CG1 4.36Å; L2541-I2737 HydrophobicContact CD1-CG2 4.08Å; L2541-I2737 HydrophobicContact CD2-CG2 4.15Å; L2731-I2737 HydrophobicContact CB-CD1 4.22Å; L2731-I2737 HydrophobicContact CD1-CD1 4.45Å; L2731-I2737 HydrophobicContact CD2-CD1 4.37Å; P2732-I2737 HydrophobicContact CG-CD1 4.46Å; P2732-I2737 HydrophobicContact CG-CG1 4.12Å; P2734-I2737 PolarHBondContact O-N 3.36Å
2738	P	69.5	Low	60	Low	48.2 Å²	48.2	76 Å²	76	31%	0.313	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-61.6	146.6	178.1	14.6	-19.7	0	0	0	110.9	P2534 W2536 L2736 L2740	P2534-P2738 WeakPolarHBondContact O-CD 3.3Å; P2534-P2738 VanDerWaalsContact O-CG 3.22Å; P2534-P2738 WeakPolarHBondContact O-CG 3.39Å; W2536-P2738 VanDerWaalsContact CD1-O 3.29Å; W2536-P2738 PolarHBondContact NE1-O 3.14Å; L2736-P2738 WeakPolarHBondContact O-CD 3.21Å; P2738-L2740 PolarHBondContact O-N 2.91Å
2739	P	66.5	Low	59.1	Low	117.2 Å²	117.2	82.8 Å²	82.8	76%	0.761	45%	0.446	S	S	*	.	P	Polyproline II helix	trans	-62.4	137.4	177.6	26.8	-34	0	0	0	110.3	S2741	P2739-S2741 PolarHBondContact O-N 2.98Å; P2739-S2741 VanDerWaalsContact O-N 3.12Å
2740	L	65.9	Low	58.8	Low	37 Å²	37	85.3 Å²	85.3	19%	0.194	45%	0.454	C	S	.	.			trans	-66.3	108.8	175.8	179.8	66.8	0	0	0	109.3	L2273 W2536 P2738 L2742 I2927 R2931 I2934	L2273-L2740 HydrophobicContact CD1-CB 4.17Å; L2273-L2740 HydrophobicContact CD1-CD2 4.12Å; W2536-L2740 HydrophobicContact CD2-CD1 3.69Å; W2536-L2740 HydrophobicContact CE3-CD1 3.68Å; W2536-L2740 HydrophobicContact CG-CD1 4.23Å; W2536-L2740 HydrophobicContact CH2-CD1 4.07Å; W2536-L2740 HydrophobicContact CZ2-CB 4.29Å; W2536-L2740 HydrophobicContact CZ2-CD1 4.06Å; W2536-L2740 HydrophobicContact CZ3-CD1 3.87Å; P2738-L2740 PolarHBondContact O-N 2.91Å; L2740-L2742 PolarHBondContact O-N 3.17Å; L2740-I2927 HydrophobicContact CD1-CG2 4.26Å; L2740-I2927 HydrophobicContact CD2-CG2 4.13Å; L2740-R2931 HydrophobicContact CD1-CG 4.48Å; L2740-R2931 HydrophobicContact CD2-CG 3.87Å; L2740-R2931 HydrophobicContact CG-CG 4.29Å; L2740-I2934 HydrophobicContact CD2-CD1 4.35Å
2741	S	61.6	Low	58.6	Low	34 Å²	34	83.4 Å²	83.4	24%	0.238	45%	0.448	C	S	.	.			trans	-61.2	142.1	175.3	62.3	0	0	0	0	111	P2739 D2743 E2746 V2747 R2931	P2739-S2741 PolarHBondContact O-N 2.98Å; P2739-S2741 VanDerWaalsContact O-N 3.12Å; S2741-D2743 PolarHBondContact O-N 2.86Å; S2741-D2743 PolarHBondContact OG-N 3.17Å; S2741-E2746 VanDerWaalsContact CB-OE2 3.3Å; S2741-E2746 WeakPolarHBondContact CB-OE2 3.19Å; S2741-E2746 PolarHBondContact OG-OE2 2.88Å; S2741-V2747 VanDerWaalsContact OG-CG2 3.22Å; S2741-V2747 WeakPolarHBondContact OG-CG2 3.21Å; S2741-R2931 VanDerWaalsContact O-CZ 3.27Å; S2741-R2931 PolarHBondContact O-NE 3.18Å; S2741-R2931 VanDerWaalsContact O-NE 3.12Å; S2741-R2931 PolarHBondContact O-NH2 3.12Å; S2741-R2931 PolarHBondContact OG-NH2 3.44Å
2742	L	58	Low	58.6	Low	81.6 Å²	81.6	82.4 Å²	82.4	43%	0.427	44%	0.442	S	S	.	.	S	Bend	trans	-92.5	-18.1	-175.3	-93.8	118.9	0	0	0	112.9	L2740 I2934 R2935 M2938	L2740-L2742 PolarHBondContact O-N 3.17Å; L2742-I2934 HydrophobicContact CD1-CB 3.89Å; L2742-I2934 HydrophobicContact CD1-CG2 3.47Å; L2742-I2934 VanDerWaalsContact CD1-CG2 3.47Å; L2742-I2934 HydrophobicContact CD2-CB 4.28Å; L2742-I2934 HydrophobicContact CD2-CG2 3.83Å; L2742-R2935 HydrophobicContact CD1-CG 3.99Å; L2742-R2935 HydrophobicContact CD2-CG 3.88Å; L2742-R2935 HydrophobicContact CG-CG 3.61Å; L2742-R2935 PolarHBondContact O-NE 2.98Å; L2742-R2935 VanDerWaalsContact O-NE 3.13Å; L2742-R2935 PolarHBondContact O-NH2 2.86Å; L2742-M2938 HydrophobicContact CD1-CE 3.54Å; L2742-M2938 VanDerWaalsContact CD1-CE 3.41Å; L2742-M2938 HydrophobicContact CD1-SD 4.3Å; L2742-M2938 HydrophobicContact CD2-CE 3.57Å; L2742-M2938 VanDerWaalsContact CD2-CE 3.49Å; L2742-M2938 HydrophobicContact CG-CE 4.13Å
2743	D	56	Low	58.8	Low	84.6 Å²	84.6	80.7 Å²	80.7	45%	0.452	43%	0.432	S	S	.	.			trans	-86.9	126.5	175.3	-145.9	-33.8	0	0	0	110	S2741 T2745 E2746	S2741-D2743 PolarHBondContact O-N 2.86Å; S2741-D2743 PolarHBondContact OG-N 3.17Å; D2743-T2745 VanDerWaalsContact C-N 3.31Å; D2743-T2745 PolarHBondContact O-N 3.17Å; D2743-T2745 WeakPolarHBondContact OD1-CA 3.41Å; D2743-T2745 VanDerWaalsContact OD1-CB 3.3Å; D2743-T2745 WeakPolarHBondContact OD1-CB 3.29Å; D2743-T2745 WeakPolarHBondContact OD1-CG2 3.38Å; D2743-T2745 PolarHBondContact OD1-N 3.11Å; D2743-T2745 PolarHBondContact OD1-OG1 2.94Å; D2743-T2745 WeakPolarHBondContact OD2-CB 3.38Å; D2743-T2745 PolarHBondContact OD2-OG1 3.13Å; D2743-E2746 HydrophobicContact CB-CB 4.4Å; D2743-E2746 HydrophobicContact CB-CG 4.29Å; D2743-E2746 PolarHBondContact O-N 2.9Å
2744	E	52.4	Low	59.4	Low	118 Å²	118	76.1 Å²	76.1	55%	0.551	41%	0.409	S	S	*	.	H	α-helix	trans	-72.9	-19.1	178.9	-73	166.6	-160.3	0	0	111.9	V2748 R2935	E2744-V2748 WeakPolarHBondContact O-CB 3.32Å; E2744-V2748 WeakPolarHBondContact O-CG2 3.4Å; E2744-V2748 PolarHBondContact O-N 3.19Å; E2744-R2935 IonicContact OE1-CZ 2.82Å; E2744-R2935 IonicContact OE1-NH1 3.4Å; E2744-R2935 PolarHBondContact OE1-NH1 3.08Å; E2744-R2935 IonicContact OE1-NH2 3.35Å; E2744-R2935 PolarHBondContact OE1-NH2 3.05Å
2745	T	49.8	Very low	60.7	Low	79 Å²	79	72.5 Å²	72.5	49%	0.485	38%	0.384	S	S	.	.	H	α-helix	trans	-81.1	-24.9	-177.2	51.6	0	0	0	0	114.1	D2743 V2748 R2749	D2743-T2745 VanDerWaalsContact C-N 3.31Å; D2743-T2745 PolarHBondContact O-N 3.17Å; D2743-T2745 WeakPolarHBondContact OD1-CA 3.41Å; D2743-T2745 VanDerWaalsContact OD1-CB 3.3Å; D2743-T2745 WeakPolarHBondContact OD1-CB 3.29Å; D2743-T2745 WeakPolarHBondContact OD1-CG2 3.38Å; D2743-T2745 PolarHBondContact OD1-N 3.11Å; D2743-T2745 PolarHBondContact OD1-OG1 2.94Å; D2743-T2745 WeakPolarHBondContact OD2-CB 3.38Å; D2743-T2745 PolarHBondContact OD2-OG1 3.13Å; T2745-V2748 CarbonylContact O-C 3.56Å; T2745-V2748 PolarHBondContact O-N 2.76Å; T2745-R2749 VanDerWaalsContact O-CB 3.3Å; T2745-R2749 WeakPolarHBondContact O-CB 3.21Å; T2745-R2749 WeakPolarHBondContact O-CD 3.2Å; T2745-R2749 VanDerWaalsContact O-CG 3.26Å; T2745-R2749 WeakPolarHBondContact O-CG 3.34Å; T2745-R2749 PolarHBondContact O-N 3.16Å; T2745-R2749 VanDerWaalsContact O-N 3.08Å; T2745-R2749 PolarHBondContact O-NE 2.93Å
2746	E	45	Very low	61.8	Low	116.6 Å²	116.6	65.5 Å²	65.5	55%	0.545	35%	0.352	S	S	.	.	H	α-helix	trans	-76.4	-45	176.6	-84.1	-176.4	159.2	0	0	111.6	S2741 D2743 V2748 R2749 N2750	S2741-E2746 VanDerWaalsContact CB-OE2 3.3Å; S2741-E2746 WeakPolarHBondContact CB-OE2 3.19Å; S2741-E2746 PolarHBondContact OG-OE2 2.88Å; D2743-E2746 HydrophobicContact CB-CB 4.4Å; D2743-E2746 HydrophobicContact CB-CG 4.29Å; D2743-E2746 PolarHBondContact O-N 2.9Å; E2746-V2748 VanDerWaalsContact C-N 3.27Å; E2746-V2748 PolarHBondContact O-N 3.1Å; E2746-V2748 VanDerWaalsContact O-N 3.1Å; E2746-R2749 PolarHBondContact O-N 3.01Å; E2746-N2750 PolarHBondContact O-N 2.82Å; E2746-N2750 VanDerWaalsContact O-N 3.16Å
2747	V	47.1	Very low	63	Low	17.8 Å²	17.8	64.7 Å²	64.7	11%	0.108	35%	0.349	C	S	.	.	H	α-helix	trans	-62.6	-26.8	-177.4	-178.1	0	0	0	0	112.7	W2536 D2538 S2741 R2749 R2931	W2536-V2747 HydrophobicContact CB-CG1 4.04Å; W2536-V2747 HydrophobicContact CB-CG2 4.36Å; D2538-V2747 VanDerWaalsContact N-CG1 3.32Å; D2538-V2747 PolarHBondContact N-O 2.86Å; S2741-V2747 VanDerWaalsContact OG-CG2 3.22Å; S2741-V2747 WeakPolarHBondContact OG-CG2 3.21Å; V2747-R2749 VanDerWaalsContact C-N 3.3Å; V2747-R2749 PolarHBondContact O-N 2.84Å; V2747-R2931 VanDerWaalsContact CG1-NH2 3.34Å
2748	V	43.8	Very low	63.9	Low	87.2 Å²	87.2	63.3 Å²	63.3	53%	0.528	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-9.6	-180	177.5	0	0	0	0	112.6	E2744 T2745 E2746	E2744-V2748 WeakPolarHBondContact O-CB 3.32Å; E2744-V2748 WeakPolarHBondContact O-CG2 3.4Å; E2744-V2748 PolarHBondContact O-N 3.19Å; T2745-V2748 CarbonylContact O-C 3.56Å; T2745-V2748 PolarHBondContact O-N 2.76Å; E2746-V2748 VanDerWaalsContact C-N 3.27Å; E2746-V2748 PolarHBondContact O-N 3.1Å; E2746-V2748 VanDerWaalsContact O-N 3.1Å
2749	R	45.1	Very low	65	Low	190.4 Å²	190.4	64.1 Å²	64.1	72%	0.718	34%	0.343	S	S	*	.	H	α-helix	trans	-98.5	-15.5	-175.8	-74.3	-178	-177.2	-143.1	0.7	115.3	T2745 E2746 V2747 P2751	T2745-R2749 VanDerWaalsContact O-CB 3.3Å; T2745-R2749 WeakPolarHBondContact O-CB 3.21Å; T2745-R2749 WeakPolarHBondContact O-CD 3.2Å; T2745-R2749 VanDerWaalsContact O-CG 3.26Å; T2745-R2749 WeakPolarHBondContact O-CG 3.34Å; T2745-R2749 PolarHBondContact O-N 3.16Å; T2745-R2749 VanDerWaalsContact O-N 3.08Å; T2745-R2749 PolarHBondContact O-NE 2.93Å; E2746-R2749 PolarHBondContact O-N 3.01Å; V2747-R2749 VanDerWaalsContact C-N 3.3Å; V2747-R2749 PolarHBondContact O-N 2.84Å; R2749-P2751 VanDerWaalsContact O-CD 3.29Å; R2749-P2751 WeakPolarHBondContact O-CD 3.37Å
2750	N	53	Low	66.2	Low	98.4 Å²	98.4	58.9 Å²	58.9	53%	0.526	31%	0.309	S	S	.	.			trans	-72.5	123	178.7	-75.6	1.1	0	0	0	110.3	W2536 E2746 E2752	W2536-N2750 PolarHBondContact O-ND2 3.21Å; E2746-N2750 PolarHBondContact O-N 2.82Å; E2746-N2750 VanDerWaalsContact O-N 3.16Å; N2750-E2752 HydrophobicContact CB-CB 4.46Å; N2750-E2752 PolarHBondContact O-N 3.05Å; N2750-E2752 VanDerWaalsContact O-N 3.11Å
2751	P	58.9	Low	67.4	Low	80.4 Å²	80.4	58.1 Å²	58.1	52%	0.522	30%	0.304	S	S	.	.			trans	-78.6	5	177.4	34.6	-37	0	0	0	113.2	Q2483 R2749 R3064	Q2483-P2751 PolarHBondContact NE2-O 3.07Å; R2749-P2751 VanDerWaalsContact O-CD 3.29Å; R2749-P2751 WeakPolarHBondContact O-CD 3.37Å; P2751-R3064 PolarHBondContact O-NH2 3.39Å
2752	E	66.8	Low	68.6	Low	44.2 Å²	44.2	59.3 Å²	59.3	21%	0.207	31%	0.306	C	S	.	.			trans	-81.6	163.4	175.6	-131.9	-171.2	174.2	0	0	111.6	I2487 I2535 K2537 K2544 Y2723 N2750 A2754	I2487-E2752 HydrophobicContact CD1-CB 4.41Å; I2487-E2752 HydrophobicContact CD1-CG 4.27Å; I2487-E2752 HydrophobicContact CG1-CG 4.29Å; I2487-E2752 HydrophobicContact CG2-CG 4.13Å; I2535-E2752 HydrophobicContact CD1-CB 3.75Å; I2535-E2752 HydrophobicContact CD1-CG 4.04Å; K2537-E2752 WeakPolarHBondContact CD-O 3.4Å; K2537-E2752 PolarHBondContact NZ-O 2.96Å; K2537-E2752 VanDerWaalsContact NZ-O 3.16Å; K2544-E2752 WeakPolarHBondContact CE-OE1 3.31Å; K2544-E2752 WeakPolarHBondContact CE-OE2 3.42Å; K2544-E2752 IonicContact NZ-OE1 3.36Å; K2544-E2752 PolarHBondContact NZ-OE1 3Å; K2544-E2752 IonicContact NZ-OE2 3.65Å; K2544-E2752 PolarHBondContact NZ-OE2 2.84Å; Y2723-E2752 HydrophobicContact CE1-CG 4.45Å; Y2723-E2752 VanDerWaalsContact OH-CG 3.27Å; Y2723-E2752 WeakPolarHBondContact OH-CG 3.46Å; Y2723-E2752 PolarHBondContact OH-OE1 3.15Å; Y2723-E2752 PolarHBondContact OH-OE2 2.81Å; N2750-E2752 HydrophobicContact CB-CB 4.46Å; N2750-E2752 PolarHBondContact O-N 3.05Å; N2750-E2752 VanDerWaalsContact O-N 3.11Å; E2752-A2754 VanDerWaalsContact C-N 3.34Å
2753	G	68.3	Low	70.1	Confident	9 Å²	9	58.8 Å²	58.8	9%	0.093	31%	0.306	C	S	.	.	S	Bend	trans	85	16.7	-179.1	0	0	0	0	0	114.7	K2537 Y2723	K2537-G2753 VanDerWaalsContact CD-O 3.26Å; K2537-G2753 WeakPolarHBondContact CD-O 3.28Å; K2537-G2753 VanDerWaalsContact CE-O 3.31Å; K2537-G2753 WeakPolarHBondContact CE-O 3.48Å; K2537-G2753 VanDerWaalsContact NZ-C 3.28Å; K2537-G2753 PolarHBondContact NZ-O 2.99Å; Y2723-G2753 VanDerWaalsContact CE2-CA 3.48Å; Y2723-G2753 VanDerWaalsContact CE2-N 3.33Å; Y2723-G2753 VanDerWaalsContact CZ-CA 3.43Å; Y2723-G2753 VanDerWaalsContact CZ-N 3.28Å; Y2723-G2753 PolarHBondContact OH-N 3.1Å
2754	A	78.5	Confident	71.7	Confident	8.4 Å²	8.4	56.1 Å²	56.1	7%	0.069	29%	0.292	C	S	.	.	S	Bend	trans	-107.5	132.1	164.8	0	0	0	0	0	109	Y2723 E2752 T2756 I3061 V3062	Y2723-A2754 WeakPolarHBondContact CE2-O 3.34Å; E2752-A2754 VanDerWaalsContact C-N 3.34Å; A2754-T2756 PolarHBondContact O-N 3.07Å; A2754-T2756 VanDerWaalsContact O-N 3.12Å; A2754-T2756 PolarHBondContact O-OG1 2.97Å; A2754-I3061 HydrophobicContact CB-CB 4.43Å; A2754-I3061 HydrophobicContact CB-CG2 4.01Å; A2754-I3061 VanDerWaalsContact CB-O 3.31Å; A2754-I3061 WeakPolarHBondContact CB-O 3.24Å; A2754-V3062 WeakPolarHBondContact CA-O 3.31Å
2755	D	85.6	Confident	73.5	Confident	32.8 Å²	32.8	53.8 Å²	53.8	18%	0.175	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	116.4	177.4	-94.7	26.9	0	0	0	109.3	Y2720 I2721 H2722 Y2723 V3062 R3063 R3064	Y2720-D2755 HydrophobicContact CE2-CB 4.35Å; Y2720-D2755 PolarHBondContact OH-OD2 3.02Å; I2721-D2755 CarbonylContact O-C 3.38Å; I2721-D2755 WeakPolarHBondContact O-CA 3.38Å; H2722-D2755 VanDerWaalsContact CA-OD1 3.31Å; H2722-D2755 WeakPolarHBondContact CA-OD1 3.42Å; H2722-D2755 IonicContact CE1-OD1 3.02Å; H2722-D2755 IonicContact CE1-OD2 3.23Å; H2722-D2755 PolarHBondContact CE1-OD2 3.1Å; H2722-D2755 IonicContact CG-OD1 3.35Å; H2722-D2755 IonicContact CG-OD2 3.31Å; H2722-D2755 VanDerWaalsContact ND1-CG 3.32Å; H2722-D2755 IonicContact ND1-OD1 3.1Å; H2722-D2755 PolarHBondContact ND1-OD1 2.9Å; H2722-D2755 IonicContact ND1-OD2 3.33Å; H2722-D2755 PolarHBondContact ND1-OD2 2.89Å; Y2723-D2755 PolarHBondContact N-OD1 3.07Å; Y2723-D2755 VanDerWaalsContact N-OD1 3.1Å; D2755-V3062 PolarHBondContact N-O 3.2Å; D2755-R3063 HydrophobicContact CB-CG 4.42Å; D2755-R3063 CarbonylContact O-C 3.5Å; D2755-R3063 VanDerWaalsContact O-CA 3.25Å; D2755-R3063 WeakPolarHBondContact O-CA 3.29Å; D2755-R3063 WeakPolarHBondContact O-CG 3.37Å; D2755-R3063 IonicContact OD2-NH1 3.12Å; D2755-R3064 PolarHBondContact O-N 3.12Å
2756	T	88.5	Confident	75.6	Confident	1.4 Å²	1.4	51.8 Å²	51.8	1%	0.009	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	125.4	-170.2	-46.2	0	0	0	0	110	Y2720 I2721 A2754 R3064	Y2720-T2756 CarbonylContact C-O 3.56Å; Y2720-T2756 WeakPolarHBondContact CA-O 3.37Å; Y2720-T2756 WeakPolarHBondContact CD2-O 3.43Å; I2721-T2756 PolarHBondContact N-O 3.12Å; I2721-T2756 PolarHBondContact O-N 2.93Å; A2754-T2756 PolarHBondContact O-N 3.07Å; A2754-T2756 VanDerWaalsContact O-N 3.12Å; A2754-T2756 PolarHBondContact O-OG1 2.97Å; T2756-R3064 WeakPolarHBondContact CA-O 3.37Å; T2756-R3064 HydrophobicContact CG2-CB 4.09Å; T2756-R3064 HydrophobicContact CG2-CG 4.22Å; T2756-R3064 PolarHBondContact OG1-NH1 3.02Å
2757	V	90.4	Very high	77.7	Confident	42 Å²	42	46.8 Å²	46.8	26%	0.255	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	133.8	168.1	102.8	0	0	0	0	109	F2719 Y2720 L2759 R3064 S3065 E3066	F2719-V2757 CarbonylContact O-C 3.52Å; F2719-V2757 WeakPolarHBondContact O-CA 3.4Å; Y2720-V2757 HydrophobicContact CD2-CB 4.04Å; Y2720-V2757 HydrophobicContact CD2-CG2 3.84Å; Y2720-V2757 HydrophobicContact CE2-CG2 4.15Å; Y2720-V2757 HydrophobicContact CG-CG2 4.25Å; V2757-L2759 HydrophobicContact CG1-CD2 4.39Å; V2757-L2759 HydrophobicContact CG1-CG 4.24Å; V2757-L2759 HydrophobicContact CG2-CD1 3.94Å; V2757-R3064 PolarHBondContact N-O 3.04Å; V2757-R3064 VanDerWaalsContact N-O 3.11Å; V2757-S3065 WeakPolarHBondContact CG1-OG 3.41Å; V2757-S3065 CarbonylContact O-C 3.54Å; V2757-S3065 VanDerWaalsContact O-CA 3.3Å; V2757-S3065 WeakPolarHBondContact O-CA 3.36Å; V2757-E3066 PolarHBondContact O-N 3.02Å
2758	T	91.8	Very high	79.9	Confident	1.2 Å²	1.2	46.7 Å²	46.7	1%	0.007	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	126.3	177.2	-53.9	0	0	0	0	108.7	L2482 G2484 V2718 F2719 E3066	L2482-T2758 HydrophobicContact CB-CG2 4.19Å; L2482-T2758 HydrophobicContact CD1-CG2 4.03Å; L2482-T2758 HydrophobicContact CD2-CG2 4.28Å; L2482-T2758 HydrophobicContact CG-CG2 4.31Å; G2484-T2758 WeakPolarHBondContact CA-OG1 3.46Å; V2718-T2758 WeakPolarHBondContact CA-O 3.39Å; F2719-T2758 HydrophobicContact CD2-CG2 4.45Å; F2719-T2758 PolarHBondContact N-O 3.06Å; F2719-T2758 PolarHBondContact O-N 3.07Å; T2758-E3066 WeakPolarHBondContact CA-O 3.27Å; T2758-E3066 HydrophobicContact CG2-CB 3.93Å; T2758-E3066 WeakPolarHBondContact CG2-OE2 3.18Å; T2758-E3066 PolarHBondContact OG1-OE2 3.08Å
2759	L	91.8	Very high	82.1	Confident	65.2 Å²	65.2	43.1 Å²	43.1	34%	0.341	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	123.6	173.1	-139.5	85.2	0	0	0	108.7	C2716 E2717 V2718 V2757 E3066 V3067 C3068	C2716-L2759 VanDerWaalsContact SG-CD1 3.5Å; C2716-L2759 WeakPolarHBondContact SG-CD1 3.4Å; E2717-L2759 WeakPolarHBondContact O-CA 3.29Å; V2718-L2759 HydrophobicContact CB-CD2 4.23Å; V2718-L2759 HydrophobicContact CG1-CD2 3.91Å; V2718-L2759 HydrophobicContact CG2-CD1 3.89Å; V2718-L2759 HydrophobicContact CG2-CD2 3.74Å; V2718-L2759 HydrophobicContact CG2-CG 4.38Å; V2757-L2759 HydrophobicContact CG1-CD2 4.39Å; V2757-L2759 HydrophobicContact CG1-CG 4.24Å; V2757-L2759 HydrophobicContact CG2-CD1 3.94Å; L2759-E3066 PolarHBondContact N-O 2.86Å; L2759-V3067 HydrophobicContact CB-CG2 4.39Å; L2759-V3067 HydrophobicContact CD2-CG1 4.32Å; L2759-V3067 CarbonylContact O-C 3.58Å; L2759-V3067 WeakPolarHBondContact O-CA 3.43Å; L2759-C3068 PolarHBondContact O-N 3.24Å
2760	L	92	Very high	84.1	Confident	7.2 Å²	7.2	35.6 Å²	35.6	4%	0.038	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	130	-179.1	174.6	61.6	0	0	0	110.5	V2479 L2482 C2716 E2717 C3068 E3070	V2479-L2760 HydrophobicContact CG1-CD2 4.4Å; V2479-L2760 HydrophobicContact CG2-CD1 4.25Å; V2479-L2760 HydrophobicContact CG2-CD2 4.31Å; L2482-L2760 HydrophobicContact CD1-CB 4.45Å; L2482-L2760 HydrophobicContact CD1-CD1 4.26Å; L2482-L2760 HydrophobicContact CD1-CD2 4.28Å; C2716-L2760 CarbonylContact C-O 3.51Å; C2716-L2760 VanDerWaalsContact CA-O 3.3Å; C2716-L2760 WeakPolarHBondContact CA-O 3.42Å; E2717-L2760 HydrophobicContact CB-CB 4.35Å; E2717-L2760 PolarHBondContact N-O 2.96Å; E2717-L2760 PolarHBondContact O-N 3.34Å; L2760-C3068 HydrophobicContact CD1-CB 3.9Å; L2760-E3070 HydrophobicContact CD1-CG 4.35Å
2761	H	90.7	Very high	85.6	Confident	20.2 Å²	20.2	33.4 Å²	33.4	9%	0.094	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	121.2	165.9	-64.6	-82.2	0	0	0	109.6	M2554 Y2556 S2715 C2716 L2764 C3068 F3069 E3070	M2554-H2761 WeakPolarHBondContact CE-CE1 3.43Å; Y2556-H2761 PolarHBondContact OH-CE1 2.84Å; Y2556-H2761 PolarHBondContact OH-NE2 3.1Å; Y2556-H2761 VanDerWaalsContact OH-NE2 3.16Å; S2715-H2761 PolarHBondContact O-ND1 2.88Å; S2715-H2761 VanDerWaalsContact O-ND1 3.09Å; C2716-H2761 VanDerWaalsContact CB-CE1 3.46Å; C2716-H2761 WeakPolarHBondContact CB-CE1 3.41Å; C2716-H2761 WeakPolarHBondContact CB-ND1 3.34Å; C2716-H2761 WeakPolarHBondContact CB-NE2 3.37Å; C2716-H2761 PolarHBondContact SG-CE1 3.01Å; C2716-H2761 VanDerWaalsContact SG-CE1 3.55Å; C2716-H2761 PolarHBondContact SG-NE2 3.27Å; H2761-L2764 HydrophobicContact CB-CD1 3.95Å; H2761-L2764 HydrophobicContact CB-CD2 3.97Å; H2761-L2764 HydrophobicContact CB-CG 3.78Å; H2761-C3068 PolarHBondContact N-O 3.29Å; H2761-F3069 HydrophobicContact CB-CB 4.21Å; H2761-F3069 HydrophobicContact CB-CD1 4.2Å; H2761-F3069 AromaticContact CD2-CD1 3.97Å; H2761-F3069 AromaticContact CD2-CE1 3.84Å; H2761-F3069 WeakPolarHBondContact O-CA 3.43Å; H2761-F3069 WeakPolarHBondContact O-CB 3.49Å; H2761-E3070 PolarHBondContact O-N 3.21Å; H2761-E3070 VanDerWaalsContact O-N 3.15Å
2762	H	87.3	Confident	87.1	Confident	60.6 Å²	60.6	29.6 Å²	29.6	28%	0.281	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	-49.7	177.7	-60.6	102.2	0	0	0	111.6	S2715 E2717 E3070 H3071	S2715-H2762 PolarHBondContact OG-ND1 2.95Å; S2715-H2762 VanDerWaalsContact OG-ND1 3.14Å; E2717-H2762 IonicContact OE1-CE1 3.28Å; E2717-H2762 IonicContact OE2-CE1 3.82Å; H2762-E3070 WeakPolarHBondContact CA-OE2 3.43Å; H2762-E3070 WeakPolarHBondContact CB-OE2 3.39Å; H2762-E3070 IonicContact CD2-OE2 3.48Å; H2762-E3070 PolarHBondContact CD2-OE2 3.25Å; H2762-E3070 VanDerWaalsContact CD2-OE2 3.27Å; H2762-E3070 IonicContact CG-OE2 2.95Å; H2762-E3070 WeakPolarHBondContact O-CB 3.32Å; H2762-E3070 PolarHBondContact O-N 3.13Å; H2762-H3071 PolarHBondContact O-N 2.91Å; H2762-H3071 VanDerWaalsContact O-N 3.09Å
2763	T	88.7	Confident	88.2	Confident	70.4 Å²	70.4	31.2 Å²	31.2	43%	0.432	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	132.7	179.5	-48.6	0	0	0	0	111.6	C2714 H3071	C2714-T2763 VanDerWaalsContact CB-O 3.31Å; C2714-T2763 WeakPolarHBondContact CB-O 3.32Å; T2763-H3071 CarbonylContact C-O 3.55Å; T2763-H3071 WeakPolarHBondContact CA-O 3.34Å
2764	L	90.4	Very high	89	Confident	28.4 Å²	28.4	33.7 Å²	33.7	15%	0.149	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	119.2	175.6	-69.4	173.5	0	0	0	110.7	I2711 C2714 H2761 V2766 F3069 H3071 A3072 R3073	I2711-L2764 HydrophobicContact CG2-CD2 4.1Å; C2714-L2764 HydrophobicContact CB-CD2 4.26Å; H2761-L2764 HydrophobicContact CB-CD1 3.95Å; H2761-L2764 HydrophobicContact CB-CD2 3.97Å; H2761-L2764 HydrophobicContact CB-CG 3.78Å; L2764-V2766 HydrophobicContact CB-CG2 4.18Å; L2764-F3069 HydrophobicContact CD1-CB 4.21Å; L2764-F3069 HydrophobicContact CD1-CD1 4.05Å; L2764-F3069 HydrophobicContact CD1-CE1 3.83Å; L2764-F3069 HydrophobicContact CD1-CG 4.24Å; L2764-H3071 PolarHBondContact N-O 3.38Å; L2764-A3072 HydrophobicContact CB-CB 3.99Å; L2764-A3072 HydrophobicContact CD1-CB 4.44Å; L2764-A3072 CarbonylContact O-C 3.53Å; L2764-A3072 VanDerWaalsContact O-CA 3.3Å; L2764-A3072 WeakPolarHBondContact O-CA 3.19Å; L2764-R3073 PolarHBondContact O-N 3.27Å
2765	N	90.5	Very high	89.4	Confident	69.4 Å²	69.4	33.5 Å²	33.5	37%	0.371	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	116.3	165.4	-67.3	-53.9	0	0	0	108.5	V2624 I2711 S2712 R3073	V2624-N2765 WeakPolarHBondContact CG1-O 3.41Å; V2624-N2765 HydrophobicContact CG2-CB 4.24Å; I2711-N2765 CarbonylContact C-O 3.57Å; I2711-N2765 VanDerWaalsContact CA-O 3.29Å; I2711-N2765 WeakPolarHBondContact CA-O 3.45Å; S2712-N2765 PolarHBondContact N-O 3.06Å; S2712-N2765 PolarHBondContact OG-N 3.44Å; N2765-R3073 CarbonylContact C-O 3.48Å; N2765-R3073 WeakPolarHBondContact CA-O 3.29Å
2766	V	92.3	Very high	89.6	Confident	36.4 Å²	36.4	34.5 Å²	34.5	22%	0.221	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	140.1	-169.1	-173.4	0	0	0	0	110	M2710 I2711 L2764 T2768 R3073 W3074 R3075	M2710-V2766 CarbonylContact O-C 3.56Å; M2710-V2766 VanDerWaalsContact O-CA 3.28Å; M2710-V2766 WeakPolarHBondContact O-CA 3.33Å; I2711-V2766 HydrophobicContact CD1-CG1 4.35Å; I2711-V2766 HydrophobicContact CD1-CG2 4.04Å; I2711-V2766 HydrophobicContact CG1-CB 4.37Å; I2711-V2766 HydrophobicContact CG1-CG1 4.08Å; I2711-V2766 HydrophobicContact CG1-CG2 4.02Å; I2711-V2766 HydrophobicContact CG2-CG2 4.47Å; L2764-V2766 HydrophobicContact CB-CG2 4.18Å; V2766-T2768 HydrophobicContact CG1-CG2 3.81Å; V2766-R3073 PolarHBondContact N-O 3.13Å; V2766-W3074 HydrophobicContact CB-CB 4.24Å; V2766-W3074 HydrophobicContact CB-CG 4.39Å; V2766-W3074 HydrophobicContact CG1-CG 4.39Å; V2766-W3074 CarbonylContact O-C 3.5Å; V2766-W3074 WeakPolarHBondContact O-CA 3.31Å; V2766-R3075 PolarHBondContact O-N 3.27Å
2767	S	90.9	Very high	89.4	Confident	11 Å²	11	36.4 Å²	36.4	8%	0.077	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	127	167.6	177.2	0	0	0	0	109.6	V2624 G2625 M2710 R3075 T3077	V2624-S2767 WeakPolarHBondContact CG1-OG 3.39Å; G2625-S2767 VanDerWaalsContact CA-OG 3.32Å; G2625-S2767 WeakPolarHBondContact CA-OG 3.5Å; G2625-S2767 PolarHBondContact N-OG 3.09Å; G2625-S2767 VanDerWaalsContact N-OG 3.16Å; M2710-S2767 VanDerWaalsContact CA-O 3.3Å; M2710-S2767 WeakPolarHBondContact CA-O 3.35Å; M2710-S2767 WeakPolarHBondContact CG-O 3.37Å; M2710-S2767 PolarHBondContact O-N 3.13Å; S2767-R3075 CarbonylContact C-O 3.57Å; S2767-R3075 VanDerWaalsContact CA-O 3.25Å; S2767-R3075 WeakPolarHBondContact CA-O 3.44Å; S2767-T3077 WeakPolarHBondContact OG-CG2 3.34Å
2768	T	92.1	Very high	89.1	Confident	15.6 Å²	15.6	35.9 Å²	35.9	10%	0.096	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	139.9	-178.9	70	0	0	0	0	112.2	M2710 V2766 Q2772 I2776 W3074 R3075 T3077 F3185	M2710-T2768 HydrophobicContact CB-CG2 4.23Å; M2710-T2768 HydrophobicContact CE-CG2 3.41Å; M2710-T2768 HydrophobicContact CG-CG2 4.36Å; M2710-T2768 HydrophobicContact SD-CG2 4.04Å; V2766-T2768 HydrophobicContact CG1-CG2 3.81Å; T2768-Q2772 VanDerWaalsContact CA-OE1 3.3Å; T2768-Q2772 HydrophobicContact CG2-CB 4.32Å; T2768-I2776 HydrophobicContact CG2-CD1 4.07Å; T2768-W3074 PolarHBondContact OG1-NE1 3.02Å; T2768-R3075 PolarHBondContact N-O 2.91Å; T2768-T3077 VanDerWaalsContact C-OG1 3.23Å; T2768-T3077 PolarHBondContact O-N 3.17Å; T2768-T3077 PolarHBondContact O-OG1 3.26Å; T2768-F3185 WeakPolarHBondContact O-CE2 3.48Å; T2768-F3185 WeakPolarHBondContact O-CZ 3.17Å
2769	N	89.6	Confident	88.8	Confident	13.2 Å²	13.2	36.4 Å²	36.4	7%	0.071	19%	0.191	C	C	.	.			trans	-81.3	173.1	159.7	76.4	17.1	0	0	0	111.4	L2771 Q2772 Y2773 T3077 E3078 N3079	N2769-L2771 PolarHBondContact O-N 3.05Å; N2769-L2771 PolarHBondContact OD1-N 3.1Å; N2769-L2771 VanDerWaalsContact OD1-N 3.13Å; N2769-Q2772 PolarHBondContact O-N 3.11Å; N2769-Q2772 VanDerWaalsContact OD1-CB 3.31Å; N2769-Q2772 WeakPolarHBondContact OD1-CB 3.4Å; N2769-Q2772 VanDerWaalsContact OD1-CG 3.24Å; N2769-Q2772 WeakPolarHBondContact OD1-CG 3.35Å; N2769-Q2772 PolarHBondContact OD1-N 3.19Å; N2769-Q2772 PolarHBondContact OD1-OE1 3.24Å; N2769-Y2773 WeakPolarHBondContact O-CB 3.41Å; N2769-Y2773 PolarHBondContact O-N 3.31Å; N2769-T3077 WeakPolarHBondContact CA-OG1 3.33Å; N2769-T3077 PolarHBondContact N-OG1 3.11Å; N2769-E3078 WeakPolarHBondContact CB-O 3.34Å; N2769-N3079 PolarHBondContact ND2-O 2.93Å
2770	S	87.8	Confident	88.3	Confident	33 Å²	33	35.8 Å²	35.8	23%	0.231	19%	0.19	C	C	.	.	H	α-helix	trans	-60	-43	-179	93.6	0	0	0	0	113.2	Q2772 Y2773 H2774 N3079 F3185	S2770-Q2772 VanDerWaalsContact C-N 3.32Å; S2770-Q2772 PolarHBondContact O-N 2.92Å; S2770-Y2773 WeakPolarHBondContact O-CB 3.3Å; S2770-Y2773 PolarHBondContact O-N 3.15Å; S2770-H2774 PolarHBondContact O-CD2 3.11Å; S2770-H2774 VanDerWaalsContact O-CD2 3.32Å; S2770-H2774 PolarHBondContact O-N 3.12Å; S2770-N3079 PolarHBondContact OG-OD1 3.14Å; S2770-N3079 VanDerWaalsContact OG-OD1 3.07Å; S2770-F3185 WeakPolarHBondContact CB-O 3.35Å; S2770-F3185 PolarHBondContact OG-O 2.94Å
2771	L	85.5	Confident	87.7	Confident	52.4 Å²	52.4	38.8 Å²	38.8	27%	0.274	21%	0.206	S	C	.	.	H	α-helix	trans	-62.6	-44	178.6	-179.3	67.5	0	0	0	111.7	L2514 G2561 Q2562 N2769 H2774 M2775	L2514-L2771 HydrophobicContact CD2-CD1 3.76Å; G2561-L2771 WeakPolarHBondContact O-CD2 3.47Å; Q2562-L2771 HydrophobicContact CG-CD1 4.14Å; Q2562-L2771 HydrophobicContact CG-CD2 4.06Å; N2769-L2771 PolarHBondContact O-N 3.05Å; N2769-L2771 PolarHBondContact OD1-N 3.1Å; N2769-L2771 VanDerWaalsContact OD1-N 3.13Å; L2771-H2774 PolarHBondContact O-N 3.3Å; L2771-M2775 HydrophobicContact CG-CE 4.41Å; L2771-M2775 VanDerWaalsContact O-CB 3.3Å; L2771-M2775 WeakPolarHBondContact O-CB 3.33Å; L2771-M2775 WeakPolarHBondContact O-CG 3.37Å; L2771-M2775 PolarHBondContact O-N 3.18Å
2772	Q	89.3	Confident	87.1	Confident	0.2 Å²	0.2	40.1 Å²	40.1	0%	0.001	21%	0.214	C	C	.	.	H	α-helix	trans	-66.4	-39	176.8	-71.4	164.7	-11.1	0	0	112.2	A2558 M2710 T2768 N2769 S2770 H2774 M2775 I2776	A2558-Q2772 HydrophobicContact CB-CG 4.16Å; M2710-Q2772 HydrophobicContact CE-CB 3.67Å; M2710-Q2772 HydrophobicContact CE-CG 4.37Å; M2710-Q2772 HydrophobicContact CG-CG 4.48Å; M2710-Q2772 HydrophobicContact SD-CB 3.99Å; M2710-Q2772 HydrophobicContact SD-CG 4.12Å; T2768-Q2772 VanDerWaalsContact CA-OE1 3.3Å; T2768-Q2772 HydrophobicContact CG2-CB 4.32Å; N2769-Q2772 PolarHBondContact O-N 3.11Å; N2769-Q2772 VanDerWaalsContact OD1-CB 3.31Å; N2769-Q2772 WeakPolarHBondContact OD1-CB 3.4Å; N2769-Q2772 VanDerWaalsContact OD1-CG 3.24Å; N2769-Q2772 WeakPolarHBondContact OD1-CG 3.35Å; N2769-Q2772 PolarHBondContact OD1-N 3.19Å; N2769-Q2772 PolarHBondContact OD1-OE1 3.24Å; S2770-Q2772 VanDerWaalsContact C-N 3.32Å; S2770-Q2772 PolarHBondContact O-N 2.92Å; Q2772-H2774 VanDerWaalsContact C-N 3.33Å; Q2772-H2774 PolarHBondContact O-N 2.93Å; Q2772-M2775 HydrophobicContact CB-CE 4.36Å; Q2772-M2775 HydrophobicContact CG-CE 4.11Å; Q2772-M2775 WeakPolarHBondContact O-CB 3.29Å; Q2772-M2775 PolarHBondContact O-N 3.07Å; Q2772-I2776 WeakPolarHBondContact O-CG1 3.31Å; Q2772-I2776 PolarHBondContact O-N 3.13Å
2773	Y	90.1	Very high	86.5	Confident	78.2 Å²	78.2	39.1 Å²	39.1	31%	0.307	21%	0.21	S	C	.	.	H	α-helix	trans	-59.4	-47.5	172	171.4	-101.2	0	0	0	111.1	N2769 S2770 M2775 I2776 V2777 W3074 F3185 F3186	N2769-Y2773 WeakPolarHBondContact O-CB 3.41Å; N2769-Y2773 PolarHBondContact O-N 3.31Å; S2770-Y2773 WeakPolarHBondContact O-CB 3.3Å; S2770-Y2773 PolarHBondContact O-N 3.15Å; Y2773-M2775 VanDerWaalsContact C-N 3.34Å; Y2773-M2775 PolarHBondContact O-N 3.13Å; Y2773-I2776 PolarHBondContact O-N 3.15Å; Y2773-V2777 HydrophobicContact CD1-CG2 4.34Å; Y2773-V2777 HydrophobicContact CD2-CG2 4.3Å; Y2773-V2777 HydrophobicContact CE1-CG2 4.13Å; Y2773-V2777 HydrophobicContact CE2-CG2 3.96Å; Y2773-V2777 WeakPolarHBondContact O-CB 3.3Å; Y2773-V2777 VanDerWaalsContact O-CG2 3.3Å; Y2773-V2777 WeakPolarHBondContact O-CG2 3.36Å; Y2773-V2777 PolarHBondContact O-N 3.15Å; Y2773-W3074 AromaticContact CD2-CH2 3.78Å; Y2773-W3074 HydrophobicContact CD2-CH2 3.78Å; Y2773-W3074 AromaticContact CD2-CZ2 3.82Å; Y2773-W3074 HydrophobicContact CD2-CZ2 3.82Å; Y2773-W3074 AromaticContact CE2-CH2 3.86Å; Y2773-W3074 HydrophobicContact CE2-CH2 3.86Å; Y2773-W3074 HydrophobicContact CE2-CZ2 4.3Å; Y2773-W3074 HydrophobicContact CG-CH2 4.49Å; Y2773-W3074 HydrophobicContact CG-CZ2 4.4Å; Y2773-F3185 HydrophobicContact CD1-CE1 4.33Å; Y2773-F3185 HydrophobicContact CD2-CE1 4.37Å; Y2773-F3185 AromaticContact CG-CE1 3.84Å; Y2773-F3185 HydrophobicContact CG-CE1 4.14Å; Y2773-F3185 HydrophobicContact CG-CZ 4.49Å; Y2773-F3186 AromaticContact CE1-CD1 3.88Å; Y2773-F3186 HydrophobicContact CE1-CD1 3.88Å; Y2773-F3186 HydrophobicContact CE1-CE1 4.33Å; Y2773-F3186 HydrophobicContact CE2-CE1 4.29Å; Y2773-F3186 AromaticContact CZ-CD1 3.78Å; Y2773-F3186 AromaticContact CZ-CE1 3.93Å
2774	H	85.9	Confident	85.7	Confident	61.4 Å²	61.4	39.7 Å²	39.7	28%	0.284	21%	0.211	S	C	.	.	H	α-helix	trans	-62.3	-42.2	175.3	-94	-31.5	0	0	0	112.8	L2514 S2770 L2771 Q2772 I2776 V2777 E2778 P3188	L2514-H2774 HydrophobicContact CD2-CB 3.79Å; S2770-H2774 PolarHBondContact O-CD2 3.11Å; S2770-H2774 VanDerWaalsContact O-CD2 3.32Å; S2770-H2774 PolarHBondContact O-N 3.12Å; L2771-H2774 PolarHBondContact O-N 3.3Å; Q2772-H2774 VanDerWaalsContact C-N 3.33Å; Q2772-H2774 PolarHBondContact O-N 2.93Å; H2774-I2776 VanDerWaalsContact C-N 3.34Å; H2774-I2776 PolarHBondContact O-N 2.94Å; H2774-V2777 PolarHBondContact O-N 3.24Å; H2774-V2777 VanDerWaalsContact O-N 3.15Å; H2774-E2778 IonicContact CE1-OE1 3.28Å; H2774-E2778 IonicContact NE2-OE1 3.72Å; H2774-E2778 WeakPolarHBondContact O-CB 3.23Å; H2774-E2778 PolarHBondContact O-N 3.3Å; H2774-P3188 VanDerWaalsContact NE2-CD 3.31Å; H2774-P3188 WeakPolarHBondContact NE2-CD 3.48Å; H2774-P3188 VanDerWaalsContact NE2-CG 3.26Å; H2774-P3188 WeakPolarHBondContact NE2-CG 3.24Å
2775	M	87	Confident	84.6	Confident	3.8 Å²	3.8	42.6 Å²	42.6	2%	0.019	23%	0.225	C	C	.	.	H	α-helix	trans	-59.9	-43.5	175	-140.8	-178.6	-21.9	0	0	112.3	T2511 L2514 G2516 Y2517 V2518 A2558 T2559 L2771 Q2772 Y2773 E2778 I2779	T2511-M2775 HydrophobicContact CG2-CB 4.12Å; T2511-M2775 HydrophobicContact CG2-CG 4.19Å; L2514-M2775 HydrophobicContact CB-CG 4.11Å; L2514-M2775 HydrophobicContact CD1-CB 4.07Å; L2514-M2775 HydrophobicContact CD1-CG 3.8Å; L2514-M2775 HydrophobicContact CD2-CB 4.38Å; L2514-M2775 HydrophobicContact CD2-CG 4.17Å; G2516-M2775 VanDerWaalsContact C-SD 3.57Å; Y2517-M2775 VanDerWaalsContact C-SD 3.52Å; Y2517-M2775 PolarHBondContact N-SD 2.77Å; V2518-M2775 HydrophobicContact CG2-CB 4.47Å; V2518-M2775 HydrophobicContact CG2-CE 3.89Å; V2518-M2775 HydrophobicContact CG2-CG 4.15Å; V2518-M2775 HydrophobicContact CG2-SD 4.06Å; A2558-M2775 HydrophobicContact CB-CE 3.84Å; A2558-M2775 HydrophobicContact CB-SD 4.13Å; T2559-M2775 WeakPolarHBondContact O-CE 3.47Å; T2559-M2775 VanDerWaalsContact OG1-CE 3.32Å; T2559-M2775 WeakPolarHBondContact OG1-CE 3.23Å; L2771-M2775 HydrophobicContact CG-CE 4.41Å; L2771-M2775 VanDerWaalsContact O-CB 3.3Å; L2771-M2775 WeakPolarHBondContact O-CB 3.33Å; L2771-M2775 WeakPolarHBondContact O-CG 3.37Å; L2771-M2775 PolarHBondContact O-N 3.18Å; Q2772-M2775 HydrophobicContact CB-CE 4.36Å; Q2772-M2775 HydrophobicContact CG-CE 4.11Å; Q2772-M2775 WeakPolarHBondContact O-CB 3.29Å; Q2772-M2775 PolarHBondContact O-N 3.07Å; Y2773-M2775 VanDerWaalsContact C-N 3.34Å; Y2773-M2775 PolarHBondContact O-N 3.13Å; M2775-E2778 PolarHBondContact O-N 3.08Å; M2775-I2779 HydrophobicContact CG-CD1 3.85Å; M2775-I2779 WeakPolarHBondContact O-CB 3.26Å; M2775-I2779 WeakPolarHBondContact O-CD1 3.32Å; M2775-I2779 VanDerWaalsContact O-CG1 3.26Å; M2775-I2779 WeakPolarHBondContact O-CG1 3.37Å; M2775-I2779 PolarHBondContact O-N 3.08Å
2776	I	88.6	Confident	83.5	Confident	52.8 Å²	52.8	43.3 Å²	43.3	27%	0.271	22%	0.224	S	C	.	.	H	α-helix	trans	-62.8	-44.8	173.9	-72.1	175.6	0	0	0	110.7	V2518 M2710 T2768 Q2772 Y2773 H2774 E2778 I2779 V2780	V2518-I2776 HydrophobicContact CG2-CG1 4.17Å; M2710-I2776 HydrophobicContact CE-CD1 3.44Å; M2710-I2776 HydrophobicContact CE-CG1 4.08Å; M2710-I2776 HydrophobicContact SD-CD1 3.93Å; M2710-I2776 HydrophobicContact SD-CG1 4.45Å; T2768-I2776 HydrophobicContact CG2-CD1 4.07Å; Q2772-I2776 WeakPolarHBondContact O-CG1 3.31Å; Q2772-I2776 PolarHBondContact O-N 3.13Å; Y2773-I2776 PolarHBondContact O-N 3.15Å; H2774-I2776 VanDerWaalsContact C-N 3.34Å; H2774-I2776 PolarHBondContact O-N 2.94Å; I2776-E2778 VanDerWaalsContact C-N 3.34Å; I2776-E2778 PolarHBondContact O-N 3.15Å; I2776-I2779 PolarHBondContact O-N 3.1Å; I2776-V2780 HydrophobicContact CG2-CG2 4.06Å; I2776-V2780 VanDerWaalsContact O-CB 3.3Å; I2776-V2780 WeakPolarHBondContact O-CB 3.38Å; I2776-V2780 VanDerWaalsContact O-CG2 3.25Å; I2776-V2780 WeakPolarHBondContact O-CG2 3.36Å; I2776-V2780 PolarHBondContact O-N 2.93Å
2777	V	84.8	Confident	82	Confident	42.2 Å²	42.2	45.9 Å²	45.9	26%	0.256	24%	0.239	S	C	.	.	H	α-helix	trans	-63.4	-40.5	-179.4	171	0	0	0	0	111.5	Y2773 H2774 V2780 N2781	Y2773-V2777 HydrophobicContact CD1-CG2 4.34Å; Y2773-V2777 HydrophobicContact CD2-CG2 4.3Å; Y2773-V2777 HydrophobicContact CE1-CG2 4.13Å; Y2773-V2777 HydrophobicContact CE2-CG2 3.96Å; Y2773-V2777 WeakPolarHBondContact O-CB 3.3Å; Y2773-V2777 VanDerWaalsContact O-CG2 3.3Å; Y2773-V2777 WeakPolarHBondContact O-CG2 3.36Å; Y2773-V2777 PolarHBondContact O-N 3.15Å; H2774-V2777 PolarHBondContact O-N 3.24Å; H2774-V2777 VanDerWaalsContact O-N 3.15Å; V2777-V2780 PolarHBondContact O-N 3.19Å; V2777-N2781 WeakPolarHBondContact CG1-ND2 3.46Å; V2777-N2781 WeakPolarHBondContact O-CB 3.34Å; V2777-N2781 PolarHBondContact O-N 3.1Å; V2777-N2781 VanDerWaalsContact O-N 3.09Å; V2777-N2781 PolarHBondContact O-ND2 3.11Å; V2777-N2781 PolarHBondContact O-OD1 2.89Å
2778	E	82.9	Confident	80.4	Confident	31.6 Å²	31.6	50.2 Å²	50.2	15%	0.148	26%	0.258	C	S	.	.	H	α-helix	trans	-64.6	-49.2	173.3	-107.3	-171.6	165.2	0	0	111.5	T2511 N2512 H2513 L2514 H2774 M2775 I2776 V2780 N2781 D2782 R3273	T2511-E2778 VanDerWaalsContact CB-OE2 3.32Å; T2511-E2778 WeakPolarHBondContact CB-OE2 3.43Å; T2511-E2778 HydrophobicContact CG2-CB 3.99Å; T2511-E2778 HydrophobicContact CG2-CG 4.16Å; T2511-E2778 VanDerWaalsContact CG2-OE2 3.32Å; T2511-E2778 WeakPolarHBondContact CG2-OE2 3.24Å; N2512-E2778 WeakPolarHBondContact CA-OE1 3.04Å; N2512-E2778 WeakPolarHBondContact CB-OE1 3.38Å; N2512-E2778 PolarHBondContact N-OE1 3.46Å; H2513-E2778 IonicContact CD2-OE1 3.3Å; H2513-E2778 IonicContact CG-OE1 2.75Å; H2513-E2778 PolarHBondContact N-OE1 3.22Å; L2514-E2778 HydrophobicContact CD1-CB 4.23Å; L2514-E2778 VanDerWaalsContact CD1-OE2 3.26Å; L2514-E2778 WeakPolarHBondContact CD1-OE2 3.38Å; L2514-E2778 WeakPolarHBondContact CD2-OE2 3.41Å; L2514-E2778 VanDerWaalsContact CG-OE2 3.31Å; L2514-E2778 WeakPolarHBondContact CG-OE2 3.31Å; L2514-E2778 PolarHBondContact N-OE2 2.96Å; H2774-E2778 IonicContact CE1-OE1 3.28Å; H2774-E2778 IonicContact NE2-OE1 3.72Å; H2774-E2778 WeakPolarHBondContact O-CB 3.23Å; H2774-E2778 PolarHBondContact O-N 3.3Å; M2775-E2778 PolarHBondContact O-N 3.08Å; I2776-E2778 VanDerWaalsContact C-N 3.34Å; I2776-E2778 PolarHBondContact O-N 3.15Å; E2778-V2780 VanDerWaalsContact C-N 3.31Å; E2778-V2780 PolarHBondContact O-N 2.94Å; E2778-N2781 WeakPolarHBondContact O-CB 3.28Å; E2778-N2781 PolarHBondContact O-N 3.08Å; E2778-N2781 VanDerWaalsContact O-N 3.13Å; E2778-D2782 VanDerWaalsContact O-CB 3.29Å; E2778-D2782 WeakPolarHBondContact O-CB 3.37Å; E2778-D2782 PolarHBondContact O-N 3.14Å; E2778-R3273 IonicContact OE1-NH2 3.51Å
2779	I	86.2	Confident	78.5	Confident	10.4 Å²	10.4	53.4 Å²	53.4	5%	0.053	28%	0.28	C	S	.	.	H	α-helix	trans	-58.4	-41.6	177.1	-72.1	166.7	0	0	0	111.9	L2509 T2511 L2514 V2518 M2775 I2776 N2781 D2782 L2783 L2784	L2509-I2779 HydrophobicContact CB-CD1 4.09Å; L2509-I2779 HydrophobicContact CB-CG1 4.46Å; L2509-I2779 HydrophobicContact CB-CG2 4.02Å; L2509-I2779 HydrophobicContact CD1-CG2 3.79Å; L2509-I2779 HydrophobicContact CG-CG2 4.41Å; T2511-I2779 HydrophobicContact CG2-CD1 4.12Å; T2511-I2779 HydrophobicContact CG2-CG1 3.95Å; L2514-I2779 HydrophobicContact CD1-CD1 4.39Å; L2514-I2779 HydrophobicContact CD1-CG1 4.12Å; V2518-I2779 HydrophobicContact CB-CD1 3.92Å; V2518-I2779 HydrophobicContact CG2-CD1 3.51Å; V2518-I2779 VanDerWaalsContact CG2-CD1 3.46Å; M2775-I2779 HydrophobicContact CG-CD1 3.85Å; M2775-I2779 WeakPolarHBondContact O-CB 3.26Å; M2775-I2779 WeakPolarHBondContact O-CD1 3.32Å; M2775-I2779 VanDerWaalsContact O-CG1 3.26Å; M2775-I2779 WeakPolarHBondContact O-CG1 3.37Å; M2775-I2779 PolarHBondContact O-N 3.08Å; I2776-I2779 PolarHBondContact O-N 3.1Å; I2779-N2781 VanDerWaalsContact C-N 3.33Å; I2779-D2782 PolarHBondContact O-N 3.16Å; I2779-L2783 HydrophobicContact CG1-CD1 4.31Å; I2779-L2783 HydrophobicContact CG2-CB 4.4Å; I2779-L2783 HydrophobicContact CG2-CD1 3.95Å; I2779-L2783 HydrophobicContact CG2-CD2 4.2Å; I2779-L2783 HydrophobicContact CG2-CG 4.27Å; I2779-L2783 CarbonylContact O-C 3.55Å; I2779-L2783 WeakPolarHBondContact O-CA 3.38Å; I2779-L2783 VanDerWaalsContact O-CB 3.3Å; I2779-L2783 WeakPolarHBondContact O-CB 3.41Å; I2779-L2783 VanDerWaalsContact O-CG 3.31Å; I2779-L2783 WeakPolarHBondContact O-CG 3.28Å; I2779-L2783 PolarHBondContact O-N 3.1Å; I2779-L2784 HydrophobicContact CG2-CD1 4.23Å; I2779-L2784 HydrophobicContact CG2-CG 4.37Å; I2779-L2784 PolarHBondContact O-N 3.17Å; I2779-L2784 VanDerWaalsContact O-N 3.1Å
2780	V	82.1	Confident	76.7	Confident	53 Å²	53	58.5 Å²	58.5	32%	0.321	30%	0.303	S	S	.	.	I	π-helix	trans	-66.2	-41.7	177.6	167.6	0	0	0	0	111.1	I2776 V2777 E2778 L2784 L2785	I2776-V2780 HydrophobicContact CG2-CG2 4.06Å; I2776-V2780 VanDerWaalsContact O-CB 3.3Å; I2776-V2780 WeakPolarHBondContact O-CB 3.38Å; I2776-V2780 VanDerWaalsContact O-CG2 3.25Å; I2776-V2780 WeakPolarHBondContact O-CG2 3.36Å; I2776-V2780 PolarHBondContact O-N 2.93Å; V2777-V2780 PolarHBondContact O-N 3.19Å; E2778-V2780 VanDerWaalsContact C-N 3.31Å; E2778-V2780 PolarHBondContact O-N 2.94Å; V2780-L2784 HydrophobicContact CG1-CB 4.4Å; V2780-L2784 HydrophobicContact CG1-CD1 4.14Å; V2780-L2784 HydrophobicContact CG1-CD2 4.28Å; V2780-L2784 HydrophobicContact CG2-CD1 4.31Å; V2780-L2784 WeakPolarHBondContact O-CA 3.39Å; V2780-L2784 WeakPolarHBondContact O-CB 3.36Å; V2780-L2784 PolarHBondContact O-N 2.86Å; V2780-L2785 HydrophobicContact CG1-CD1 3.61Å; V2780-L2785 HydrophobicContact CG1-CG 4.07Å; V2780-L2785 VanDerWaalsContact O-CB 3.24Å; V2780-L2785 WeakPolarHBondContact O-CB 3.34Å; V2780-L2785 WeakPolarHBondContact O-CG 3.25Å; V2780-L2785 PolarHBondContact O-N 2.92Å
2781	N	79.6	Confident	74.9	Confident	69.6 Å²	69.6	65.6 Å²	65.6	37%	0.372	33%	0.325	S	S	.	.	I	π-helix	trans	-70.9	-41.5	177.9	-73.7	-48.1	0	0	0	112.8	V2777 E2778 I2779 L2783 L2785 Y2786	V2777-N2781 WeakPolarHBondContact CG1-ND2 3.46Å; V2777-N2781 WeakPolarHBondContact O-CB 3.34Å; V2777-N2781 PolarHBondContact O-N 3.1Å; V2777-N2781 VanDerWaalsContact O-N 3.09Å; V2777-N2781 PolarHBondContact O-ND2 3.11Å; V2777-N2781 PolarHBondContact O-OD1 2.89Å; E2778-N2781 WeakPolarHBondContact O-CB 3.28Å; E2778-N2781 PolarHBondContact O-N 3.08Å; E2778-N2781 VanDerWaalsContact O-N 3.13Å; I2779-N2781 VanDerWaalsContact C-N 3.33Å; N2781-L2783 PolarHBondContact O-N 2.87Å; N2781-L2785 CarbonylContact O-C 3.55Å; N2781-L2785 WeakPolarHBondContact O-CA 3.31Å; N2781-L2785 VanDerWaalsContact O-CB 3.31Å; N2781-L2785 WeakPolarHBondContact O-CB 3.39Å; N2781-L2785 PolarHBondContact O-N 3.03Å; N2781-L2785 WeakPolarHBondContact OD1-CD1 3.44Å; N2781-Y2786 PolarHBondContact O-N 3.09Å
2782	D	77.3	Confident	73.4	Confident	47.6 Å²	47.6	68.3 Å²	68.3	26%	0.255	33%	0.334	S	S	.	.	I	π-helix	trans	-91.3	-23.6	-171.7	-76.4	-11.8	0	0	0	114.1	R2243 T2511 E2778 I2779 Y2786 R3277	R2243-D2782 IonicContact CZ-OD2 2.81Å; R2243-D2782 PolarHBondContact NH1-O 3.08Å; R2243-D2782 IonicContact NH1-OD2 3.99Å; R2243-D2782 PolarHBondContact NH1-OD2 3.45Å; R2243-D2782 IonicContact NH2-OD2 3.67Å; T2511-D2782 HydrophobicContact CG2-CB 4.33Å; E2778-D2782 VanDerWaalsContact O-CB 3.29Å; E2778-D2782 WeakPolarHBondContact O-CB 3.37Å; E2778-D2782 PolarHBondContact O-N 3.14Å; I2779-D2782 PolarHBondContact O-N 3.16Å; D2782-Y2786 WeakPolarHBondContact O-CB 3.42Å; D2782-R3277 IonicContact OD1-CZ 3.23Å; D2782-R3277 IonicContact OD1-NH1 2.67Å; D2782-R3277 PolarHBondContact OD1-NH1 3.25Å; D2782-R3277 IonicContact OD1-NH2 2.74Å; D2782-R3277 PolarHBondContact OD1-NH2 2.86Å
2783	L	75.7	Confident	71.5	Confident	40 Å²	40	70.4 Å²	70.4	21%	0.209	35%	0.347	C	S	.	.	I	π-helix	trans	-108	-45.4	179.8	-79.7	159.4	0	0	0	113.5	W2238 E2240 L2509 T2511 I2779 N2781	W2238-L2783 HydrophobicContact CG-CD2 4.38Å; W2238-L2783 HydrophobicContact CG-CG 4.49Å; W2238-L2783 VanDerWaalsContact NE1-CD2 3.33Å; W2238-L2783 PolarHBondContact NE1-O 3.08Å; W2238-L2783 WeakPolarHBondContact O-CD2 3.3Å; E2240-L2783 HydrophobicContact CB-CD1 4.38Å; L2509-L2783 HydrophobicContact CB-CD1 4.48Å; L2509-L2783 HydrophobicContact CB-CD2 3.9Å; L2509-L2783 HydrophobicContact CD1-CD1 4.13Å; L2509-L2783 HydrophobicContact CD2-CD1 4.23Å; L2509-L2783 HydrophobicContact CD2-CD2 4.2Å; T2511-L2783 HydrophobicContact CG2-CD1 3.92Å; T2511-L2783 HydrophobicContact CG2-CG 4.22Å; I2779-L2783 HydrophobicContact CG1-CD1 4.31Å; I2779-L2783 HydrophobicContact CG2-CB 4.4Å; I2779-L2783 HydrophobicContact CG2-CD1 3.95Å; I2779-L2783 HydrophobicContact CG2-CD2 4.2Å; I2779-L2783 HydrophobicContact CG2-CG 4.27Å; I2779-L2783 CarbonylContact O-C 3.55Å; I2779-L2783 WeakPolarHBondContact O-CA 3.38Å; I2779-L2783 VanDerWaalsContact O-CB 3.3Å; I2779-L2783 WeakPolarHBondContact O-CB 3.41Å; I2779-L2783 VanDerWaalsContact O-CG 3.31Å; I2779-L2783 WeakPolarHBondContact O-CG 3.28Å; I2779-L2783 PolarHBondContact O-N 3.1Å; N2781-L2783 PolarHBondContact O-N 2.87Å
2784	L	70.7	Confident	69.6	Low	84.4 Å²	84.4	70.1 Å²	70.1	44%	0.442	36%	0.36	S	S	.	.	I	π-helix	trans	-95.9	-41.4	-171.5	-79.3	157.1	0	0	0	113.3	L2509 I2779 V2780 Y2786 V3067	L2509-L2784 HydrophobicContact CD1-CD1 4.3Å; L2509-L2784 HydrophobicContact CD2-CD2 4.34Å; I2779-L2784 HydrophobicContact CG2-CD1 4.23Å; I2779-L2784 HydrophobicContact CG2-CG 4.37Å; I2779-L2784 PolarHBondContact O-N 3.17Å; I2779-L2784 VanDerWaalsContact O-N 3.1Å; V2780-L2784 HydrophobicContact CG1-CB 4.4Å; V2780-L2784 HydrophobicContact CG1-CD1 4.14Å; V2780-L2784 HydrophobicContact CG1-CD2 4.28Å; V2780-L2784 HydrophobicContact CG2-CD1 4.31Å; V2780-L2784 WeakPolarHBondContact O-CA 3.39Å; V2780-L2784 WeakPolarHBondContact O-CB 3.36Å; V2780-L2784 PolarHBondContact O-N 2.86Å; L2784-Y2786 VanDerWaalsContact C-N 3.28Å; L2784-Y2786 PolarHBondContact O-N 2.82Å; L2784-V3067 HydrophobicContact CD2-CG2 4.48Å
2785	L	68.3	Low	68.2	Low	87.4 Å²	87.4	71.4 Å²	71.4	46%	0.458	37%	0.365	S	S	.	.	S	Bend	trans	-93.7	6.4	177.2	-55.4	-175.7	0	0	0	113.1	V2780 N2781 V2787	V2780-L2785 HydrophobicContact CG1-CD1 3.61Å; V2780-L2785 HydrophobicContact CG1-CG 4.07Å; V2780-L2785 VanDerWaalsContact O-CB 3.24Å; V2780-L2785 WeakPolarHBondContact O-CB 3.34Å; V2780-L2785 WeakPolarHBondContact O-CG 3.25Å; V2780-L2785 PolarHBondContact O-N 2.92Å; N2781-L2785 CarbonylContact O-C 3.55Å; N2781-L2785 WeakPolarHBondContact O-CA 3.31Å; N2781-L2785 VanDerWaalsContact O-CB 3.31Å; N2781-L2785 WeakPolarHBondContact O-CB 3.39Å; N2781-L2785 PolarHBondContact O-N 3.03Å; N2781-L2785 WeakPolarHBondContact OD1-CD1 3.44Å; L2785-V2787 PolarHBondContact O-N 3.25Å; L2785-V2787 VanDerWaalsContact O-N 3.11Å
2786	Y	66.6	Low	66.8	Low	84.8 Å²	84.8	74.8 Å²	74.8	33%	0.333	38%	0.383	S	S	.	.			trans	-58.1	112.8	173.9	-176.1	-93.2	0	0	0	110.8	Y2247 N2781 D2782 L2784 E2788 P2789	Y2247-Y2786 HydrophobicContact CE2-CD1 4.19Å; Y2247-Y2786 HydrophobicContact CE2-CE1 4.44Å; N2781-Y2786 PolarHBondContact O-N 3.09Å; D2782-Y2786 WeakPolarHBondContact O-CB 3.42Å; L2784-Y2786 VanDerWaalsContact C-N 3.28Å; L2784-Y2786 PolarHBondContact O-N 2.82Å; Y2786-E2788 HydrophobicContact CE1-CB 4.21Å; Y2786-E2788 HydrophobicContact CE1-CG 4.12Å; Y2786-P2789 VanDerWaalsContact OH-CD 3.28Å; Y2786-P2789 WeakPolarHBondContact OH-CD 3.4Å
2787	V	61	Low	65.3	Low	90.6 Å²	90.6	75.6 Å²	75.6	55%	0.549	39%	0.386	S	S	.	.			trans	-104.5	120.1	168.8	-179.2	0	0	0	0	107	L2785 P2789 K2792	L2785-V2787 PolarHBondContact O-N 3.25Å; L2785-V2787 VanDerWaalsContact O-N 3.11Å; V2787-P2789 WeakPolarHBondContact O-CD 3.36Å; V2787-P2789 VanDerWaalsContact O-N 3.16Å; V2787-K2792 HydrophobicContact CG1-CD 3.87Å; V2787-K2792 HydrophobicContact CG1-CG 4.1Å
2788	E	56.7	Low	64.2	Low	102.4 Å²	102.4	81.4 Å²	81.4	48%	0.479	40%	0.403	S	S	.	.			trans	-53.7	123.8	176.2	-156.9	-175.7	-165	0	0	110	Y2786 Q2790 R2791 K2792	Y2786-E2788 HydrophobicContact CE1-CB 4.21Å; Y2786-E2788 HydrophobicContact CE1-CG 4.12Å; E2788-Q2790 VanDerWaalsContact C-N 3.35Å; E2788-Q2790 WeakPolarHBondContact O-CG 3.21Å; E2788-Q2790 PolarHBondContact O-N 3.02Å; E2788-Q2790 VanDerWaalsContact O-N 3.17Å; E2788-R2791 HydrophobicContact CB-CB 4.2Å; E2788-R2791 HydrophobicContact CG-CB 4.18Å; E2788-R2791 WeakPolarHBondContact O-CB 3.31Å; E2788-R2791 PolarHBondContact O-N 3.06Å; E2788-R2791 VanDerWaalsContact OE2-CD 3.29Å; E2788-R2791 WeakPolarHBondContact OE2-CD 3.47Å; E2788-R2791 IonicContact OE2-CZ 3.18Å; E2788-R2791 IonicContact OE2-NE 3.73Å; E2788-R2791 IonicContact OE2-NH1 2.73Å; E2788-R2791 PolarHBondContact OE2-NH1 3.08Å; E2788-K2792 HydrophobicContact CG-CB 3.95Å; E2788-K2792 HydrophobicContact CG-CD 3.96Å; E2788-K2792 WeakPolarHBondContact OE1-CB 3.2Å; E2788-K2792 WeakPolarHBondContact OE1-CD 3.29Å
2789	P	52.9	Low	63.4	Low	83.4 Å²	83.4	81.5 Å²	81.5	54%	0.542	41%	0.405	S	S	.	.			trans	-61.2	111	-174.6	3.4	-7.1	0	0	0	111.3	Y2786 V2787 R2791 K2792	Y2786-P2789 VanDerWaalsContact OH-CD 3.28Å; Y2786-P2789 WeakPolarHBondContact OH-CD 3.4Å; V2787-P2789 WeakPolarHBondContact O-CD 3.36Å; V2787-P2789 VanDerWaalsContact O-N 3.16Å; P2789-R2791 VanDerWaalsContact C-N 3.29Å; P2789-R2791 PolarHBondContact O-N 3.1Å; P2789-R2791 VanDerWaalsContact O-N 3.15Å; P2789-K2792 PolarHBondContact O-N 3.07Å
2790	Q	51	Low	62.4	Low	119.2 Å²	119.2	88 Å²	88	56%	0.557	43%	0.428	S	S	*	.			trans	-59.8	43	-171.5	-63.5	-173	19.4	0	0	113.6	E2788 K2792 V2793 A2794	E2788-Q2790 VanDerWaalsContact C-N 3.35Å; E2788-Q2790 WeakPolarHBondContact O-CG 3.21Å; E2788-Q2790 PolarHBondContact O-N 3.02Å; E2788-Q2790 VanDerWaalsContact O-N 3.17Å; Q2790-K2792 VanDerWaalsContact C-N 3.34Å; Q2790-K2792 PolarHBondContact O-N 3.17Å; Q2790-K2792 VanDerWaalsContact O-N 3.17Å; Q2790-V2793 HydrophobicContact CB-CG2 3.83Å; Q2790-V2793 PolarHBondContact O-N 3.24Å; Q2790-A2794 WeakPolarHBondContact O-CB 3.4Å; Q2790-A2794 PolarHBondContact O-N 3.09Å
2791	R	51.5	Low	61.5	Low	183 Å²	183	90.9 Å²	90.9	69%	0.691	44%	0.441	S	S	*	.	H	α-helix	trans	-68.9	-2.4	177.6	-102.3	-176.4	-179.2	174.7	-1.5	113.8	D2251 E2788 P2789 V2793 K2795 D3555	D2251-R2791 IonicContact OD1-CZ 3.64Å; D2251-R2791 IonicContact OD1-NH1 3.62Å; D2251-R2791 IonicContact OD1-NH2 2.86Å; D2251-R2791 PolarHBondContact OD1-NH2 2.85Å; D2251-R2791 IonicContact OD2-CZ 2.83Å; D2251-R2791 IonicContact OD2-NH1 2.77Å; D2251-R2791 PolarHBondContact OD2-NH1 2.95Å; D2251-R2791 IonicContact OD2-NH2 3.73Å; D2251-R2791 PolarHBondContact OD2-NH2 3.47Å; E2788-R2791 HydrophobicContact CB-CB 4.2Å; E2788-R2791 HydrophobicContact CG-CB 4.18Å; E2788-R2791 WeakPolarHBondContact O-CB 3.31Å; E2788-R2791 PolarHBondContact O-N 3.06Å; E2788-R2791 VanDerWaalsContact OE2-CD 3.29Å; E2788-R2791 WeakPolarHBondContact OE2-CD 3.47Å; E2788-R2791 IonicContact OE2-CZ 3.18Å; E2788-R2791 IonicContact OE2-NE 3.73Å; E2788-R2791 IonicContact OE2-NH1 2.73Å; E2788-R2791 PolarHBondContact OE2-NH1 3.08Å; P2789-R2791 VanDerWaalsContact C-N 3.29Å; P2789-R2791 PolarHBondContact O-N 3.1Å; P2789-R2791 VanDerWaalsContact O-N 3.15Å; R2791-V2793 PolarHBondContact O-N 3.44Å; R2791-K2795 VanDerWaalsContact O-CB 3.24Å; R2791-K2795 WeakPolarHBondContact O-CB 3.46Å; R2791-K2795 PolarHBondContact O-N 2.92Å; R2791-D3555 IonicContact CZ-OD1 3.64Å; R2791-D3555 IonicContact NH1-OD1 3.54Å; R2791-D3555 IonicContact NH2-OD1 2.74Å; R2791-D3555 PolarHBondContact NH2-OD1 3.45Å
2792	K	52.5	Low	61.1	Low	108 Å²	108	91 Å²	91	47%	0.47	44%	0.444	S	S	.	.	H	α-helix	trans	-76.9	-23	177	-71.5	178.5	176.4	171.7	0	113.1	V2787 E2788 P2789 Q2790 A2794 K2795 L2796 D2910 Y3496	V2787-K2792 HydrophobicContact CG1-CD 3.87Å; V2787-K2792 HydrophobicContact CG1-CG 4.1Å; E2788-K2792 HydrophobicContact CG-CB 3.95Å; E2788-K2792 HydrophobicContact CG-CD 3.96Å; E2788-K2792 WeakPolarHBondContact OE1-CB 3.2Å; E2788-K2792 WeakPolarHBondContact OE1-CD 3.29Å; P2789-K2792 PolarHBondContact O-N 3.07Å; Q2790-K2792 VanDerWaalsContact C-N 3.34Å; Q2790-K2792 PolarHBondContact O-N 3.17Å; Q2790-K2792 VanDerWaalsContact O-N 3.17Å; K2792-A2794 VanDerWaalsContact C-N 3.34Å; K2792-A2794 PolarHBondContact O-N 3.05Å; K2792-K2795 HydrophobicContact CB-CB 3.97Å; K2792-K2795 HydrophobicContact CD-CD 4.16Å; K2792-K2795 WeakPolarHBondContact O-CA 3.49Å; K2792-K2795 VanDerWaalsContact O-CB 3.22Å; K2792-K2795 WeakPolarHBondContact O-CB 3.32Å; K2792-K2795 PolarHBondContact O-N 3.08Å; K2792-K2795 VanDerWaalsContact O-N 3.13Å; K2792-L2796 WeakPolarHBondContact O-CB 3.43Å; K2792-L2796 PolarHBondContact O-N 2.88Å; K2792-L2796 VanDerWaalsContact O-N 3.09Å; K2792-D2910 IonicContact NZ-OD1 3.64Å; K2792-D2910 PolarHBondContact NZ-OD1 2.95Å; K2792-D2910 IonicContact NZ-OD2 3.12Å; K2792-D2910 PolarHBondContact NZ-OD2 2.95Å; K2792-Y3496 VanDerWaalsContact CE-CE1 3.42Å
2793	V	49	Very low	61	Low	45.4 Å²	45.4	89.2 Å²	89.2	28%	0.275	44%	0.435	S	S	.	.	H	α-helix	trans	-62.8	-45.1	-176.4	-176.4	0	0	0	0	112.4	Q2790 R2791 K2795 L2796 E2797 D3103	Q2790-V2793 HydrophobicContact CB-CG2 3.83Å; Q2790-V2793 PolarHBondContact O-N 3.24Å; R2791-V2793 PolarHBondContact O-N 3.44Å; V2793-K2795 PolarHBondContact O-N 3.08Å; V2793-K2795 VanDerWaalsContact O-N 3.1Å; V2793-L2796 WeakPolarHBondContact O-CA 3.41Å; V2793-L2796 WeakPolarHBondContact O-CB 3.46Å; V2793-L2796 PolarHBondContact O-N 3.18Å; V2793-E2797 HydrophobicContact CG1-CG 4.37Å; V2793-E2797 PolarHBondContact O-N 3.03Å; V2793-D3103 WeakPolarHBondContact CG1-OD2 3.45Å
2794	A	50.3	Low	60.7	Low	70.8 Å²	70.8	89.7 Å²	89.7	59%	0.585	45%	0.45	S	S	*	.	H	α-helix	trans	-61.4	-27.6	176.9	0	0	0	0	0	113.5	Q2790 K2792 R2798	Q2790-A2794 WeakPolarHBondContact O-CB 3.4Å; Q2790-A2794 PolarHBondContact O-N 3.09Å; K2792-A2794 VanDerWaalsContact C-N 3.34Å; K2792-A2794 PolarHBondContact O-N 3.05Å; A2794-R2798 WeakPolarHBondContact O-CB 3.32Å; A2794-R2798 PolarHBondContact O-N 3.16Å; A2794-R2798 VanDerWaalsContact O-N 3.16Å
2795	K	57.2	Low	60.8	Low	89.4 Å²	89.4	93 Å²	93	39%	0.389	47%	0.467	S	S	.	.	H	α-helix	trans	-78.2	-39.3	174.5	-169.3	178.3	-177.1	178.6	0	111.4	R2791 K2792 V2793 N2799 D2910	R2791-K2795 VanDerWaalsContact O-CB 3.24Å; R2791-K2795 WeakPolarHBondContact O-CB 3.46Å; R2791-K2795 PolarHBondContact O-N 2.92Å; K2792-K2795 HydrophobicContact CB-CB 3.97Å; K2792-K2795 HydrophobicContact CD-CD 4.16Å; K2792-K2795 WeakPolarHBondContact O-CA 3.49Å; K2792-K2795 VanDerWaalsContact O-CB 3.22Å; K2792-K2795 WeakPolarHBondContact O-CB 3.32Å; K2792-K2795 PolarHBondContact O-N 3.08Å; K2792-K2795 VanDerWaalsContact O-N 3.13Å; V2793-K2795 PolarHBondContact O-N 3.08Å; V2793-K2795 VanDerWaalsContact O-N 3.1Å; K2795-N2799 VanDerWaalsContact O-CB 3.24Å; K2795-N2799 WeakPolarHBondContact O-CB 3.39Å; K2795-N2799 PolarHBondContact O-N 3.15Å; K2795-N2799 VanDerWaalsContact O-N 3.12Å; K2795-N2799 PolarHBondContact O-ND2 3.1Å; K2795-N2799 PolarHBondContact O-OD1 2.92Å; K2795-D2910 IonicContact NZ-OD1 3.15Å; K2795-D2910 PolarHBondContact NZ-OD1 3.21Å; K2795-D2910 IonicContact NZ-OD2 3.4Å; K2795-D2910 PolarHBondContact NZ-OD2 3.1Å
2796	L	58.4	Low	61.2	Low	75.6 Å²	75.6	91.1 Å²	91.1	40%	0.396	46%	0.456	S	S	.	.	H	α-helix	trans	-64.2	-50.4	176.6	-164	108.7	0	0	0	111.8	K2792 V2793 R2798 N2799 R2800 Q2917	K2792-L2796 WeakPolarHBondContact O-CB 3.43Å; K2792-L2796 PolarHBondContact O-N 2.88Å; K2792-L2796 VanDerWaalsContact O-N 3.09Å; V2793-L2796 WeakPolarHBondContact O-CA 3.41Å; V2793-L2796 WeakPolarHBondContact O-CB 3.46Å; V2793-L2796 PolarHBondContact O-N 3.18Å; L2796-R2798 PolarHBondContact O-N 3.39Å; L2796-N2799 WeakPolarHBondContact O-CB 3.4Å; L2796-N2799 PolarHBondContact O-N 2.88Å; L2796-R2800 WeakPolarHBondContact O-CB 3.5Å; L2796-R2800 PolarHBondContact O-N 3.17Å; L2796-Q2917 HydrophobicContact CD1-CG 3.86Å; L2796-Q2917 VanDerWaalsContact CD1-NE2 3.33Å
2797	E	57.3	Low	61.8	Low	68.2 Å²	68.2	89.6 Å²	89.6	32%	0.319	46%	0.458	S	S	.	.	H	α-helix	trans	-67.4	-42.5	-178.8	-78.4	-72.7	106.5	0	0	112.9	V2793 N2799 R2800 L2801	V2793-E2797 HydrophobicContact CG1-CG 4.37Å; V2793-E2797 PolarHBondContact O-N 3.03Å; E2797-N2799 VanDerWaalsContact C-N 3.27Å; E2797-N2799 PolarHBondContact O-N 2.95Å; E2797-R2800 VanDerWaalsContact CD-NE 3.31Å; E2797-R2800 WeakPolarHBondContact O-CB 3.41Å; E2797-R2800 PolarHBondContact O-N 3.01Å; E2797-R2800 VanDerWaalsContact O-N 3.14Å; E2797-R2800 WeakPolarHBondContact OE1-CD 3.28Å; E2797-R2800 IonicContact OE1-CZ 3.13Å; E2797-R2800 IonicContact OE1-NE 3.22Å; E2797-R2800 PolarHBondContact OE1-NE 3.02Å; E2797-R2800 IonicContact OE1-NH2 2.87Å; E2797-R2800 IonicContact OE2-CZ 3.43Å; E2797-R2800 VanDerWaalsContact OE2-CZ 3.25Å; E2797-R2800 IonicContact OE2-NE 3.13Å; E2797-R2800 PolarHBondContact OE2-NE 2.9Å; E2797-R2800 VanDerWaalsContact OE2-NE 3.13Å; E2797-R2800 IonicContact OE2-NH2 3.65Å; E2797-R2800 PolarHBondContact OE2-NH2 2.96Å; E2797-L2801 WeakPolarHBondContact O-CB 3.21Å; E2797-L2801 WeakPolarHBondContact O-CG 3.38Å; E2797-L2801 PolarHBondContact O-N 3.09Å
2798	R	59.9	Low	62.8	Low	164.2 Å²	164.2	88.5 Å²	88.5	62%	0.62	45%	0.447	S	S	*	.	H	α-helix	trans	-60.6	-37.2	175	-153.9	-175.7	169	103.3	2.7	111.8	A2794 L2796 T2802	A2794-R2798 WeakPolarHBondContact O-CB 3.32Å; A2794-R2798 PolarHBondContact O-N 3.16Å; A2794-R2798 VanDerWaalsContact O-N 3.16Å; L2796-R2798 PolarHBondContact O-N 3.39Å; R2798-T2802 VanDerWaalsContact O-CB 3.27Å; R2798-T2802 WeakPolarHBondContact O-CB 3.32Å; R2798-T2802 PolarHBondContact O-N 3.11Å; R2798-T2802 VanDerWaalsContact O-N 3.14Å; R2798-T2802 PolarHBondContact O-OG1 3.26Å
2799	N	66.8	Low	63.9	Low	34.6 Å²	34.6	87.2 Å²	87.2	19%	0.185	45%	0.449	C	S	.	.	H	α-helix	trans	-67.5	-43.8	174.4	-74	-4.9	0	0	0	111.6	K2795 L2796 E2797 L2801 T2802 F2803 Q2917	K2795-N2799 VanDerWaalsContact O-CB 3.24Å; K2795-N2799 WeakPolarHBondContact O-CB 3.39Å; K2795-N2799 PolarHBondContact O-N 3.15Å; K2795-N2799 VanDerWaalsContact O-N 3.12Å; K2795-N2799 PolarHBondContact O-ND2 3.1Å; K2795-N2799 PolarHBondContact O-OD1 2.92Å; L2796-N2799 WeakPolarHBondContact O-CB 3.4Å; L2796-N2799 PolarHBondContact O-N 2.88Å; E2797-N2799 VanDerWaalsContact C-N 3.27Å; E2797-N2799 PolarHBondContact O-N 2.95Å; N2799-L2801 PolarHBondContact O-N 3Å; N2799-T2802 WeakPolarHBondContact O-CB 3.38Å; N2799-T2802 PolarHBondContact O-N 3Å; N2799-T2802 VanDerWaalsContact O-N 3.12Å; N2799-F2803 HydrophobicContact CB-CD2 4.44Å; N2799-F2803 HydrophobicContact CB-CE2 3.79Å; N2799-F2803 HydrophobicContact CB-CZ 3.92Å; N2799-F2803 WeakPolarHBondContact O-CD1 3.25Å; N2799-F2803 VanDerWaalsContact O-CD2 3.26Å; N2799-F2803 WeakPolarHBondContact O-CD2 3.33Å; N2799-F2803 VanDerWaalsContact O-CG 3.24Å; N2799-F2803 WeakPolarHBondContact O-CG 3.16Å; N2799-F2803 PolarHBondContact O-N 2.97Å; N2799-Q2917 VanDerWaalsContact CB-OE1 3.3Å; N2799-Q2917 PolarHBondContact ND2-OE1 3.18Å
2800	R	65.6	Low	65.5	Low	146.6 Å²	146.6	88.1 Å²	88.1	55%	0.553	45%	0.446	S	S	*	.	H	α-helix	trans	-61.5	-45.9	-179.1	-165.9	177.5	73.8	110.4	-0.9	112.2	L2796 E2797 T2802 F2803 G2804	L2796-R2800 WeakPolarHBondContact O-CB 3.5Å; L2796-R2800 PolarHBondContact O-N 3.17Å; E2797-R2800 VanDerWaalsContact CD-NE 3.31Å; E2797-R2800 WeakPolarHBondContact O-CB 3.41Å; E2797-R2800 PolarHBondContact O-N 3.01Å; E2797-R2800 VanDerWaalsContact O-N 3.14Å; E2797-R2800 WeakPolarHBondContact OE1-CD 3.28Å; E2797-R2800 IonicContact OE1-CZ 3.13Å; E2797-R2800 IonicContact OE1-NE 3.22Å; E2797-R2800 PolarHBondContact OE1-NE 3.02Å; E2797-R2800 IonicContact OE1-NH2 2.87Å; E2797-R2800 IonicContact OE2-CZ 3.43Å; E2797-R2800 VanDerWaalsContact OE2-CZ 3.25Å; E2797-R2800 IonicContact OE2-NE 3.13Å; E2797-R2800 PolarHBondContact OE2-NE 2.9Å; E2797-R2800 VanDerWaalsContact OE2-NE 3.13Å; E2797-R2800 IonicContact OE2-NH2 3.65Å; E2797-R2800 PolarHBondContact OE2-NH2 2.96Å; R2800-T2802 VanDerWaalsContact C-N 3.35Å; R2800-T2802 PolarHBondContact O-N 2.94Å; R2800-F2803 PolarHBondContact O-N 3.15Å; R2800-G2804 PolarHBondContact O-N 3.16Å
2801	L	63.5	Low	67.1	Low	113 Å²	113	82.4 Å²	82.4	59%	0.592	42%	0.419	S	S	*	.	H	α-helix	trans	-62	-42.6	174.6	-68	173.2	0	0	0	112	E2797 N2799 F2803 G2804 L2805	E2797-L2801 WeakPolarHBondContact O-CB 3.21Å; E2797-L2801 WeakPolarHBondContact O-CG 3.38Å; E2797-L2801 PolarHBondContact O-N 3.09Å; N2799-L2801 PolarHBondContact O-N 3Å; L2801-F2803 VanDerWaalsContact C-N 3.28Å; L2801-F2803 PolarHBondContact O-N 3.04Å; L2801-G2804 PolarHBondContact O-N 2.99Å; L2801-L2805 WeakPolarHBondContact O-CG 3.32Å; L2801-L2805 PolarHBondContact O-N 3.09Å
2802	T	71.7	Confident	68.8	Low	71.5 Å²	71.5	79.6 Å²	79.6	44%	0.439	41%	0.409	S	S	.	.	H	α-helix	trans	-63	-41	177.9	-58.1	0	0	0	0	111.7	R2798 N2799 R2800 L2805 M2806	R2798-T2802 VanDerWaalsContact O-CB 3.27Å; R2798-T2802 WeakPolarHBondContact O-CB 3.32Å; R2798-T2802 PolarHBondContact O-N 3.11Å; R2798-T2802 VanDerWaalsContact O-N 3.14Å; R2798-T2802 PolarHBondContact O-OG1 3.26Å; N2799-T2802 WeakPolarHBondContact O-CB 3.38Å; N2799-T2802 PolarHBondContact O-N 3Å; N2799-T2802 VanDerWaalsContact O-N 3.12Å; R2800-T2802 VanDerWaalsContact C-N 3.35Å; R2800-T2802 PolarHBondContact O-N 2.94Å; T2802-L2805 PolarHBondContact O-N 2.97Å; T2802-M2806 WeakPolarHBondContact O-CG 3.47Å
2803	F	73.5	Confident	70.4	Confident	11 Å²	11	80.5 Å²	80.5	5%	0.048	42%	0.418	C	S	.	.	H	α-helix	trans	-71.9	-34.7	178.1	-56.3	-29.7	0	0	0	112.4	N2799 R2800 L2801 L2805 M2806 I2914 Q2917 R2918 H2921	N2799-F2803 HydrophobicContact CB-CD2 4.44Å; N2799-F2803 HydrophobicContact CB-CE2 3.79Å; N2799-F2803 HydrophobicContact CB-CZ 3.92Å; N2799-F2803 WeakPolarHBondContact O-CD1 3.25Å; N2799-F2803 VanDerWaalsContact O-CD2 3.26Å; N2799-F2803 WeakPolarHBondContact O-CD2 3.33Å; N2799-F2803 VanDerWaalsContact O-CG 3.24Å; N2799-F2803 WeakPolarHBondContact O-CG 3.16Å; N2799-F2803 PolarHBondContact O-N 2.97Å; R2800-F2803 PolarHBondContact O-N 3.15Å; L2801-F2803 VanDerWaalsContact C-N 3.28Å; L2801-F2803 PolarHBondContact O-N 3.04Å; F2803-L2805 PolarHBondContact O-N 2.94Å; F2803-L2805 VanDerWaalsContact O-N 3.13Å; F2803-M2806 HydrophobicContact CD1-SD 3.97Å; F2803-M2806 WeakPolarHBondContact O-CB 3.27Å; F2803-M2806 PolarHBondContact O-N 2.98Å; F2803-I2914 HydrophobicContact CZ-CG2 4.19Å; F2803-Q2917 HydrophobicContact CD2-CB 4.33Å; F2803-Q2917 HydrophobicContact CE2-CB 3.76Å; F2803-R2918 HydrophobicContact CD1-CG 4.26Å; F2803-R2918 HydrophobicContact CD2-CB 4.34Å; F2803-R2918 HydrophobicContact CD2-CG 4.42Å; F2803-R2918 HydrophobicContact CE1-CB 4.37Å; F2803-R2918 HydrophobicContact CE1-CG 4.33Å; F2803-R2918 HydrophobicContact CE2-CB 4.06Å; F2803-R2918 HydrophobicContact CE2-CG 4.4Å; F2803-R2918 HydrophobicContact CG-CG 4.4Å; F2803-R2918 HydrophobicContact CZ-CB 4.11Å; F2803-R2918 HydrophobicContact CZ-CG 4.24Å; F2803-H2921 VanDerWaalsContact C-CE1 3.49Å; F2803-H2921 HydrophobicContact CB-CB 4.33Å; F2803-H2921 HydrophobicContact CD2-CB 4.49Å; F2803-H2921 PolarHBondContact O-CE1 3.25Å; F2803-H2921 PolarHBondContact O-ND1 3.15Å
2804	G	69.2	Low	72.3	Confident	50.75 Å²	50.75	79.2 Å²	79.2	52%	0.523	41%	0.412	S	S	.	.	H	α-helix	trans	-61.8	-19.9	176	0	0	0	0	0	114.7	R2800 L2801 M2806	R2800-G2804 PolarHBondContact O-N 3.16Å; L2801-G2804 PolarHBondContact O-N 2.99Å; G2804-M2806 VanDerWaalsContact C-N 3.27Å; G2804-M2806 PolarHBondContact O-N 3.44Å
2805	L	74.1	Confident	74	Confident	153.25 Å²	153.25	76 Å²	76	80%	0.802	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-6.5	173.6	-63.4	174.2	0	0	0	113.7	L2801 T2802 F2803	L2801-L2805 WeakPolarHBondContact O-CG 3.32Å; L2801-L2805 PolarHBondContact O-N 3.09Å; T2802-L2805 PolarHBondContact O-N 2.97Å; F2803-L2805 PolarHBondContact O-N 2.94Å; F2803-L2805 VanDerWaalsContact O-N 3.13Å
2806	M	76.6	Confident	75.5	Confident	46.75 Å²	46.75	74.6 Å²	74.6	23%	0.23	39%	0.386	C	S	.	.	S	Bend	trans	-93.6	135.7	-176.4	-60.1	179.3	72.1	0	0	112.1	T2802 F2803 G2804 Q2810 V2811 A2814	T2802-M2806 WeakPolarHBondContact O-CG 3.47Å; F2803-M2806 HydrophobicContact CD1-SD 3.97Å; F2803-M2806 WeakPolarHBondContact O-CB 3.27Å; F2803-M2806 PolarHBondContact O-N 2.98Å; G2804-M2806 VanDerWaalsContact C-N 3.27Å; G2804-M2806 PolarHBondContact O-N 3.44Å; M2806-Q2810 HydrophobicContact CB-CB 4.32Å; M2806-Q2810 HydrophobicContact CE-CB 3.97Å; M2806-V2811 HydrophobicContact CB-CG2 3.52Å; M2806-V2811 VanDerWaalsContact CB-CG2 3.48Å; M2806-V2811 HydrophobicContact SD-CG2 4.46Å; M2806-A2814 HydrophobicContact CE-CB 3.81Å
2807	S	79.7	Confident	77	Confident	53 Å²	53	80 Å²	80	37%	0.371	40%	0.402	S	S	.	.			trans	-70	158.1	170.5	68.5	0	0	0	0	112.3	S2809 Q2810 V2811	S2807-S2809 VanDerWaalsContact C-N 3.25Å; S2807-S2809 PolarHBondContact O-N 3.04Å; S2807-S2809 VanDerWaalsContact O-N 3.14Å; S2807-S2809 PolarHBondContact OG-OG 3.04Å; S2807-S2809 VanDerWaalsContact OG-OG 3.05Å; S2807-Q2810 WeakPolarHBondContact O-CB 3.36Å; S2807-Q2810 PolarHBondContact O-N 2.74Å; S2807-Q2810 VanDerWaalsContact OG-CD 3.28Å; S2807-Q2810 WeakPolarHBondContact OG-CG 3.43Å; S2807-Q2810 PolarHBondContact OG-N 2.82Å; S2807-Q2810 PolarHBondContact OG-OE1 2.87Å; S2807-Q2810 VanDerWaalsContact OG-OE1 3.11Å; S2807-V2811 WeakPolarHBondContact O-CG2 3.28Å; S2807-V2811 PolarHBondContact O-N 3.14Å
2808	E	80.4	Confident	78.5	Confident	69.25 Å²	69.25	77.8 Å²	77.8	32%	0.324	39%	0.392	S	S	.	.	H	α-helix	trans	-51.3	-41.4	-179.5	-172.6	-166.9	163.5	0	0	113.2	V2811 R2812 Y2922 L2925 Q2926 I2929	E2808-V2811 PolarHBondContact O-N 3.09Å; E2808-R2812 VanDerWaalsContact CD-NH1 3.28Å; E2808-R2812 VanDerWaalsContact O-CB 3.31Å; E2808-R2812 WeakPolarHBondContact O-CB 3.36Å; E2808-R2812 WeakPolarHBondContact O-CG 3.49Å; E2808-R2812 PolarHBondContact O-N 3.26Å; E2808-R2812 IonicContact OE1-CZ 2.64Å; E2808-R2812 IonicContact OE1-NH1 2.68Å; E2808-R2812 PolarHBondContact OE1-NH1 3.11Å; E2808-R2812 IonicContact OE1-NH2 3.11Å; E2808-R2812 PolarHBondContact OE1-NH2 3.36Å; E2808-Y2922 HydrophobicContact CG-CD2 4.38Å; E2808-Y2922 HydrophobicContact CG-CE2 4.17Å; E2808-L2925 HydrophobicContact CB-CD2 3.68Å; E2808-L2925 HydrophobicContact CB-CG 4.47Å; E2808-L2925 HydrophobicContact CG-CD2 4.02Å; E2808-Q2926 PolarHBondContact OE1-NE2 3.2Å; E2808-I2929 HydrophobicContact CB-CD1 4.3Å; E2808-I2929 HydrophobicContact CG-CD1 4.23Å; E2808-I2929 VanDerWaalsContact OE2-CD1 3.25Å; E2808-I2929 WeakPolarHBondContact OE2-CD1 3.32Å
2809	S	81.4	Confident	79.9	Confident	75 Å²	75	71.3 Å²	71.3	52%	0.524	37%	0.369	S	S	.	.	H	α-helix	trans	-68.2	-41.9	178.3	56.2	0	0	0	0	112.2	S2807 R2812 L2813	S2807-S2809 VanDerWaalsContact C-N 3.25Å; S2807-S2809 PolarHBondContact O-N 3.04Å; S2807-S2809 VanDerWaalsContact O-N 3.14Å; S2807-S2809 PolarHBondContact OG-OG 3.04Å; S2807-S2809 VanDerWaalsContact OG-OG 3.05Å; S2809-R2812 PolarHBondContact O-N 3.11Å; S2809-L2813 WeakPolarHBondContact O-CB 3.36Å; S2809-L2813 VanDerWaalsContact O-CG 3.29Å; S2809-L2813 WeakPolarHBondContact O-CG 3.48Å; S2809-L2813 PolarHBondContact O-N 3.39Å
2810	Q	86	Confident	81.1	Confident	101.25 Å²	101.25	74.7 Å²	74.7	47%	0.473	38%	0.384	S	S	.	.	H	α-helix	trans	-63.9	-44.6	174.3	-70.1	166.4	-29.8	0	0	111.3	M2806 S2807 R2812 L2813 A2814	M2806-Q2810 HydrophobicContact CB-CB 4.32Å; M2806-Q2810 HydrophobicContact CE-CB 3.97Å; S2807-Q2810 WeakPolarHBondContact O-CB 3.36Å; S2807-Q2810 PolarHBondContact O-N 2.74Å; S2807-Q2810 VanDerWaalsContact OG-CD 3.28Å; S2807-Q2810 WeakPolarHBondContact OG-CG 3.43Å; S2807-Q2810 PolarHBondContact OG-N 2.82Å; S2807-Q2810 PolarHBondContact OG-OE1 2.87Å; S2807-Q2810 VanDerWaalsContact OG-OE1 3.11Å; Q2810-R2812 VanDerWaalsContact C-N 3.34Å; Q2810-R2812 PolarHBondContact O-N 3.09Å; Q2810-L2813 PolarHBondContact O-N 3.02Å; Q2810-A2814 VanDerWaalsContact O-CB 3.23Å; Q2810-A2814 WeakPolarHBondContact O-CB 3.31Å; Q2810-A2814 PolarHBondContact O-N 3.18Å
2811	V	84.5	Confident	82.3	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-58.5	-47	176.2	174.6	0	0	0	0	110.5	M2806 S2807 E2808 A2814 I2815 R2918 Y2922 L2925	M2806-V2811 HydrophobicContact CB-CG2 3.52Å; M2806-V2811 VanDerWaalsContact CB-CG2 3.48Å; M2806-V2811 HydrophobicContact SD-CG2 4.46Å; S2807-V2811 WeakPolarHBondContact O-CG2 3.28Å; S2807-V2811 PolarHBondContact O-N 3.14Å; E2808-V2811 PolarHBondContact O-N 3.09Å; V2811-A2814 PolarHBondContact O-N 3.16Å; V2811-I2815 HydrophobicContact CG1-CD1 3.87Å; V2811-I2815 HydrophobicContact CG1-CG1 4.44Å; V2811-I2815 VanDerWaalsContact O-CG1 3.3Å; V2811-I2815 WeakPolarHBondContact O-CG1 3.36Å; V2811-I2815 PolarHBondContact O-N 3.03Å; V2811-R2918 HydrophobicContact CG1-CG 4.04Å; V2811-Y2922 HydrophobicContact CG1-CD2 4.05Å; V2811-Y2922 HydrophobicContact CG1-CG 4.38Å; V2811-L2925 HydrophobicContact CG2-CD1 4.27Å
2812	R	86.2	Confident	83.6	Confident	123.25 Å²	123.25	64.3 Å²	64.3	47%	0.465	34%	0.341	S	S	.	.	H	α-helix	trans	-64.4	-45.4	179.1	-157.1	174.7	174	163.4	-0.6	113.1	L2268 E2808 S2809 Q2810 A2814 I2815 S2816 Y2922	L2268-R2812 HydrophobicContact CD1-CG 4.19Å; L2268-R2812 HydrophobicContact CD2-CG 4.24Å; E2808-R2812 VanDerWaalsContact CD-NH1 3.28Å; E2808-R2812 VanDerWaalsContact O-CB 3.31Å; E2808-R2812 WeakPolarHBondContact O-CB 3.36Å; E2808-R2812 WeakPolarHBondContact O-CG 3.49Å; E2808-R2812 PolarHBondContact O-N 3.26Å; E2808-R2812 IonicContact OE1-CZ 2.64Å; E2808-R2812 IonicContact OE1-NH1 2.68Å; E2808-R2812 PolarHBondContact OE1-NH1 3.11Å; E2808-R2812 IonicContact OE1-NH2 3.11Å; E2808-R2812 PolarHBondContact OE1-NH2 3.36Å; S2809-R2812 PolarHBondContact O-N 3.11Å; Q2810-R2812 VanDerWaalsContact C-N 3.34Å; Q2810-R2812 PolarHBondContact O-N 3.09Å; R2812-A2814 VanDerWaalsContact C-N 3.3Å; R2812-A2814 PolarHBondContact O-N 2.94Å; R2812-I2815 PolarHBondContact O-N 3.25Å; R2812-S2816 PolarHBondContact O-N 2.86Å; R2812-S2816 VanDerWaalsContact O-N 3.12Å; R2812-S2816 PolarHBondContact O-OG 3.16Å; R2812-Y2922 HydrophobicContact CB-CE2 4.1Å; R2812-Y2922 HydrophobicContact CG-CD2 4.24Å; R2812-Y2922 HydrophobicContact CG-CE2 4.18Å; R2812-Y2922 PolarHBondContact NE-OH 3.48Å; R2812-Y2922 PolarHBondContact NH2-OH 2.87Å
2813	L	87.9	Confident	84.6	Confident	127.75 Å²	127.75	65.3 Å²	65.3	67%	0.669	34%	0.337	S	S	*	.	H	α-helix	trans	-61.7	-41.6	175.8	-73.7	170.4	0	0	0	111.4	S2809 Q2810 S2816 R2817	S2809-L2813 WeakPolarHBondContact O-CB 3.36Å; S2809-L2813 VanDerWaalsContact O-CG 3.29Å; S2809-L2813 WeakPolarHBondContact O-CG 3.48Å; S2809-L2813 PolarHBondContact O-N 3.39Å; Q2810-L2813 PolarHBondContact O-N 3.02Å; L2813-S2816 WeakPolarHBondContact O-CB 3.42Å; L2813-S2816 PolarHBondContact O-N 2.9Å; L2813-R2817 WeakPolarHBondContact O-CB 3.46Å; L2813-R2817 PolarHBondContact O-N 3.06Å; L2813-R2817 VanDerWaalsContact O-N 3.07Å
2814	A	87	Confident	85.5	Confident	18.75 Å²	18.75	72.1 Å²	72.1	16%	0.155	36%	0.362	C	S	.	.	H	α-helix	trans	-68.1	-39.6	177.8	0	0	0	0	0	111.9	M2806 Q2810 V2811 R2812 S2816 R2817 D2818 R2918	M2806-A2814 HydrophobicContact CE-CB 3.81Å; Q2810-A2814 VanDerWaalsContact O-CB 3.23Å; Q2810-A2814 WeakPolarHBondContact O-CB 3.31Å; Q2810-A2814 PolarHBondContact O-N 3.18Å; V2811-A2814 PolarHBondContact O-N 3.16Å; R2812-A2814 VanDerWaalsContact C-N 3.3Å; R2812-A2814 PolarHBondContact O-N 2.94Å; A2814-S2816 VanDerWaalsContact C-N 3.31Å; A2814-S2816 PolarHBondContact O-N 3.01Å; A2814-R2817 PolarHBondContact O-N 3.07Å; A2814-D2818 PolarHBondContact O-N 3.16Å; A2814-D2818 VanDerWaalsContact O-OD1 3.08Å; A2814-R2918 VanDerWaalsContact CB-NH1 3.31Å; A2814-R2918 PolarHBondContact O-NH1 3.06Å
2815	I	87.4	Confident	86.6	Confident	3.75 Å²	3.75	70.1 Å²	70.1	2%	0.019	34%	0.339	C	S	.	.	H	α-helix	trans	-57.1	-45.5	171.8	-73.5	165.2	0	0	0	110.6	L2268 V2811 R2812 R2817 D2818 Q2819 L2915 R2918 L2919 Y2922	L2268-I2815 HydrophobicContact CD1-CG2 4.48Å; L2268-I2815 HydrophobicContact CD2-CB 4.34Å; L2268-I2815 HydrophobicContact CD2-CD1 3.93Å; L2268-I2815 HydrophobicContact CD2-CG2 3.86Å; L2268-I2815 HydrophobicContact CG-CG2 4.3Å; V2811-I2815 HydrophobicContact CG1-CD1 3.87Å; V2811-I2815 HydrophobicContact CG1-CG1 4.44Å; V2811-I2815 VanDerWaalsContact O-CG1 3.3Å; V2811-I2815 WeakPolarHBondContact O-CG1 3.36Å; V2811-I2815 PolarHBondContact O-N 3.03Å; R2812-I2815 PolarHBondContact O-N 3.25Å; I2815-R2817 VanDerWaalsContact C-N 3.35Å; I2815-R2817 PolarHBondContact O-N 2.9Å; I2815-D2818 PolarHBondContact O-N 3.1Å; I2815-Q2819 HydrophobicContact CG2-CG 4.44Å; I2815-Q2819 WeakPolarHBondContact O-CB 3.35Å; I2815-Q2819 VanDerWaalsContact O-CG 3.31Å; I2815-Q2819 WeakPolarHBondContact O-CG 3.35Å; I2815-Q2819 PolarHBondContact O-N 3.2Å; I2815-L2915 HydrophobicContact CB-CD1 4.48Å; I2815-L2915 HydrophobicContact CG1-CD1 4.49Å; I2815-L2915 HydrophobicContact CG2-CD1 4.09Å; I2815-R2918 HydrophobicContact CD1-CG 4.39Å; I2815-R2918 HydrophobicContact CG1-CB 4.34Å; I2815-R2918 HydrophobicContact CG1-CG 3.93Å; I2815-L2919 HydrophobicContact CD1-CD1 4.19Å; I2815-L2919 HydrophobicContact CG1-CD1 4.44Å; I2815-L2919 HydrophobicContact CG2-CD1 4.13Å; I2815-Y2922 HydrophobicContact CD1-CD1 4.43Å; I2815-Y2922 HydrophobicContact CD1-CD2 4.4Å; I2815-Y2922 HydrophobicContact CD1-CG 4.04Å
2816	S	87.5	Confident	87.4	Confident	58.25 Å²	58.25	64.2 Å²	64.2	41%	0.407	31%	0.308	S	S	.	.	H	α-helix	trans	-63.5	-39.6	178.1	-58.8	0	0	0	0	112.6	R2812 L2813 A2814 E2820	R2812-S2816 PolarHBondContact O-N 2.86Å; R2812-S2816 VanDerWaalsContact O-N 3.12Å; R2812-S2816 PolarHBondContact O-OG 3.16Å; L2813-S2816 WeakPolarHBondContact O-CB 3.42Å; L2813-S2816 PolarHBondContact O-N 2.9Å; A2814-S2816 VanDerWaalsContact C-N 3.31Å; A2814-S2816 PolarHBondContact O-N 3.01Å; S2816-E2820 WeakPolarHBondContact O-CB 3.37Å; S2816-E2820 PolarHBondContact O-N 3.19Å; S2816-E2820 VanDerWaalsContact O-N 3.13Å
2817	R	90	Very high	88.2	Confident	189.75 Å²	189.75	67.9 Å²	67.9	72%	0.716	32%	0.323	S	S	*	.	H	α-helix	trans	-64.8	-44.5	176.3	-176.6	-179.9	177.7	121.6	-1.6	112.5	L2813 A2814 I2815 E2820 T2821	L2813-R2817 WeakPolarHBondContact O-CB 3.46Å; L2813-R2817 PolarHBondContact O-N 3.06Å; L2813-R2817 VanDerWaalsContact O-N 3.07Å; A2814-R2817 PolarHBondContact O-N 3.07Å; I2815-R2817 VanDerWaalsContact C-N 3.35Å; I2815-R2817 PolarHBondContact O-N 2.9Å; R2817-E2820 PolarHBondContact O-N 3.17Å; R2817-T2821 WeakPolarHBondContact O-CB 3.31Å; R2817-T2821 PolarHBondContact O-N 2.88Å; R2817-T2821 PolarHBondContact O-OG1 2.91Å
2818	D	88.7	Confident	88.8	Confident	22.25 Å²	22.25	69.4 Å²	69.4	12%	0.119	32%	0.324	C	S	.	.	H	α-helix	trans	-69	-42.5	179.1	-74.2	39.4	0	0	0	110.8	A2814 I2815 E2820 T2821 L2822 L2911 I2914 L2915 R2918	A2814-D2818 PolarHBondContact O-N 3.16Å; A2814-D2818 VanDerWaalsContact O-OD1 3.08Å; I2815-D2818 PolarHBondContact O-N 3.1Å; D2818-E2820 VanDerWaalsContact C-N 3.31Å; D2818-E2820 PolarHBondContact O-N 3.08Å; D2818-T2821 PolarHBondContact O-N 3.1Å; D2818-L2822 VanDerWaalsContact O-CB 3.24Å; D2818-L2822 WeakPolarHBondContact O-CB 3.28Å; D2818-L2822 PolarHBondContact O-N 2.93Å; D2818-L2911 HydrophobicContact CB-CD2 4.25Å; D2818-L2911 WeakPolarHBondContact O-CD2 3.23Å; D2818-I2914 WeakPolarHBondContact OD2-CG2 3.19Å; D2818-L2915 HydrophobicContact CB-CB 4.48Å; D2818-L2915 HydrophobicContact CB-CD1 4.14Å; D2818-R2918 IonicContact OD1-CZ 3.2Å; D2818-R2918 IonicContact OD1-NH1 3.2Å; D2818-R2918 PolarHBondContact OD1-NH1 3.04Å; D2818-R2918 IonicContact OD1-NH2 3.45Å; D2818-R2918 IonicContact OD2-CZ 3.19Å; D2818-R2918 IonicContact OD2-NH1 3.56Å; D2818-R2918 PolarHBondContact OD2-NH1 3.25Å; D2818-R2918 IonicContact OD2-NH2 3.13Å; D2818-R2918 PolarHBondContact OD2-NH2 3.22Å
2819	Q	90.7	Very high	89.3	Confident	28 Å²	28	67.7 Å²	67.7	13%	0.131	32%	0.316	C	S	.	.	H	α-helix	trans	-55.1	-45.1	172.8	-80.4	-173	-5.6	0	0	112.2	N2262 L2263 I2815 L2822 R2823 L2915	N2262-Q2819 PolarHBondContact O-NE2 3.26Å; L2263-Q2819 HydrophobicContact CD2-CB 4.4Å; L2263-Q2819 HydrophobicContact CD2-CG 4.33Å; I2815-Q2819 HydrophobicContact CG2-CG 4.44Å; I2815-Q2819 WeakPolarHBondContact O-CB 3.35Å; I2815-Q2819 VanDerWaalsContact O-CG 3.31Å; I2815-Q2819 WeakPolarHBondContact O-CG 3.35Å; I2815-Q2819 PolarHBondContact O-N 3.2Å; Q2819-L2822 WeakPolarHBondContact O-CB 3.42Å; Q2819-L2822 PolarHBondContact O-N 3.24Å; Q2819-R2823 VanDerWaalsContact O-CG 3.29Å; Q2819-R2823 WeakPolarHBondContact O-CG 3.33Å; Q2819-R2823 PolarHBondContact O-N 3.17Å; Q2819-R2823 VanDerWaalsContact OE1-NH2 3.12Å; Q2819-L2915 HydrophobicContact CG-CD1 4.17Å; Q2819-L2915 HydrophobicContact CG-CD2 3.95Å
2820	E	90.7	Very high	89.7	Confident	105.5 Å²	105.5	71.4 Å²	71.4	49%	0.493	32%	0.319	S	S	.	.	H	α-helix	trans	-71.9	-37.4	-179	-164	55.1	-148.2	0	0	112.4	S2816 R2817 D2818 L2822 R2823 R2824	S2816-E2820 WeakPolarHBondContact O-CB 3.37Å; S2816-E2820 PolarHBondContact O-N 3.19Å; S2816-E2820 VanDerWaalsContact O-N 3.13Å; R2817-E2820 PolarHBondContact O-N 3.17Å; D2818-E2820 VanDerWaalsContact C-N 3.31Å; D2818-E2820 PolarHBondContact O-N 3.08Å; E2820-L2822 VanDerWaalsContact C-N 3.31Å; E2820-L2822 PolarHBondContact O-N 2.86Å; E2820-R2823 PolarHBondContact O-N 3.23Å; E2820-R2823 WeakPolarHBondContact OE2-CD 3.37Å; E2820-R2823 IonicContact OE2-CZ 3.45Å; E2820-R2823 IonicContact OE2-NE 2.7Å; E2820-R2823 IonicContact OE2-NH1 3.16Å; E2820-R2823 PolarHBondContact OE2-NH1 2.96Å; E2820-R2824 WeakPolarHBondContact O-CB 3.49Å; E2820-R2824 PolarHBondContact O-N 2.94Å; E2820-R2824 VanDerWaalsContact O-N 3.07Å
2821	T	92.1	Very high	90	Very high	34.75 Å²	34.75	70.4 Å²	70.4	21%	0.213	31%	0.314	C	S	.	.	H	α-helix	trans	-60	-43.5	171.8	-55.6	0	0	0	0	110.8	R2817 D2818 R2824 L2825 L2911	R2817-T2821 WeakPolarHBondContact O-CB 3.31Å; R2817-T2821 PolarHBondContact O-N 2.88Å; R2817-T2821 PolarHBondContact O-OG1 2.91Å; D2818-T2821 PolarHBondContact O-N 3.1Å; T2821-R2824 WeakPolarHBondContact O-CB 3.28Å; T2821-R2824 PolarHBondContact O-N 3.13Å; T2821-L2825 HydrophobicContact CG2-CD1 4.29Å; T2821-L2825 HydrophobicContact CG2-CG 4.45Å; T2821-L2825 VanDerWaalsContact O-CG 3.31Å; T2821-L2825 WeakPolarHBondContact O-CG 3.29Å; T2821-L2825 PolarHBondContact O-N 3.1Å; T2821-L2825 VanDerWaalsContact O-N 3.09Å; T2821-L2911 HydrophobicContact CG2-CD1 3.92Å
2822	L	91	Very high	90.2	Very high	5.75 Å²	5.75	72.2 Å²	72.2	3%	0.03	32%	0.323	C	S	.	.	H	α-helix	trans	-66.2	-40.8	178.3	-167	58.7	0	0	0	112.1	L2259 L2263 D2818 Q2819 E2820 R2824 L2825 I2826 I2908 L2911 N2912 L2915	L2259-L2822 HydrophobicContact CD1-CD1 4.23Å; L2259-L2822 HydrophobicContact CD1-CD2 3.59Å; L2259-L2822 HydrophobicContact CD1-CG 3.95Å; L2263-L2822 HydrophobicContact CD1-CD2 4.48Å; L2263-L2822 HydrophobicContact CD1-CG 4.46Å; L2263-L2822 HydrophobicContact CD2-CB 4.15Å; L2263-L2822 HydrophobicContact CD2-CD2 3.95Å; L2263-L2822 HydrophobicContact CD2-CG 4.17Å; L2263-L2822 HydrophobicContact CG-CD2 4.28Å; D2818-L2822 VanDerWaalsContact O-CB 3.24Å; D2818-L2822 WeakPolarHBondContact O-CB 3.28Å; D2818-L2822 PolarHBondContact O-N 2.93Å; Q2819-L2822 WeakPolarHBondContact O-CB 3.42Å; Q2819-L2822 PolarHBondContact O-N 3.24Å; E2820-L2822 VanDerWaalsContact C-N 3.31Å; E2820-L2822 PolarHBondContact O-N 2.86Å; L2822-R2824 VanDerWaalsContact C-N 3.33Å; L2822-R2824 PolarHBondContact O-N 2.92Å; L2822-L2825 PolarHBondContact O-N 3.05Å; L2822-I2826 HydrophobicContact CD1-CD1 4.3Å; L2822-I2826 HydrophobicContact CG-CD1 4.15Å; L2822-I2826 WeakPolarHBondContact O-CB 3.32Å; L2822-I2826 WeakPolarHBondContact O-CD1 3.33Å; L2822-I2826 VanDerWaalsContact O-CG1 3.26Å; L2822-I2826 WeakPolarHBondContact O-CG1 3.47Å; L2822-I2826 PolarHBondContact O-N 3.07Å; L2822-I2908 HydrophobicContact CD1-CB 4.37Å; L2822-I2908 HydrophobicContact CD1-CG1 4.41Å; L2822-I2908 HydrophobicContact CD1-CG2 3.96Å; L2822-L2911 HydrophobicContact CB-CD2 3.76Å; L2822-L2911 HydrophobicContact CD1-CB 4.21Å; L2822-L2911 HydrophobicContact CD1-CD2 3.96Å; L2822-L2911 HydrophobicContact CD2-CD2 4.34Å; L2822-L2911 HydrophobicContact CG-CD2 4.28Å; L2822-N2912 HydrophobicContact CD1-CB 4.38Å; L2822-N2912 HydrophobicContact CD2-CB 4.01Å; L2822-L2915 HydrophobicContact CD2-CD2 3.75Å
2823	R	92.1	Very high	90.3	Very high	94 Å²	94	69.4 Å²	69.4	36%	0.355	32%	0.315	S	S	.	.	H	α-helix	trans	-59.3	-43.1	172.1	-72.6	176.6	-163.5	113.8	10.4	111.8	L2263 Q2819 E2820 I2826 F2827	L2263-R2823 HydrophobicContact CD2-CG 4.04Å; L2263-R2823 PolarHBondContact O-NH2 3.22Å; L2263-R2823 VanDerWaalsContact O-NH2 3.14Å; Q2819-R2823 VanDerWaalsContact O-CG 3.29Å; Q2819-R2823 WeakPolarHBondContact O-CG 3.33Å; Q2819-R2823 PolarHBondContact O-N 3.17Å; Q2819-R2823 VanDerWaalsContact OE1-NH2 3.12Å; E2820-R2823 PolarHBondContact O-N 3.23Å; E2820-R2823 WeakPolarHBondContact OE2-CD 3.37Å; E2820-R2823 IonicContact OE2-CZ 3.45Å; E2820-R2823 IonicContact OE2-NE 2.7Å; E2820-R2823 IonicContact OE2-NH1 3.16Å; E2820-R2823 PolarHBondContact OE2-NH1 2.96Å; R2823-I2826 PolarHBondContact O-N 2.97Å; R2823-F2827 WeakPolarHBondContact O-CB 3.42Å; R2823-F2827 PolarHBondContact O-N 3.19Å
2824	R	93	Very high	90.4	Very high	153.5 Å²	153.5	69.9 Å²	69.9	58%	0.579	31%	0.308	S	S	*	.	H	α-helix	trans	-62.8	-46.8	177.1	-170.7	-177.8	69.6	-154.3	-0.1	112	E2820 T2821 L2822 I2826 F2827 E2828	E2820-R2824 WeakPolarHBondContact O-CB 3.49Å; E2820-R2824 PolarHBondContact O-N 2.94Å; E2820-R2824 VanDerWaalsContact O-N 3.07Å; T2821-R2824 WeakPolarHBondContact O-CB 3.28Å; T2821-R2824 PolarHBondContact O-N 3.13Å; L2822-R2824 VanDerWaalsContact C-N 3.33Å; L2822-R2824 PolarHBondContact O-N 2.92Å; R2824-I2826 VanDerWaalsContact C-N 3.34Å; R2824-I2826 PolarHBondContact O-N 3.14Å; R2824-F2827 WeakPolarHBondContact O-CB 3.36Å; R2824-F2827 PolarHBondContact O-N 3.12Å; R2824-F2827 VanDerWaalsContact O-N 3.13Å; R2824-E2828 WeakPolarHBondContact O-CB 3.28Å; R2824-E2828 PolarHBondContact O-N 3.28Å
2825	L	92.2	Very high	90.5	Very high	7.75 Å²	7.75	75.5 Å²	75.5	4%	0.041	33%	0.327	C	S	.	.	H	α-helix	trans	-63.4	-39.8	178.3	-65.8	169.1	0	0	0	112	T2821 L2822 F2827 E2828 Q2829 L2904 I2908 L2911	T2821-L2825 HydrophobicContact CG2-CD1 4.29Å; T2821-L2825 HydrophobicContact CG2-CG 4.45Å; T2821-L2825 VanDerWaalsContact O-CG 3.31Å; T2821-L2825 WeakPolarHBondContact O-CG 3.29Å; T2821-L2825 PolarHBondContact O-N 3.1Å; T2821-L2825 VanDerWaalsContact O-N 3.09Å; L2822-L2825 PolarHBondContact O-N 3.05Å; L2825-F2827 VanDerWaalsContact C-N 3.34Å; L2825-F2827 PolarHBondContact O-N 2.93Å; L2825-E2828 PolarHBondContact O-N 3Å; L2825-Q2829 WeakPolarHBondContact O-CB 3.43Å; L2825-Q2829 PolarHBondContact O-N 3.06Å; L2825-L2904 HydrophobicContact CB-CD1 4.14Å; L2825-L2904 HydrophobicContact CD2-CD1 3.7Å; L2825-L2904 HydrophobicContact CD2-CG 4.24Å; L2825-L2904 HydrophobicContact CG-CD1 4.27Å; L2825-L2904 VanDerWaalsContact O-CD2 3.26Å; L2825-L2904 WeakPolarHBondContact O-CD2 3.33Å; L2825-I2908 HydrophobicContact CB-CD1 4.08Å; L2825-I2908 HydrophobicContact CB-CG1 3.69Å; L2825-I2908 HydrophobicContact CD1-CG1 4.39Å; L2825-L2911 HydrophobicContact CD1-CD1 3.75Å
2826	I	90.9	Very high	90.4	Very high	29 Å²	29	76.3 Å²	76.3	15%	0.149	33%	0.331	C	S	.	.	H	α-helix	trans	-66.8	-36.5	175.3	-67.4	163	0	0	0	111.6	L2259 L2263 L2822 R2823 R2824 R2830 I2908	L2259-I2826 HydrophobicContact CD1-CD1 4.09Å; L2259-I2826 HydrophobicContact CD2-CD1 3.97Å; L2259-I2826 HydrophobicContact CD2-CG1 4.48Å; L2259-I2826 HydrophobicContact CG-CD1 4.28Å; L2263-I2826 HydrophobicContact CD1-CD1 3.49Å; L2263-I2826 VanDerWaalsContact CD1-CD1 3.49Å; L2822-I2826 HydrophobicContact CD1-CD1 4.3Å; L2822-I2826 HydrophobicContact CG-CD1 4.15Å; L2822-I2826 WeakPolarHBondContact O-CB 3.32Å; L2822-I2826 WeakPolarHBondContact O-CD1 3.33Å; L2822-I2826 VanDerWaalsContact O-CG1 3.26Å; L2822-I2826 WeakPolarHBondContact O-CG1 3.47Å; L2822-I2826 PolarHBondContact O-N 3.07Å; R2823-I2826 PolarHBondContact O-N 2.97Å; R2824-I2826 VanDerWaalsContact C-N 3.34Å; R2824-I2826 PolarHBondContact O-N 3.14Å; I2826-R2830 WeakPolarHBondContact O-CB 3.3Å; I2826-R2830 VanDerWaalsContact O-CG 3.29Å; I2826-R2830 WeakPolarHBondContact O-CG 3.28Å; I2826-R2830 PolarHBondContact O-N 3.13Å; I2826-R2830 VanDerWaalsContact O-N 3.1Å; I2826-I2908 HydrophobicContact CG1-CD1 4.12Å; I2826-I2908 HydrophobicContact CG1-CG1 4.48Å; I2826-I2908 HydrophobicContact CG1-CG2 4.37Å
2827	F	92.1	Very high	90.2	Very high	125.25 Å²	125.25	80.2 Å²	80.2	55%	0.549	34%	0.337	S	S	.	.	H	α-helix	trans	-64	-46.7	172.9	175.5	-94.5	0	0	0	111	R2823 R2824 L2825 Q2829 R2830 Q2831	R2823-F2827 WeakPolarHBondContact O-CB 3.42Å; R2823-F2827 PolarHBondContact O-N 3.19Å; R2824-F2827 WeakPolarHBondContact O-CB 3.36Å; R2824-F2827 PolarHBondContact O-N 3.12Å; R2824-F2827 VanDerWaalsContact O-N 3.13Å; L2825-F2827 VanDerWaalsContact C-N 3.34Å; L2825-F2827 PolarHBondContact O-N 2.93Å; F2827-Q2829 PolarHBondContact O-N 3.5Å; F2827-R2830 CarbonylContact O-C 3.54Å; F2827-R2830 WeakPolarHBondContact O-CA 3.5Å; F2827-R2830 WeakPolarHBondContact O-CB 3.49Å; F2827-R2830 PolarHBondContact O-N 3.18Å; F2827-R2830 VanDerWaalsContact O-N 3.07Å; F2827-Q2831 HydrophobicContact CD1-CG 4.11Å; F2827-Q2831 HydrophobicContact CE1-CG 3.79Å; F2827-Q2831 HydrophobicContact CE2-CG 4.16Å; F2827-Q2831 HydrophobicContact CG-CG 4.46Å; F2827-Q2831 HydrophobicContact CZ-CG 4.08Å; F2827-Q2831 WeakPolarHBondContact O-CG 3.39Å; F2827-Q2831 PolarHBondContact O-N 3.19Å
2828	E	92.2	Very high	90	Very high	85.5 Å²	85.5	73.7 Å²	73.7	40%	0.4	32%	0.321	S	S	.	.	H	α-helix	trans	-59.8	-44.8	177	-174.9	176.1	-174	0	0	112.1	R2824 L2825 R2830 Q2831 L2832 L2904	R2824-E2828 WeakPolarHBondContact O-CB 3.28Å; R2824-E2828 PolarHBondContact O-N 3.28Å; L2825-E2828 PolarHBondContact O-N 3Å; E2828-R2830 VanDerWaalsContact C-N 3.31Å; E2828-R2830 PolarHBondContact O-N 3.03Å; E2828-Q2831 CarbonylContact O-C 3.49Å; E2828-Q2831 WeakPolarHBondContact O-CA 3.32Å; E2828-Q2831 WeakPolarHBondContact O-CB 3.36Å; E2828-Q2831 PolarHBondContact O-N 3.22Å; E2828-L2832 HydrophobicContact CG-CD1 4.47Å; E2828-L2832 PolarHBondContact O-N 3.16Å; E2828-L2904 HydrophobicContact CB-CD2 3.96Å; E2828-L2904 HydrophobicContact CG-CD1 4.42Å; E2828-L2904 HydrophobicContact CG-CD2 3.78Å
2829	Q	91.1	Very high	89.7	Confident	33.25 Å²	33.25	75.2 Å²	75.2	16%	0.155	33%	0.325	C	S	.	.	H	α-helix	trans	-55	-48.9	172.8	-173.3	-160.5	-35.3	0	0	110.8	L2825 F2827 Q2831 L2832 E2833 I2901 L2904 K2905 I2908	L2825-Q2829 WeakPolarHBondContact O-CB 3.43Å; L2825-Q2829 PolarHBondContact O-N 3.06Å; F2827-Q2829 PolarHBondContact O-N 3.5Å; Q2829-Q2831 VanDerWaalsContact C-N 3.27Å; Q2829-Q2831 PolarHBondContact O-N 3.12Å; Q2829-L2832 PolarHBondContact O-N 3.19Å; Q2829-E2833 HydrophobicContact CG-CG 4.38Å; Q2829-E2833 VanDerWaalsContact NE2-CD 3.3Å; Q2829-E2833 PolarHBondContact NE2-OE1 3.09Å; Q2829-E2833 PolarHBondContact NE2-OE2 3.42Å; Q2829-E2833 WeakPolarHBondContact O-CB 3.42Å; Q2829-E2833 VanDerWaalsContact O-CG 3.27Å; Q2829-E2833 WeakPolarHBondContact O-CG 3.33Å; Q2829-E2833 PolarHBondContact O-N 3.16Å; Q2829-I2901 HydrophobicContact CG-CG2 4.46Å; Q2829-L2904 HydrophobicContact CB-CD2 3.87Å; Q2829-L2904 HydrophobicContact CB-CG 4.29Å; Q2829-L2904 VanDerWaalsContact N-CD2 3.3Å; Q2829-K2905 HydrophobicContact CG-CG 4.41Å; Q2829-K2905 VanDerWaalsContact NE2-CE 3.3Å; Q2829-I2908 HydrophobicContact CB-CD1 4.18Å; Q2829-I2908 VanDerWaalsContact OE1-CD1 3.27Å
2830	R	90	Very high	89.3	Confident	152.25 Å²	152.25	75.7 Å²	75.7	58%	0.575	33%	0.33	S	S	*	.	H	α-helix	trans	-68.7	-16.8	178	-69.8	173.7	-178.8	-174.3	1.8	113.7	I2826 F2827 E2828 R2834	I2826-R2830 WeakPolarHBondContact O-CB 3.3Å; I2826-R2830 VanDerWaalsContact O-CG 3.29Å; I2826-R2830 WeakPolarHBondContact O-CG 3.28Å; I2826-R2830 PolarHBondContact O-N 3.13Å; I2826-R2830 VanDerWaalsContact O-N 3.1Å; F2827-R2830 CarbonylContact O-C 3.54Å; F2827-R2830 WeakPolarHBondContact O-CA 3.5Å; F2827-R2830 WeakPolarHBondContact O-CB 3.49Å; F2827-R2830 PolarHBondContact O-N 3.18Å; F2827-R2830 VanDerWaalsContact O-N 3.07Å; E2828-R2830 VanDerWaalsContact C-N 3.31Å; E2828-R2830 PolarHBondContact O-N 3.03Å; R2830-R2834 WeakPolarHBondContact O-CB 3.29Å; R2830-R2834 WeakPolarHBondContact O-CG 3.41Å; R2830-R2834 PolarHBondContact O-NE 3.16Å; R2830-R2834 PolarHBondContact O-NH2 3.39Å; R2830-R2834 VanDerWaalsContact O-NH2 3.1Å
2831	Q	92	Very high	88.8	Confident	80 Å²	80	77.3 Å²	77.3	37%	0.374	33%	0.331	S	S	.	.	H	α-helix	trans	-81.9	-46.1	170.5	-66.6	-63.9	27.2	0	0	110.4	F2827 E2828 Q2829 E2833 R2834 Y2835	F2827-Q2831 HydrophobicContact CD1-CG 4.11Å; F2827-Q2831 HydrophobicContact CE1-CG 3.79Å; F2827-Q2831 HydrophobicContact CE2-CG 4.16Å; F2827-Q2831 HydrophobicContact CG-CG 4.46Å; F2827-Q2831 HydrophobicContact CZ-CG 4.08Å; F2827-Q2831 WeakPolarHBondContact O-CG 3.39Å; F2827-Q2831 PolarHBondContact O-N 3.19Å; E2828-Q2831 CarbonylContact O-C 3.49Å; E2828-Q2831 WeakPolarHBondContact O-CA 3.32Å; E2828-Q2831 WeakPolarHBondContact O-CB 3.36Å; E2828-Q2831 PolarHBondContact O-N 3.22Å; Q2829-Q2831 VanDerWaalsContact C-N 3.27Å; Q2829-Q2831 PolarHBondContact O-N 3.12Å; Q2831-E2833 PolarHBondContact O-N 3.35Å; Q2831-R2834 CarbonylContact O-C 3.53Å; Q2831-R2834 PolarHBondContact O-N 3.19Å; Q2831-R2834 VanDerWaalsContact OE1-NH2 3.1Å; Q2831-Y2835 WeakPolarHBondContact O-CB 3.38Å; Q2831-Y2835 PolarHBondContact O-N 2.99Å
2832	L	89.1	Confident	88.3	Confident	37 Å²	37	80.7 Å²	80.7	19%	0.194	35%	0.345	C	S	.	.	H	α-helix	trans	-62.5	-42	176.5	-67.7	174.4	0	0	0	112.3	E2828 Q2829 R2834 Y2835 L2836 L2897 Q2900 I2901 L2904	E2828-L2832 HydrophobicContact CG-CD1 4.47Å; E2828-L2832 PolarHBondContact O-N 3.16Å; Q2829-L2832 PolarHBondContact O-N 3.19Å; L2832-R2834 VanDerWaalsContact C-N 3.31Å; L2832-R2834 PolarHBondContact O-N 3.08Å; L2832-Y2835 PolarHBondContact O-N 3.04Å; L2832-L2836 WeakPolarHBondContact O-CB 3.37Å; L2832-L2836 PolarHBondContact O-N 2.97Å; L2832-L2897 HydrophobicContact CB-CD1 4.1Å; L2832-L2897 HydrophobicContact CD2-CD1 3.81Å; L2832-L2897 HydrophobicContact CD2-CD2 4.41Å; L2832-L2897 HydrophobicContact CG-CD1 4.44Å; L2832-Q2900 HydrophobicContact CD1-CB 4.26Å; L2832-I2901 HydrophobicContact CB-CD1 4.14Å; L2832-I2901 HydrophobicContact CB-CG1 3.65Å; L2832-I2901 HydrophobicContact CD1-CG1 4.4Å; L2832-L2904 HydrophobicContact CD1-CD2 4.05Å
2833	E	88.6	Confident	87.5	Confident	64.75 Å²	64.75	81.2 Å²	81.2	30%	0.303	35%	0.348	S	S	.	.	H	α-helix	trans	-62.6	-37.4	175.5	-73.7	171.7	161	0	0	112.1	Q2829 Q2831 W2837 I2901 K2905	Q2829-E2833 HydrophobicContact CG-CG 4.38Å; Q2829-E2833 VanDerWaalsContact NE2-CD 3.3Å; Q2829-E2833 PolarHBondContact NE2-OE1 3.09Å; Q2829-E2833 PolarHBondContact NE2-OE2 3.42Å; Q2829-E2833 WeakPolarHBondContact O-CB 3.42Å; Q2829-E2833 VanDerWaalsContact O-CG 3.27Å; Q2829-E2833 WeakPolarHBondContact O-CG 3.33Å; Q2829-E2833 PolarHBondContact O-N 3.16Å; Q2831-E2833 PolarHBondContact O-N 3.35Å; E2833-W2837 WeakPolarHBondContact O-CB 3.4Å; E2833-W2837 PolarHBondContact O-N 3.1Å; E2833-W2837 VanDerWaalsContact O-N 3.12Å; E2833-I2901 HydrophobicContact CG-CD1 3.94Å; E2833-I2901 HydrophobicContact CG-CG1 4.31Å; E2833-I2901 HydrophobicContact CG-CG2 4.13Å; E2833-K2905 WeakPolarHBondContact OE1-CE 3.45Å; E2833-K2905 IonicContact OE1-NZ 3.53Å; E2833-K2905 PolarHBondContact OE1-NZ 3.12Å
2834	R	89.3	Confident	86.6	Confident	138.25 Å²	138.25	79.9 Å²	79.9	52%	0.522	35%	0.347	S	S	.	.	H	α-helix	trans	-72.3	-37.3	173.5	-84.5	-179.8	-73.2	169.1	1.7	112.6	R2830 Q2831 L2832 W2837 S2838	R2830-R2834 WeakPolarHBondContact O-CB 3.29Å; R2830-R2834 WeakPolarHBondContact O-CG 3.41Å; R2830-R2834 PolarHBondContact O-NE 3.16Å; R2830-R2834 PolarHBondContact O-NH2 3.39Å; R2830-R2834 VanDerWaalsContact O-NH2 3.1Å; Q2831-R2834 CarbonylContact O-C 3.53Å; Q2831-R2834 PolarHBondContact O-N 3.19Å; Q2831-R2834 VanDerWaalsContact OE1-NH2 3.1Å; L2832-R2834 VanDerWaalsContact C-N 3.31Å; L2832-R2834 PolarHBondContact O-N 3.08Å; R2834-W2837 PolarHBondContact O-N 3.05Å; R2834-S2838 WeakPolarHBondContact O-CB 3.46Å; R2834-S2838 PolarHBondContact O-N 3.04Å; R2834-S2838 PolarHBondContact O-OG 3Å; R2834-S2838 VanDerWaalsContact O-OG 3.09Å
2835	Y	89.6	Confident	85.8	Confident	136.5 Å²	136.5	78.7 Å²	78.7	54%	0.535	35%	0.348	S	S	.	.	H	α-helix	trans	-65.4	-45	176.7	-176.7	-105.8	0	0	0	111.3	Q2831 L2832 W2837 S2838 Y2839 L2897	Q2831-Y2835 WeakPolarHBondContact O-CB 3.38Å; Q2831-Y2835 PolarHBondContact O-N 2.99Å; L2832-Y2835 PolarHBondContact O-N 3.04Å; Y2835-W2837 VanDerWaalsContact C-N 3.34Å; Y2835-W2837 PolarHBondContact O-N 2.94Å; Y2835-S2838 WeakPolarHBondContact CA-OG 3.39Å; Y2835-S2838 PolarHBondContact O-N 3.28Å; Y2835-S2838 PolarHBondContact O-OG 3.12Å; Y2835-Y2839 VanDerWaalsContact O-CB 3.26Å; Y2835-Y2839 WeakPolarHBondContact O-CB 3.34Å; Y2835-Y2839 PolarHBondContact O-N 3.05Å; Y2835-L2897 HydrophobicContact CD1-CD1 3.81Å; Y2835-L2897 HydrophobicContact CD1-CD2 3.63Å; Y2835-L2897 VanDerWaalsContact CD1-CD2 3.5Å; Y2835-L2897 HydrophobicContact CD1-CG 4.32Å; Y2835-L2897 HydrophobicContact CE1-CD1 3.85Å; Y2835-L2897 HydrophobicContact CE1-CD2 3.99Å; Y2835-L2897 HydrophobicContact CE1-CG 4.47Å; Y2835-L2897 HydrophobicContact CG-CD2 4.44Å
2836	L	86.3	Confident	84.7	Confident	20.75 Å²	20.75	84 Å²	84	11%	0.109	37%	0.372	C	S	.	.	H	α-helix	trans	-56.4	-47.7	172	176.4	60.9	0	0	0	111.3	L2025 L2832 S2838 Y2839 V2840 A2894 L2897 E2898 I2901	L2025-L2836 HydrophobicContact CD1-CB 4.37Å; L2025-L2836 HydrophobicContact CD1-CD2 4Å; L2025-L2836 HydrophobicContact CD1-CG 3.72Å; L2832-L2836 WeakPolarHBondContact O-CB 3.37Å; L2832-L2836 PolarHBondContact O-N 2.97Å; L2836-S2838 PolarHBondContact O-N 3.06Å; L2836-Y2839 PolarHBondContact O-N 2.92Å; L2836-V2840 HydrophobicContact CD1-CG2 3.97Å; L2836-V2840 WeakPolarHBondContact O-CB 3.49Å; L2836-V2840 WeakPolarHBondContact O-CG2 3.35Å; L2836-V2840 PolarHBondContact O-N 3.07Å; L2836-A2894 HydrophobicContact CD1-CB 3.89Å; L2836-L2897 VanDerWaalsContact CA-CD2 3.47Å; L2836-L2897 HydrophobicContact CB-CB 4.31Å; L2836-L2897 HydrophobicContact CB-CD1 4.12Å; L2836-L2897 HydrophobicContact CB-CD2 3.52Å; L2836-L2897 HydrophobicContact CB-CG 4.03Å; L2836-L2897 HydrophobicContact CD1-CB 4.15Å; L2836-L2897 HydrophobicContact CD1-CD1 4.06Å; L2836-L2897 HydrophobicContact CD1-CD2 3.84Å; L2836-L2897 HydrophobicContact CD1-CG 4.17Å; L2836-L2897 HydrophobicContact CG-CD2 4.24Å; L2836-E2898 HydrophobicContact CD2-CG 3.86Å; L2836-I2901 HydrophobicContact CB-CD1 4.33Å; L2836-I2901 HydrophobicContact CD2-CD1 3.87Å
2837	W	83.4	Confident	83.5	Confident	139.5 Å²	139.5	84.5 Å²	84.5	53%	0.528	38%	0.375	S	S	.	.	H	α-helix	trans	-62	-43.8	177.4	-174.1	86.6	0	0	0	112.8	L2025 E2833 R2834 Y2835 Y2839 R2841 L3487	L2025-W2837 HydrophobicContact CD1-CB 4.02Å; E2833-W2837 WeakPolarHBondContact O-CB 3.4Å; E2833-W2837 PolarHBondContact O-N 3.1Å; E2833-W2837 VanDerWaalsContact O-N 3.12Å; R2834-W2837 PolarHBondContact O-N 3.05Å; Y2835-W2837 VanDerWaalsContact C-N 3.34Å; Y2835-W2837 PolarHBondContact O-N 2.94Å; W2837-Y2839 VanDerWaalsContact C-N 3.33Å; W2837-Y2839 PolarHBondContact O-N 3.22Å; W2837-R2841 VanDerWaalsContact CH2-CD 3.5Å; W2837-R2841 VanDerWaalsContact O-CB 3.25Å; W2837-R2841 WeakPolarHBondContact O-CB 3.35Å; W2837-R2841 PolarHBondContact O-N 3.05Å; W2837-L3487 HydrophobicContact CZ2-CB 4.36Å; W2837-L3487 PolarHBondContact NE1-O 3.43Å
2838	S	85.5	Confident	82	Confident	54.5 Å²	54.5	81.4 Å²	81.4	38%	0.381	38%	0.378	S	S	.	.	H	α-helix	trans	-65.3	-37.8	176.1	55.4	0	0	0	0	112.6	R2834 Y2835 L2836 Q2842	R2834-S2838 WeakPolarHBondContact O-CB 3.46Å; R2834-S2838 PolarHBondContact O-N 3.04Å; R2834-S2838 PolarHBondContact O-OG 3Å; R2834-S2838 VanDerWaalsContact O-OG 3.09Å; Y2835-S2838 WeakPolarHBondContact CA-OG 3.39Å; Y2835-S2838 PolarHBondContact O-N 3.28Å; Y2835-S2838 PolarHBondContact O-OG 3.12Å; L2836-S2838 PolarHBondContact O-N 3.06Å; S2838-Q2842 VanDerWaalsContact O-CB 3.29Å; S2838-Q2842 WeakPolarHBondContact O-CB 3.27Å; S2838-Q2842 PolarHBondContact O-N 3.17Å
2839	Y	82.6	Confident	80.4	Confident	52.75 Å²	52.75	82.1 Å²	82.1	21%	0.207	39%	0.385	C	S	.	.	H	α-helix	trans	-66.8	-50.9	179	-178.4	-102.1	0	0	0	111.5	Y2835 L2836 W2837 R2841 Q2842 T2843 C2890 S2893	Y2835-Y2839 VanDerWaalsContact O-CB 3.26Å; Y2835-Y2839 WeakPolarHBondContact O-CB 3.34Å; Y2835-Y2839 PolarHBondContact O-N 3.05Å; L2836-Y2839 PolarHBondContact O-N 2.92Å; W2837-Y2839 VanDerWaalsContact C-N 3.33Å; W2837-Y2839 PolarHBondContact O-N 3.22Å; Y2839-R2841 VanDerWaalsContact C-N 3.31Å; Y2839-R2841 PolarHBondContact O-N 3.15Å; Y2839-Q2842 PolarHBondContact O-N 2.84Å; Y2839-T2843 HydrophobicContact CE1-CG2 4.33Å; Y2839-T2843 HydrophobicContact CE2-CG2 4.39Å; Y2839-T2843 PolarHBondContact O-N 3.05Å; Y2839-T2843 PolarHBondContact O-OG1 2.85Å; Y2839-C2890 HydrophobicContact CE1-CB 4.37Å; Y2839-C2890 WeakPolarHBondContact CE1-SG 3.32Å; Y2839-C2890 WeakPolarHBondContact OH-CA 3.42Å; Y2839-S2893 VanDerWaalsContact CE1-CB 3.46Å; Y2839-S2893 VanDerWaalsContact OH-CB 3.29Å; Y2839-S2893 WeakPolarHBondContact OH-CB 3.2Å; Y2839-S2893 PolarHBondContact OH-OG 3.02Å
2840	V	81.9	Confident	78.3	Confident	39.75 Å²	39.75	85.1 Å²	85.1	24%	0.241	40%	0.402	C	S	.	.	H	α-helix	trans	-60.3	-42.4	176.3	171.3	0	0	0	0	111.1	L2025 M2028 L2029 L2836 Q2842 T2843 M2844 A2894	L2025-V2840 HydrophobicContact CB-CB 4.19Å; L2025-V2840 HydrophobicContact CB-CG1 4.1Å; L2025-V2840 HydrophobicContact CB-CG2 3.89Å; M2028-V2840 HydrophobicContact CE-CG1 3.57Å; L2029-V2840 HydrophobicContact CD1-CB 4.32Å; L2029-V2840 HydrophobicContact CD1-CG1 3.87Å; L2029-V2840 HydrophobicContact CD1-CG2 3.73Å; L2029-V2840 HydrophobicContact CD2-CG1 4.05Å; L2029-V2840 HydrophobicContact CG-CG1 3.75Å; L2836-V2840 HydrophobicContact CD1-CG2 3.97Å; L2836-V2840 WeakPolarHBondContact O-CB 3.49Å; L2836-V2840 WeakPolarHBondContact O-CG2 3.35Å; L2836-V2840 PolarHBondContact O-N 3.07Å; V2840-Q2842 VanDerWaalsContact C-N 3.34Å; V2840-Q2842 PolarHBondContact O-N 3.27Å; V2840-T2843 PolarHBondContact O-N 2.99Å; V2840-T2843 VanDerWaalsContact O-N 3.16Å; V2840-T2843 PolarHBondContact O-OG1 3.12Å; V2840-T2843 VanDerWaalsContact O-OG1 3.11Å; V2840-M2844 HydrophobicContact CG1-SD 4.33Å; V2840-M2844 VanDerWaalsContact O-CB 3.27Å; V2840-M2844 WeakPolarHBondContact O-CB 3.29Å; V2840-M2844 WeakPolarHBondContact O-CG 3.4Å; V2840-M2844 PolarHBondContact O-N 3Å; V2840-A2894 HydrophobicContact CG2-CB 4.3Å
2841	R	80	Confident	76.2	Confident	137.5 Å²	137.5	82.2 Å²	82.2	52%	0.519	41%	0.41	S	S	.	.	H	α-helix	trans	-66.8	-40.3	178.1	-170.6	175.6	-175	-153.6	-0	112.7	W2837 Y2839 T2843 M2844 Q2845	W2837-R2841 VanDerWaalsContact CH2-CD 3.5Å; W2837-R2841 VanDerWaalsContact O-CB 3.25Å; W2837-R2841 WeakPolarHBondContact O-CB 3.35Å; W2837-R2841 PolarHBondContact O-N 3.05Å; Y2839-R2841 VanDerWaalsContact C-N 3.31Å; Y2839-R2841 PolarHBondContact O-N 3.15Å; R2841-T2843 VanDerWaalsContact C-N 3.34Å; R2841-M2844 PolarHBondContact O-N 3.02Å; R2841-Q2845 WeakPolarHBondContact O-CG 3.26Å; R2841-Q2845 PolarHBondContact O-N 3.15Å; R2841-Q2845 VanDerWaalsContact O-N 3.15Å
2842	Q	80.9	Confident	73.8	Confident	107.75 Å²	107.75	85.1 Å²	85.1	50%	0.504	43%	0.428	S	S	.	.	H	α-helix	trans	-61.7	-46.2	174.9	178.2	178.4	-17.8	0	0	110.7	S2838 Y2839 V2840 M2844 Q2845 E2846	S2838-Q2842 VanDerWaalsContact O-CB 3.29Å; S2838-Q2842 WeakPolarHBondContact O-CB 3.27Å; S2838-Q2842 PolarHBondContact O-N 3.17Å; Y2839-Q2842 PolarHBondContact O-N 2.84Å; V2840-Q2842 VanDerWaalsContact C-N 3.34Å; V2840-Q2842 PolarHBondContact O-N 3.27Å; Q2842-M2844 PolarHBondContact O-N 2.93Å; Q2842-Q2845 WeakPolarHBondContact O-CB 3.39Å; Q2842-Q2845 PolarHBondContact O-N 3.19Å; Q2842-Q2845 VanDerWaalsContact O-N 3.13Å; Q2842-E2846 HydrophobicContact CG-CG 4.47Å; Q2842-E2846 VanDerWaalsContact CG-OE1 3.3Å; Q2842-E2846 WeakPolarHBondContact CG-OE1 3.4Å; Q2842-E2846 PolarHBondContact NE2-OE1 2.98Å; Q2842-E2846 WeakPolarHBondContact O-CG 3.45Å; Q2842-E2846 PolarHBondContact O-N 2.89Å
2843	T	74.7	Confident	71.4	Confident	15.5 Å²	15.5	90.8 Å²	90.8	10%	0.095	46%	0.459	C	S	.	.	H	α-helix	trans	-67.9	-34.7	-179.6	36.9	0	0	0	0	112.8	Y2839 V2840 R2841 Q2845 E2846 L2847 C2890	Y2839-T2843 HydrophobicContact CE1-CG2 4.33Å; Y2839-T2843 HydrophobicContact CE2-CG2 4.39Å; Y2839-T2843 PolarHBondContact O-N 3.05Å; Y2839-T2843 PolarHBondContact O-OG1 2.85Å; V2840-T2843 PolarHBondContact O-N 2.99Å; V2840-T2843 VanDerWaalsContact O-N 3.16Å; V2840-T2843 PolarHBondContact O-OG1 3.12Å; V2840-T2843 VanDerWaalsContact O-OG1 3.11Å; R2841-T2843 VanDerWaalsContact C-N 3.34Å; T2843-Q2845 VanDerWaalsContact C-N 3.31Å; T2843-Q2845 PolarHBondContact O-N 3.04Å; T2843-E2846 PolarHBondContact O-N 3.21Å; T2843-L2847 HydrophobicContact CG2-CD1 3.85Å; T2843-L2847 HydrophobicContact CG2-CG 4.28Å; T2843-L2847 VanDerWaalsContact O-CB 3.32Å; T2843-L2847 WeakPolarHBondContact O-CB 3.44Å; T2843-L2847 WeakPolarHBondContact O-CD1 3.41Å; T2843-L2847 VanDerWaalsContact O-CG 3.25Å; T2843-L2847 WeakPolarHBondContact O-CG 3.39Å; T2843-L2847 PolarHBondContact O-N 3.16Å; T2843-C2890 HydrophobicContact CG2-CB 3.93Å; T2843-C2890 PolarHBondContact OG1-SG 3.16Å
2844	M	73.9	Confident	68.9	Low	66.75 Å²	66.75	94 Å²	94	33%	0.329	48%	0.483	S	S	.	.	H	α-helix	trans	-59.9	-41.4	171.2	-91.4	176.9	24	0	0	112.2	M2028 L2029 V2840 R2841 Q2842 L2847 G2848 L2849	M2028-M2844 HydrophobicContact CE-CE 4.34Å; M2028-M2844 HydrophobicContact CE-SD 3.34Å; M2028-M2844 WeakPolarHBondContact CE-SD 3.43Å; M2028-M2844 HydrophobicContact CG-CE 3.86Å; M2028-M2844 HydrophobicContact CG-SD 3.98Å; M2028-M2844 HydrophobicContact SD-CE 3.83Å; M2028-M2844 HydrophobicContact SD-SD 3.65Å; M2028-M2844 VanDerWaalsContact SD-SD 3.65Å; L2029-M2844 HydrophobicContact CD2-CG 4.18Å; V2840-M2844 HydrophobicContact CG1-SD 4.33Å; V2840-M2844 VanDerWaalsContact O-CB 3.27Å; V2840-M2844 WeakPolarHBondContact O-CB 3.29Å; V2840-M2844 WeakPolarHBondContact O-CG 3.4Å; V2840-M2844 PolarHBondContact O-N 3Å; R2841-M2844 PolarHBondContact O-N 3.02Å; Q2842-M2844 PolarHBondContact O-N 2.93Å; M2844-L2847 PolarHBondContact O-N 3.12Å; M2844-G2848 PolarHBondContact O-N 3.17Å; M2844-G2848 VanDerWaalsContact O-N 3.16Å; M2844-L2849 HydrophobicContact CG-CB 4.22Å; M2844-L2849 PolarHBondContact O-N 2.92Å
2845	Q	74.9	Confident	66.2	Low	128 Å²	128	95.3 Å²	95.3	60%	0.598	50%	0.499	S	S	*	.	H	α-helix	trans	-68.7	-40	176.8	-153.5	172	13.8	0	0	112.1	R2841 Q2842 T2843 L2847 G2848 D2850	R2841-Q2845 WeakPolarHBondContact O-CG 3.26Å; R2841-Q2845 PolarHBondContact O-N 3.15Å; R2841-Q2845 VanDerWaalsContact O-N 3.15Å; Q2842-Q2845 WeakPolarHBondContact O-CB 3.39Å; Q2842-Q2845 PolarHBondContact O-N 3.19Å; Q2842-Q2845 VanDerWaalsContact O-N 3.13Å; T2843-Q2845 VanDerWaalsContact C-N 3.31Å; T2843-Q2845 PolarHBondContact O-N 3.04Å; Q2845-L2847 VanDerWaalsContact C-N 3.3Å; Q2845-L2847 PolarHBondContact O-N 3.26Å; Q2845-G2848 PolarHBondContact O-N 3Å; Q2845-G2848 VanDerWaalsContact O-N 3.13Å; Q2845-D2850 PolarHBondContact NE2-OD2 3.43Å
2846	E	69.7	Low	63.9	Low	118.75 Å²	118.75	94.2 Å²	94.2	56%	0.555	51%	0.507	S	S	*	.	H	α-helix	trans	-66.8	-27.5	173.9	-72.3	177	-163.5	0	0	113.2	Q2842 T2843 G2848	Q2842-E2846 HydrophobicContact CG-CG 4.47Å; Q2842-E2846 VanDerWaalsContact CG-OE1 3.3Å; Q2842-E2846 WeakPolarHBondContact CG-OE1 3.4Å; Q2842-E2846 PolarHBondContact NE2-OE1 2.98Å; Q2842-E2846 WeakPolarHBondContact O-CG 3.45Å; Q2842-E2846 PolarHBondContact O-N 2.89Å; T2843-E2846 PolarHBondContact O-N 3.21Å; E2846-G2848 VanDerWaalsContact C-N 3.33Å
2847	L	65.8	Low	61.3	Low	40.5 Å²	40.5	99.2 Å²	99.2	21%	0.212	53%	0.534	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-6.6	173.9	-69.9	167.1	0	0	0	113.4	T2843 M2844 Q2845 L2849 L2883 L2887	T2843-L2847 HydrophobicContact CG2-CD1 3.85Å; T2843-L2847 HydrophobicContact CG2-CG 4.28Å; T2843-L2847 VanDerWaalsContact O-CB 3.32Å; T2843-L2847 WeakPolarHBondContact O-CB 3.44Å; T2843-L2847 WeakPolarHBondContact O-CD1 3.41Å; T2843-L2847 VanDerWaalsContact O-CG 3.25Å; T2843-L2847 WeakPolarHBondContact O-CG 3.39Å; T2843-L2847 PolarHBondContact O-N 3.16Å; M2844-L2847 PolarHBondContact O-N 3.12Å; Q2845-L2847 VanDerWaalsContact C-N 3.3Å; Q2845-L2847 PolarHBondContact O-N 3.26Å; L2847-L2849 VanDerWaalsContact C-N 3.33Å; L2847-L2849 HydrophobicContact CB-CD1 4.22Å; L2847-L2849 HydrophobicContact CB-CG 4.22Å; L2847-L2849 HydrophobicContact CD1-CD1 4.38Å; L2847-L2849 PolarHBondContact O-N 2.98Å; L2847-L2883 HydrophobicContact CD2-CB 4.23Å; L2847-L2883 HydrophobicContact CD2-CD2 3.87Å; L2847-L2887 HydrophobicContact CD1-CB 4.25Å; L2847-L2887 HydrophobicContact CD1-CD1 3.75Å; L2847-L2887 HydrophobicContact CD1-CD2 4.48Å; L2847-L2887 HydrophobicContact CD1-CG 4.43Å
2848	G	59.8	Low	58.9	Low	59.5 Å²	59.5	100.8 Å²	100.8	61%	0.613	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.6	19.1	178	0	0	0	0	0	115.1	M2844 Q2845 E2846 D2850	M2844-G2848 PolarHBondContact O-N 3.17Å; M2844-G2848 VanDerWaalsContact O-N 3.16Å; Q2845-G2848 PolarHBondContact O-N 3Å; Q2845-G2848 VanDerWaalsContact O-N 3.13Å; E2846-G2848 VanDerWaalsContact C-N 3.33Å; G2848-D2850 VanDerWaalsContact C-N 3.26Å; G2848-D2850 PolarHBondContact O-N 3.2Å
2849	L	59.5	Low	56.2	Low	101.5 Å²	101.5	103.1 Å²	103.1	53%	0.531	56%	0.562	S	S	.	*			trans	-85.3	23.7	-176.9	-65.1	173.9	0	0	0	112.9	C2032 Y2036 M2844 L2847 A2851	C2032-L2849 HydrophobicContact CB-CD1 3.52Å; Y2036-L2849 HydrophobicContact CD2-CD2 4.42Å; M2844-L2849 HydrophobicContact CG-CB 4.22Å; M2844-L2849 PolarHBondContact O-N 2.92Å; L2847-L2849 VanDerWaalsContact C-N 3.33Å; L2847-L2849 HydrophobicContact CB-CD1 4.22Å; L2847-L2849 HydrophobicContact CB-CG 4.22Å; L2847-L2849 HydrophobicContact CD1-CD1 4.38Å; L2847-L2849 PolarHBondContact O-N 2.98Å; L2849-A2851 PolarHBondContact O-N 3.18Å; L2849-A2851 VanDerWaalsContact O-N 3.1Å
2850	D	47.6	Very low	53.8	Low	96 Å²	96	109.2 Å²	109.2	51%	0.513	59%	0.593	S	S	.	*			trans	-73.1	74.7	175.2	-73.7	-10.6	0	0	0	111.6	Q2845 G2848 N2852	Q2845-D2850 PolarHBondContact NE2-OD2 3.43Å; G2848-D2850 VanDerWaalsContact C-N 3.26Å; G2848-D2850 PolarHBondContact O-N 3.2Å; D2850-N2852 VanDerWaalsContact C-N 3.25Å; D2850-N2852 PolarHBondContact O-N 3.26Å
2851	A	45.3	Very low	51.5	Low	91 Å²	91	113 Å²	113	75%	0.752	62%	0.618	S	S	*	*			trans	-71.6	45.4	-174.5	0	0	0	0	0	114.6	L2849	L2849-A2851 PolarHBondContact O-N 3.18Å; L2849-A2851 VanDerWaalsContact O-N 3.1Å
2852	N	40.6	Very low	49.2	Very low	141 Å²	141	111.8 Å²	111.8	75%	0.754	63%	0.63	S	S	*	*	S	Bend	trans	-134.9	70.3	178	-84.8	-47.2	0	0	0	112.4	D2850 T2854	D2850-N2852 VanDerWaalsContact C-N 3.25Å; D2850-N2852 PolarHBondContact O-N 3.26Å; N2852-T2854 PolarHBondContact O-N 2.86Å; N2852-T2854 VanDerWaalsContact O-N 3.12Å
2853	N	38.4	Very low	46.8	Very low	156 Å²	156	110.7 Å²	110.7	83%	0.834	64%	0.64	S	S	*	*			trans	-74.9	82.6	166	-86.5	-28.8	0	0	0	114.9
2854	T	36.9	Very low	44.7	Very low	131.25 Å²	131.25	119.2 Å²	119.2	81%	0.805	68%	0.676	S	S	*	*			trans	-112.7	97.2	166	43.7	0	0	0	0	111.6	N2852 V2856	N2852-T2854 PolarHBondContact O-N 2.86Å; N2852-T2854 VanDerWaalsContact O-N 3.12Å; T2854-V2856 VanDerWaalsContact C-N 3.25Å; T2854-V2856 PolarHBondContact O-N 3Å
2855	L	33.5	Very low	42.6	Very low	165.75 Å²	165.75	126.1 Å²	126.1	87%	0.868	70%	0.7	S	S	*	*			trans	-99.8	86.6	169.2	-166.5	123.8	0	0	0	109.4	N2857	L2855-N2857 PolarHBondContact O-N 3.15Å
2856	V	39.7	Very low	40.7	Very low	114.75 Å²	114.75	128.3 Å²	128.3	70%	0.695	71%	0.71	S	S	*	*			trans	-129.2	105.1	171.5	171.7	0	0	0	0	109.7	T2854 H2858	T2854-V2856 VanDerWaalsContact C-N 3.25Å; T2854-V2856 PolarHBondContact O-N 3Å; V2856-H2858 PolarHBondContact O-N 2.93Å
2857	N	31.5	Very low	38.8	Very low	125.25 Å²	125.25	127.7 Å²	127.7	67%	0.67	72%	0.719	S	S	*	*			trans	29.1	119.5	151.8	-64	-14.9	0	0	0	118.6	L2855 S2859	L2855-N2857 PolarHBondContact O-N 3.15Å; N2857-S2859 PolarHBondContact O-N 3.26Å
2858	H	33.7	Very low	37.5	Very low	173.75 Å²	173.75	131.4 Å²	131.4	80%	0.804	75%	0.745	S	S	*	*				119.9	103.8	127.1	-70.6	-56.3	0	0	0	117.3	V2856 H2860	V2856-H2858 PolarHBondContact O-N 2.93Å; H2858-H2860 VanDerWaalsContact C-N 3.27Å; H2858-H2860 PolarHBondContact O-N 3.07Å; H2858-H2860 VanDerWaalsContact O-N 3.07Å
2859	S	29.5	Very low	36.1	Very low	101.75 Å²	101.75	134 Å²	134	71%	0.712	75%	0.749	S	S	*	*			trans	-45.3	108.3	145.4	55.7	0	0	0	0	115.8	N2857	N2857-S2859 PolarHBondContact O-N 3.26Å
2860	H	31.4	Very low	35.1	Very low	182 Å²	182	134.9 Å²	134.9	84%	0.843	76%	0.759	S	S	*	*			trans	-150.6	130.2	137.9	-109.3	-64.4	0	0	0	110.4	H2858 S2862	H2858-H2860 VanDerWaalsContact C-N 3.27Å; H2858-H2860 PolarHBondContact O-N 3.07Å; H2858-H2860 VanDerWaalsContact O-N 3.07Å; H2860-S2862 PolarHBondContact O-N 2.88Å; H2860-S2862 VanDerWaalsContact O-N 3.16Å
2861	P	34.5	Very low	34.3	Very low	118.5 Å²	118.5	137.5 Å²	137.5	77%	0.769	77%	0.773	S	S	*	*			trans	-103.5	117.8	-170.6	36	-28.4	0	0	0	112.7	A2863	P2861-A2863 PolarHBondContact O-N 2.82Å
2862	S	30.4	Very low	34	Very low	111.75 Å²	111.75	138 Å²	138	78%	0.781	77%	0.771	S	S	*	*			trans	-171.5	131.8	171.1	62.2	0	0	0	0	112	H2860 F2864	H2860-S2862 PolarHBondContact O-N 2.88Å; H2860-S2862 VanDerWaalsContact O-N 3.16Å; S2862-F2864 PolarHBondContact O-N 3.39Å; S2862-F2864 VanDerWaalsContact O-N 3.12Å
2863	A	30.9	Very low	33.8	Very low	86.25 Å²	86.25	136.8 Å²	136.8	71%	0.713	77%	0.774	S	S	*	*				-130.8	129.2	91.6	0	0	0	0	0	113.3	P2861	P2861-A2863 PolarHBondContact O-N 2.82Å
2864	F	30.2	Very low	33.9	Very low	193.5 Å²	193.5	136 Å²	136	85%	0.849	77%	0.77	S	S	*	*			trans	-161.1	110.7	139.9	-105.1	-91.9	0	0	0	112.6	S2862 H2866	S2862-F2864 PolarHBondContact O-N 3.39Å; S2862-F2864 VanDerWaalsContact O-N 3.12Å; F2864-H2866 PolarHBondContact O-N 3.16Å
2865	Y	31.4	Very low	34.3	Very low	210.5 Å²	210.5	135.4 Å²	135.4	83%	0.825	76%	0.761	S	S	*	*			trans	-58.2	126.3	160.7	-73.3	-85.2	0	0	0	112.6
2866	H	33.8	Very low	34.9	Very low	175.5 Å²	175.5	133.1 Å²	133.1	81%	0.813	75%	0.754	S	S	*	*				-154.8	124.3	125.7	-98.8	-69.1	0	0	0	110.1	F2864 P2868	F2864-H2866 PolarHBondContact O-N 3.16Å; H2866-P2868 WeakPolarHBondContact O-CD 3.43Å
2867	S	30.7	Very low	35.2	Very low	105 Å²	105	132.8 Å²	132.8	73%	0.734	75%	0.753	S	S	*	*			trans	-93	139.7	163.8	-115.5	0	0	0	0	109.1	T2869	S2867-T2869 PolarHBondContact OG-N 3.41Å
2868	P	37.2	Very low	36	Very low	118.25 Å²	118.25	129.3 Å²	129.3	77%	0.768	74%	0.738	S	S	*	*				-118.1	129.9	126.4	21.4	-7.8	0	0	0	111.6	H2866	H2866-P2868 WeakPolarHBondContact O-CD 3.43Å
2869	T	32.3	Very low	36.6	Very low	114.75 Å²	114.75	130 Å²	130	70%	0.704	73%	0.733	S	S	*	*			trans	-16.3	140.4	144.8	53.9	0	0	0	0	115.8	S2867	S2867-T2869 PolarHBondContact OG-N 3.41Å
2870	T	37.1	Very low	37.6	Very low	120.75 Å²	120.75	128.5 Å²	128.5	74%	0.741	72%	0.72	S	S	*	*			trans	84.5	122.3	146.3	38.2	0	0	0	0	117.3
2871	D	32	Very low	38.8	Very low	149.25 Å²	149.25	122.8 Å²	122.8	80%	0.798	70%	0.7	S	S	*	*			trans	79	126	139.9	-60.2	-14.6	0	0	0	119.5
2872	S	37.8	Very low	40.2	Very low	102.75 Å²	102.75	120.8 Å²	120.8	72%	0.719	68%	0.684	S	S	*	*			trans	125.4	80.9	142.2	29.1	0	0	0	0	117.1	N2874	S2872-N2874 VanDerWaalsContact C-N 3.29Å; S2872-N2874 PolarHBondContact O-N 3.12Å
2873	S	36.5	Very low	41.9	Very low	115.5 Å²	115.5	118.9 Å²	118.9	81%	0.808	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.2	61.3	157.7	56.8	0	0	0	0	115.5
2874	N	41.9	Very low	43.6	Very low	139.75 Å²	139.75	118.6 Å²	118.6	75%	0.747	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-148.3	18.4	179.5	-86.2	-19.9	0	0	0	114.4	S2872	S2872-N2874 VanDerWaalsContact C-N 3.29Å; S2872-N2874 PolarHBondContact O-N 3.12Å
2875	N	44.8	Very low	45.6	Very low	117.25 Å²	117.25	114.4 Å²	114.4	63%	0.627	64%	0.64	S	S	*	*			trans	-118.4	14.9	-169.7	-126.9	-16.4	0	0	0	116.1	S2878	N2875-S2878 WeakPolarHBondContact CA-OG 3.34Å; N2875-S2878 PolarHBondContact O-OG 3.26Å; N2875-S2878 VanDerWaalsContact O-OG 3.12Å; N2875-S2878 PolarHBondContact OD1-OG 3.33Å
2876	V	46.3	Very low	47.6	Very low	118.5 Å²	118.5	109.5 Å²	109.5	72%	0.718	62%	0.622	S	S	*	*	S	Bend	trans	-85.5	-43.9	177.5	-178.8	0	0	0	0	111.1	S2878 R2879 T2880	V2876-S2878 VanDerWaalsContact C-N 3.28Å; V2876-S2878 PolarHBondContact O-N 3.27Å; V2876-R2879 PolarHBondContact O-N 3.15Å; V2876-R2879 VanDerWaalsContact O-N 3.15Å; V2876-T2880 PolarHBondContact O-N 2.88Å; V2876-T2880 PolarHBondContact O-OG1 2.94Å
2877	T	45.5	Very low	49.5	Very low	109.25 Å²	109.25	104 Å²	104	67%	0.67	60%	0.599	S	S	*	*	H	α-helix	trans	-67.3	-24.5	-179.7	-5	0	0	0	0	113.9	T2880 S2881	T2877-T2880 WeakPolarHBondContact CA-OG1 3.32Å; T2877-T2880 PolarHBondContact O-OG1 3.31Å; T2877-S2881 PolarHBondContact O-N 3.23Å; T2877-S2881 VanDerWaalsContact O-N 3.14Å; T2877-S2881 PolarHBondContact O-OG 3.22Å
2878	S	47.8	Very low	51.7	Low	49.75 Å²	49.75	102.3 Å²	102.3	35%	0.348	58%	0.584	S	S	.	*	H	α-helix	trans	-71.5	-39	176.2	70.9	0	0	0	0	112.6	N2875 V2876 T2880 S2881 D2882	N2875-S2878 WeakPolarHBondContact CA-OG 3.34Å; N2875-S2878 PolarHBondContact O-OG 3.26Å; N2875-S2878 VanDerWaalsContact O-OG 3.12Å; N2875-S2878 PolarHBondContact OD1-OG 3.33Å; V2876-S2878 VanDerWaalsContact C-N 3.28Å; V2876-S2878 PolarHBondContact O-N 3.27Å; S2878-T2880 VanDerWaalsContact C-N 3.35Å; S2878-T2880 PolarHBondContact O-N 2.88Å; S2878-S2881 PolarHBondContact O-N 3.5Å; S2878-S2881 VanDerWaalsContact O-N 3.17Å; S2878-S2881 PolarHBondContact O-OG 3.01Å; S2878-S2881 VanDerWaalsContact O-OG 3.11Å; S2878-D2882 WeakPolarHBondContact O-CB 3.21Å; S2878-D2882 PolarHBondContact O-N 3.05Å; S2878-D2882 VanDerWaalsContact O-N 3.14Å
2879	R	47.6	Very low	53.7	Low	189.25 Å²	189.25	100.8 Å²	100.8	71%	0.714	57%	0.569	S	S	*	*	H	α-helix	trans	-71.5	-36.7	179.5	-80.3	-178.4	161	-175.7	-5.3	113.1	V2876 L2883	V2876-R2879 PolarHBondContact O-N 3.15Å; V2876-R2879 VanDerWaalsContact O-N 3.15Å; R2879-L2883 WeakPolarHBondContact O-CB 3.36Å; R2879-L2883 VanDerWaalsContact O-CG 3.31Å; R2879-L2883 WeakPolarHBondContact O-CG 3.37Å; R2879-L2883 PolarHBondContact O-N 3.3Å; R2879-L2883 VanDerWaalsContact O-N 3.16Å
2880	T	50	Low	56	Low	69.5 Å²	69.5	95.8 Å²	95.8	43%	0.426	54%	0.539	S	S	.	.	H	α-helix	trans	-68.3	-39.9	178.1	48.7	0	0	0	0	111.9	V2876 T2877 S2878 D2882 L2883 T2884	V2876-T2880 PolarHBondContact O-N 2.88Å; V2876-T2880 PolarHBondContact O-OG1 2.94Å; T2877-T2880 WeakPolarHBondContact CA-OG1 3.32Å; T2877-T2880 PolarHBondContact O-OG1 3.31Å; S2878-T2880 VanDerWaalsContact C-N 3.35Å; S2878-T2880 PolarHBondContact O-N 2.88Å; T2880-D2882 VanDerWaalsContact C-N 3.34Å; T2880-D2882 PolarHBondContact O-N 3.49Å; T2880-L2883 PolarHBondContact O-N 3.29Å; T2880-T2884 WeakPolarHBondContact O-CB 3.12Å; T2880-T2884 PolarHBondContact O-N 2.9Å; T2880-T2884 VanDerWaalsContact O-N 3.12Å; T2880-T2884 PolarHBondContact O-OG1 3.1Å; T2880-T2884 VanDerWaalsContact O-OG1 3.12Å
2881	S	56.3	Low	58.1	Low	62.5 Å²	62.5	92.5 Å²	92.5	44%	0.437	52%	0.517	S	S	.	.	H	α-helix	trans	-65.7	-41.2	175.9	55.4	0	0	0	0	113.1	T2877 S2878 T2884 L2885	T2877-S2881 PolarHBondContact O-N 3.23Å; T2877-S2881 VanDerWaalsContact O-N 3.14Å; T2877-S2881 PolarHBondContact O-OG 3.22Å; S2878-S2881 PolarHBondContact O-N 3.5Å; S2878-S2881 VanDerWaalsContact O-N 3.17Å; S2878-S2881 PolarHBondContact O-OG 3.01Å; S2878-S2881 VanDerWaalsContact O-OG 3.11Å; S2881-T2884 PolarHBondContact O-N 3.13Å; S2881-L2885 WeakPolarHBondContact O-CB 3.34Å; S2881-L2885 WeakPolarHBondContact O-CG 3.37Å; S2881-L2885 PolarHBondContact O-N 3.2Å
2882	D	63.5	Low	60.5	Low	78 Å²	78	91.7 Å²	91.7	42%	0.417	51%	0.508	S	S	.	.	H	α-helix	trans	-63	-42.7	176.2	-164.8	34.3	0	0	0	112.4	S2878 T2880 T2884 L2885 K2886	S2878-D2882 WeakPolarHBondContact O-CB 3.21Å; S2878-D2882 PolarHBondContact O-N 3.05Å; S2878-D2882 VanDerWaalsContact O-N 3.14Å; T2880-D2882 VanDerWaalsContact C-N 3.34Å; T2880-D2882 PolarHBondContact O-N 3.49Å; D2882-T2884 VanDerWaalsContact C-N 3.33Å; D2882-T2884 PolarHBondContact O-N 2.81Å; D2882-L2885 PolarHBondContact O-N 3.22Å; D2882-K2886 VanDerWaalsContact CG-NZ 3.33Å; D2882-K2886 WeakPolarHBondContact O-CB 3.3Å; D2882-K2886 WeakPolarHBondContact O-CD 3.35Å; D2882-K2886 VanDerWaalsContact O-CG 3.3Å; D2882-K2886 WeakPolarHBondContact O-CG 3.39Å; D2882-K2886 PolarHBondContact O-N 3.17Å; D2882-K2886 VanDerWaalsContact OD1-CE 3.24Å; D2882-K2886 WeakPolarHBondContact OD1-CE 3.42Å; D2882-K2886 IonicContact OD1-NZ 3.73Å; D2882-K2886 PolarHBondContact OD1-NZ 3.12Å; D2882-K2886 WeakPolarHBondContact OD2-CE 3.38Å; D2882-K2886 IonicContact OD2-NZ 3.15Å; D2882-K2886 PolarHBondContact OD2-NZ 3.06Å
2883	L	66.6	Low	62.6	Low	71.25 Å²	71.25	89.1 Å²	89.1	37%	0.373	49%	0.49	S	S	.	.	H	α-helix	trans	-64.2	-42.8	175	-74.7	166.4	0	0	0	112.2	Y2036 L2847 R2879 T2880 K2886 L2887	Y2036-L2883 VanDerWaalsContact OH-CD1 3.23Å; Y2036-L2883 WeakPolarHBondContact OH-CD1 3.44Å; L2847-L2883 HydrophobicContact CD2-CB 4.23Å; L2847-L2883 HydrophobicContact CD2-CD2 3.87Å; R2879-L2883 WeakPolarHBondContact O-CB 3.36Å; R2879-L2883 VanDerWaalsContact O-CG 3.31Å; R2879-L2883 WeakPolarHBondContact O-CG 3.37Å; R2879-L2883 PolarHBondContact O-N 3.3Å; R2879-L2883 VanDerWaalsContact O-N 3.16Å; T2880-L2883 PolarHBondContact O-N 3.29Å; L2883-K2886 PolarHBondContact O-N 2.94Å; L2883-L2887 WeakPolarHBondContact O-CB 3.44Å; L2883-L2887 PolarHBondContact O-N 3.07Å
2884	T	67	Low	64.9	Low	80.5 Å²	80.5	84.1 Å²	84.1	49%	0.494	46%	0.455	S	S	.	.	H	α-helix	trans	-63.4	-43.6	176.8	-56.2	0	0	0	0	111.5	T2880 S2881 D2882 K2886 L2887 V2888	T2880-T2884 WeakPolarHBondContact O-CB 3.12Å; T2880-T2884 PolarHBondContact O-N 2.9Å; T2880-T2884 VanDerWaalsContact O-N 3.12Å; T2880-T2884 PolarHBondContact O-OG1 3.1Å; T2880-T2884 VanDerWaalsContact O-OG1 3.12Å; S2881-T2884 PolarHBondContact O-N 3.13Å; D2882-T2884 VanDerWaalsContact C-N 3.33Å; D2882-T2884 PolarHBondContact O-N 2.81Å; T2884-K2886 VanDerWaalsContact C-N 3.34Å; T2884-K2886 PolarHBondContact O-N 3.06Å; T2884-L2887 WeakPolarHBondContact O-CB 3.42Å; T2884-L2887 PolarHBondContact O-N 3.23Å; T2884-V2888 HydrophobicContact CG2-CG2 4.49Å; T2884-V2888 WeakPolarHBondContact O-CG2 3.26Å; T2884-V2888 PolarHBondContact O-N 3.1Å
2885	L	72.2	Confident	66.9	Low	105.5 Å²	105.5	84.1 Å²	84.1	55%	0.552	45%	0.445	S	S	*	.	H	α-helix	trans	-64.3	-39.2	176.8	-91.9	151.6	0	0	0	112.1	S2881 D2882 V2888 N2889	S2881-L2885 WeakPolarHBondContact O-CB 3.34Å; S2881-L2885 WeakPolarHBondContact O-CG 3.37Å; S2881-L2885 PolarHBondContact O-N 3.2Å; D2882-L2885 PolarHBondContact O-N 3.22Å; L2885-V2888 PolarHBondContact O-N 3.24Å; L2885-N2889 VanDerWaalsContact O-CB 3.32Å; L2885-N2889 WeakPolarHBondContact O-CB 3.39Å; L2885-N2889 VanDerWaalsContact O-CG 3.26Å; L2885-N2889 PolarHBondContact O-N 3.11Å; L2885-N2889 PolarHBondContact O-ND2 2.92Å; L2885-N2889 VanDerWaalsContact O-ND2 3.1Å
2886	K	72.3	Confident	68.9	Low	105.75 Å²	105.75	85.2 Å²	85.2	46%	0.46	44%	0.444	S	S	.	.	H	α-helix	trans	-63.1	-42.4	173.3	-76.3	168.7	178.8	168.8	0	112.2	D2882 L2883 T2884 N2889 C2890	D2882-K2886 VanDerWaalsContact CG-NZ 3.33Å; D2882-K2886 WeakPolarHBondContact O-CB 3.3Å; D2882-K2886 WeakPolarHBondContact O-CD 3.35Å; D2882-K2886 VanDerWaalsContact O-CG 3.3Å; D2882-K2886 WeakPolarHBondContact O-CG 3.39Å; D2882-K2886 PolarHBondContact O-N 3.17Å; D2882-K2886 VanDerWaalsContact OD1-CE 3.24Å; D2882-K2886 WeakPolarHBondContact OD1-CE 3.42Å; D2882-K2886 IonicContact OD1-NZ 3.73Å; D2882-K2886 PolarHBondContact OD1-NZ 3.12Å; D2882-K2886 WeakPolarHBondContact OD2-CE 3.38Å; D2882-K2886 IonicContact OD2-NZ 3.15Å; D2882-K2886 PolarHBondContact OD2-NZ 3.06Å; L2883-K2886 PolarHBondContact O-N 2.94Å; T2884-K2886 VanDerWaalsContact C-N 3.34Å; T2884-K2886 PolarHBondContact O-N 3.06Å; K2886-N2889 PolarHBondContact O-N 3Å; K2886-C2890 VanDerWaalsContact O-CB 3.29Å; K2886-C2890 WeakPolarHBondContact O-CB 3.39Å; K2886-C2890 PolarHBondContact O-N 3.04Å
2887	L	74.4	Confident	70.8	Confident	61 Å²	61	80.2 Å²	80.2	32%	0.319	41%	0.413	S	S	.	.	H	α-helix	trans	-62.7	-46.2	176.2	-174.5	67.7	0	0	0	111.8	L2029 M2033 L2847 L2883 T2884 N2889 C2890 I2891	L2029-L2887 HydrophobicContact CB-CD1 4.17Å; L2029-L2887 HydrophobicContact CD2-CD1 3.77Å; M2033-L2887 HydrophobicContact CB-CD2 3.67Å; M2033-L2887 HydrophobicContact CB-CG 4.45Å; M2033-L2887 HydrophobicContact CG-CD2 3.8Å; M2033-L2887 HydrophobicContact CG-CG 4.45Å; L2847-L2887 HydrophobicContact CD1-CB 4.25Å; L2847-L2887 HydrophobicContact CD1-CD1 3.75Å; L2847-L2887 HydrophobicContact CD1-CD2 4.48Å; L2847-L2887 HydrophobicContact CD1-CG 4.43Å; L2883-L2887 WeakPolarHBondContact O-CB 3.44Å; L2883-L2887 PolarHBondContact O-N 3.07Å; T2884-L2887 WeakPolarHBondContact O-CB 3.42Å; T2884-L2887 PolarHBondContact O-N 3.23Å; L2887-N2889 PolarHBondContact O-N 3.39Å; L2887-C2890 WeakPolarHBondContact O-CB 3.41Å; L2887-C2890 PolarHBondContact O-N 2.93Å; L2887-I2891 HydrophobicContact CD1-CD1 4.26Å; L2887-I2891 HydrophobicContact CD1-CG1 4.35Å; L2887-I2891 HydrophobicContact CG-CD1 4.05Å; L2887-I2891 WeakPolarHBondContact O-CD1 3.44Å; L2887-I2891 VanDerWaalsContact O-CG1 3.31Å; L2887-I2891 WeakPolarHBondContact O-CG1 3.34Å; L2887-I2891 PolarHBondContact O-N 3.07Å
2888	V	77.6	Confident	72.8	Confident	68.75 Å²	68.75	78.1 Å²	78.1	42%	0.417	40%	0.396	S	S	.	.	H	α-helix	trans	-62	-46	177.1	171.4	0	0	0	0	111.4	T2884 L2885 C2890 I2891 Q2892	T2884-V2888 HydrophobicContact CG2-CG2 4.49Å; T2884-V2888 WeakPolarHBondContact O-CG2 3.26Å; T2884-V2888 PolarHBondContact O-N 3.1Å; L2885-V2888 PolarHBondContact O-N 3.24Å; V2888-C2890 VanDerWaalsContact C-N 3.3Å; V2888-C2890 PolarHBondContact O-N 2.89Å; V2888-I2891 PolarHBondContact O-N 2.9Å; V2888-Q2892 WeakPolarHBondContact O-CB 3.41Å; V2888-Q2892 PolarHBondContact O-N 3.11Å
2889	N	79.2	Confident	74.8	Confident	87.5 Å²	87.5	79 Å²	79	47%	0.468	40%	0.399	S	S	.	.	H	α-helix	trans	-62.4	-36.2	176.1	-75.8	-38.2	0	0	0	112.4	L2885 K2886 L2887 S2893	L2885-N2889 VanDerWaalsContact O-CB 3.32Å; L2885-N2889 WeakPolarHBondContact O-CB 3.39Å; L2885-N2889 VanDerWaalsContact O-CG 3.26Å; L2885-N2889 PolarHBondContact O-N 3.11Å; L2885-N2889 PolarHBondContact O-ND2 2.92Å; L2885-N2889 VanDerWaalsContact O-ND2 3.1Å; K2886-N2889 PolarHBondContact O-N 3Å; L2887-N2889 PolarHBondContact O-N 3.39Å; N2889-S2893 VanDerWaalsContact O-CB 3.27Å; N2889-S2893 WeakPolarHBondContact O-CB 3.35Å; N2889-S2893 PolarHBondContact O-N 3.04Å; N2889-S2893 PolarHBondContact O-OG 3.03Å; N2889-S2893 VanDerWaalsContact O-OG 3.1Å
2890	C	80.1	Confident	76.8	Confident	10.5 Å²	10.5	73.7 Å²	73.7	7%	0.071	38%	0.383	C	S	.	.	H	α-helix	trans	-63.1	-51.1	172.3	175.8	0	0	0	0	111.6	L2029 Y2839 T2843 K2886 L2887 V2888 Q2892 S2893 A2894	L2029-C2890 WeakPolarHBondContact CD1-SG 3.46Å; Y2839-C2890 HydrophobicContact CE1-CB 4.37Å; Y2839-C2890 WeakPolarHBondContact CE1-SG 3.32Å; Y2839-C2890 WeakPolarHBondContact OH-CA 3.42Å; T2843-C2890 HydrophobicContact CG2-CB 3.93Å; T2843-C2890 PolarHBondContact OG1-SG 3.16Å; K2886-C2890 VanDerWaalsContact O-CB 3.29Å; K2886-C2890 WeakPolarHBondContact O-CB 3.39Å; K2886-C2890 PolarHBondContact O-N 3.04Å; L2887-C2890 WeakPolarHBondContact O-CB 3.41Å; L2887-C2890 PolarHBondContact O-N 2.93Å; V2888-C2890 VanDerWaalsContact C-N 3.3Å; V2888-C2890 PolarHBondContact O-N 2.89Å; C2890-Q2892 VanDerWaalsContact C-N 3.31Å; C2890-Q2892 PolarHBondContact O-N 2.9Å; C2890-S2893 PolarHBondContact O-N 3.11Å; C2890-S2893 VanDerWaalsContact O-N 3.13Å; C2890-A2894 VanDerWaalsContact O-CB 3.31Å; C2890-A2894 WeakPolarHBondContact O-CB 3.34Å; C2890-A2894 PolarHBondContact O-N 3.03Å
2891	I	80.6	Confident	78.6	Confident	51.5 Å²	51.5	70.7 Å²	70.7	26%	0.264	36%	0.364	S	S	.	.	H	α-helix	trans	-58.7	-43.1	179.5	-68.7	163	0	0	0	110.7	I2026 L2029 L2030 M2033 L2887 V2888 S2893 A2894 R2895	I2026-I2891 HydrophobicContact CG2-CG2 4.23Å; L2029-I2891 HydrophobicContact CB-CG1 3.95Å; L2029-I2891 HydrophobicContact CD1-CG1 4.32Å; L2030-I2891 HydrophobicContact CD1-CD1 3.86Å; L2030-I2891 HydrophobicContact CD1-CG1 4.42Å; L2030-I2891 HydrophobicContact CD1-CG2 4.4Å; M2033-I2891 HydrophobicContact SD-CD1 4.03Å; L2887-I2891 HydrophobicContact CD1-CD1 4.26Å; L2887-I2891 HydrophobicContact CD1-CG1 4.35Å; L2887-I2891 HydrophobicContact CG-CD1 4.05Å; L2887-I2891 WeakPolarHBondContact O-CD1 3.44Å; L2887-I2891 VanDerWaalsContact O-CG1 3.31Å; L2887-I2891 WeakPolarHBondContact O-CG1 3.34Å; L2887-I2891 PolarHBondContact O-N 3.07Å; V2888-I2891 PolarHBondContact O-N 2.9Å; I2891-S2893 PolarHBondContact O-N 3.39Å; I2891-A2894 PolarHBondContact O-N 3.47Å; I2891-R2895 HydrophobicContact CG2-CG 4.45Å; I2891-R2895 WeakPolarHBondContact O-CB 3.39Å; I2891-R2895 VanDerWaalsContact O-CG 3.29Å; I2891-R2895 WeakPolarHBondContact O-CG 3.29Å; I2891-R2895 PolarHBondContact O-N 3.22Å
2892	Q	83.5	Confident	80.1	Confident	131.75 Å²	131.75	71.3 Å²	71.3	62%	0.616	36%	0.362	S	S	*	.	H	α-helix	trans	-66.6	-39.2	177.9	-172.6	169.7	-7.9	0	0	112.6	V2888 C2890 R2895 K2896	V2888-Q2892 WeakPolarHBondContact O-CB 3.41Å; V2888-Q2892 PolarHBondContact O-N 3.11Å; C2890-Q2892 VanDerWaalsContact C-N 3.31Å; C2890-Q2892 PolarHBondContact O-N 2.9Å; Q2892-R2895 PolarHBondContact O-N 2.92Å; Q2892-K2896 WeakPolarHBondContact O-CB 3.36Å; Q2892-K2896 PolarHBondContact O-N 3.12Å; Q2892-K2896 VanDerWaalsContact O-N 3.11Å
2893	S	81.8	Confident	81.4	Confident	48.75 Å²	48.75	73.5 Å²	73.5	34%	0.341	37%	0.37	S	S	.	.	H	α-helix	trans	-69.5	-39.7	176.2	-63.5	0	0	0	0	112.5	Y2839 N2889 C2890 I2891 K2896 L2897	Y2839-S2893 VanDerWaalsContact CE1-CB 3.46Å; Y2839-S2893 VanDerWaalsContact OH-CB 3.29Å; Y2839-S2893 WeakPolarHBondContact OH-CB 3.2Å; Y2839-S2893 PolarHBondContact OH-OG 3.02Å; N2889-S2893 VanDerWaalsContact O-CB 3.27Å; N2889-S2893 WeakPolarHBondContact O-CB 3.35Å; N2889-S2893 PolarHBondContact O-N 3.04Å; N2889-S2893 PolarHBondContact O-OG 3.03Å; N2889-S2893 VanDerWaalsContact O-OG 3.1Å; C2890-S2893 PolarHBondContact O-N 3.11Å; C2890-S2893 VanDerWaalsContact O-N 3.13Å; I2891-S2893 PolarHBondContact O-N 3.39Å; S2893-K2896 WeakPolarHBondContact O-CB 3.39Å; S2893-K2896 PolarHBondContact O-N 3.14Å; S2893-L2897 WeakPolarHBondContact O-CG 3.25Å; S2893-L2897 PolarHBondContact O-N 3.17Å; S2893-L2897 VanDerWaalsContact O-N 3.08Å
2894	A	84.5	Confident	82.5	Confident	9.5 Å²	9.5	71 Å²	71	8%	0.079	36%	0.357	C	S	.	.	H	α-helix	trans	-62.7	-49	173.7	0	0	0	0	0	111.2	I2026 L2029 L2836 V2840 C2890 I2891 K2896 L2897 E2898	I2026-A2894 HydrophobicContact CD1-CB 3.99Å; I2026-A2894 HydrophobicContact CG1-CB 3.61Å; L2029-A2894 HydrophobicContact CD1-CB 4.5Å; L2836-A2894 HydrophobicContact CD1-CB 3.89Å; V2840-A2894 HydrophobicContact CG2-CB 4.3Å; C2890-A2894 VanDerWaalsContact O-CB 3.31Å; C2890-A2894 WeakPolarHBondContact O-CB 3.34Å; C2890-A2894 PolarHBondContact O-N 3.03Å; I2891-A2894 PolarHBondContact O-N 3.47Å; A2894-K2896 VanDerWaalsContact C-N 3.29Å; A2894-K2896 PolarHBondContact O-N 3.2Å; A2894-L2897 WeakPolarHBondContact O-CB 3.32Å; A2894-L2897 PolarHBondContact O-N 3.26Å; A2894-E2898 WeakPolarHBondContact O-CG 3.36Å; A2894-E2898 PolarHBondContact O-N 3Å
2895	R	83.5	Confident	83.5	Confident	139.75 Å²	139.75	70.3 Å²	70.3	53%	0.527	35%	0.347	S	S	.	.	H	α-helix	trans	-55.6	-40.6	173.9	-75.5	174.7	176.3	170.3	-0.4	112.2	I2026 I2891 Q2892 L2897 E2898 T2899	I2026-R2895 HydrophobicContact CD1-CB 4.31Å; I2026-R2895 HydrophobicContact CD1-CG 3.74Å; I2891-R2895 HydrophobicContact CG2-CG 4.45Å; I2891-R2895 WeakPolarHBondContact O-CB 3.39Å; I2891-R2895 VanDerWaalsContact O-CG 3.29Å; I2891-R2895 WeakPolarHBondContact O-CG 3.29Å; I2891-R2895 PolarHBondContact O-N 3.22Å; Q2892-R2895 PolarHBondContact O-N 2.92Å; R2895-L2897 VanDerWaalsContact C-N 3.33Å; R2895-L2897 PolarHBondContact O-N 2.82Å; R2895-E2898 WeakPolarHBondContact CA-OE2 3.37Å; R2895-E2898 PolarHBondContact O-N 3.2Å; R2895-T2899 WeakPolarHBondContact O-CB 3.31Å; R2895-T2899 WeakPolarHBondContact O-CG2 3.45Å; R2895-T2899 PolarHBondContact O-N 3.26Å; R2895-T2899 PolarHBondContact O-OG1 2.97Å
2896	K	87.4	Confident	84.2	Confident	139.75 Å²	139.75	68.7 Å²	68.7	61%	0.608	35%	0.345	S	S	*	.	H	α-helix	trans	-61	-45.3	175.2	-174.3	178.3	179	179.8	0	111.8	Q2892 S2893 A2894 T2899 Q2900	Q2892-K2896 WeakPolarHBondContact O-CB 3.36Å; Q2892-K2896 PolarHBondContact O-N 3.12Å; Q2892-K2896 VanDerWaalsContact O-N 3.11Å; S2893-K2896 WeakPolarHBondContact O-CB 3.39Å; S2893-K2896 PolarHBondContact O-N 3.14Å; A2894-K2896 VanDerWaalsContact C-N 3.29Å; A2894-K2896 PolarHBondContact O-N 3.2Å; K2896-T2899 WeakPolarHBondContact CA-OG1 3.42Å; K2896-T2899 PolarHBondContact O-N 3.17Å; K2896-T2899 PolarHBondContact O-OG1 2.95Å; K2896-Q2900 WeakPolarHBondContact O-CG 3.18Å; K2896-Q2900 PolarHBondContact O-N 3.03Å
2897	L	86.3	Confident	85.1	Confident	14.5 Å²	14.5	68 Å²	68	8%	0.076	34%	0.343	C	S	.	.	H	α-helix	trans	-66.9	-39.2	177	-87.5	149.9	0	0	0	112.3	L2832 Y2835 L2836 S2893 A2894 R2895 T2899 Q2900 I2901	L2832-L2897 HydrophobicContact CB-CD1 4.1Å; L2832-L2897 HydrophobicContact CD2-CD1 3.81Å; L2832-L2897 HydrophobicContact CD2-CD2 4.41Å; L2832-L2897 HydrophobicContact CG-CD1 4.44Å; Y2835-L2897 HydrophobicContact CD1-CD1 3.81Å; Y2835-L2897 HydrophobicContact CD1-CD2 3.63Å; Y2835-L2897 VanDerWaalsContact CD1-CD2 3.5Å; Y2835-L2897 HydrophobicContact CD1-CG 4.32Å; Y2835-L2897 HydrophobicContact CE1-CD1 3.85Å; Y2835-L2897 HydrophobicContact CE1-CD2 3.99Å; Y2835-L2897 HydrophobicContact CE1-CG 4.47Å; Y2835-L2897 HydrophobicContact CG-CD2 4.44Å; L2836-L2897 VanDerWaalsContact CA-CD2 3.47Å; L2836-L2897 HydrophobicContact CB-CB 4.31Å; L2836-L2897 HydrophobicContact CB-CD1 4.12Å; L2836-L2897 HydrophobicContact CB-CD2 3.52Å; L2836-L2897 HydrophobicContact CB-CG 4.03Å; L2836-L2897 HydrophobicContact CD1-CB 4.15Å; L2836-L2897 HydrophobicContact CD1-CD1 4.06Å; L2836-L2897 HydrophobicContact CD1-CD2 3.84Å; L2836-L2897 HydrophobicContact CD1-CG 4.17Å; L2836-L2897 HydrophobicContact CG-CD2 4.24Å; S2893-L2897 WeakPolarHBondContact O-CG 3.25Å; S2893-L2897 PolarHBondContact O-N 3.17Å; S2893-L2897 VanDerWaalsContact O-N 3.08Å; A2894-L2897 WeakPolarHBondContact O-CB 3.32Å; A2894-L2897 PolarHBondContact O-N 3.26Å; R2895-L2897 VanDerWaalsContact C-N 3.33Å; R2895-L2897 PolarHBondContact O-N 2.82Å; L2897-T2899 PolarHBondContact O-N 3.25Å; L2897-Q2900 PolarHBondContact O-N 3.09Å; L2897-I2901 HydrophobicContact CG-CD1 4.33Å; L2897-I2901 WeakPolarHBondContact O-CB 3.24Å; L2897-I2901 WeakPolarHBondContact O-CD1 3.39Å; L2897-I2901 VanDerWaalsContact O-CG1 3.27Å; L2897-I2901 WeakPolarHBondContact O-CG1 3.35Å; L2897-I2901 PolarHBondContact O-N 3.24Å
2898	E	87.1	Confident	85.8	Confident	64 Å²	64	65.5 Å²	65.5	30%	0.299	33%	0.33	S	S	.	.	H	α-helix	trans	-60.7	-43.1	173.9	-72	177.4	166.2	0	0	112.2	G2023 I2026 L2836 A2894 R2895 Q2900 I2901 N2902	G2023-E2898 WeakPolarHBondContact CA-OE1 3.46Å; G2023-E2898 PolarHBondContact N-OE1 3.02Å; G2023-E2898 VanDerWaalsContact N-OE1 3.16Å; G2023-E2898 PolarHBondContact N-OE2 2.99Å; I2026-E2898 HydrophobicContact CD1-CG 3.97Å; I2026-E2898 VanDerWaalsContact CD1-OE1 3.24Å; I2026-E2898 WeakPolarHBondContact CD1-OE1 3.41Å; I2026-E2898 WeakPolarHBondContact CG1-OE1 3.38Å; L2836-E2898 HydrophobicContact CD2-CG 3.86Å; A2894-E2898 WeakPolarHBondContact O-CG 3.36Å; A2894-E2898 PolarHBondContact O-N 3Å; R2895-E2898 WeakPolarHBondContact CA-OE2 3.37Å; R2895-E2898 PolarHBondContact O-N 3.2Å; E2898-Q2900 VanDerWaalsContact C-N 3.32Å; E2898-Q2900 PolarHBondContact O-N 3.1Å; E2898-I2901 PolarHBondContact O-N 3.3Å; E2898-N2902 WeakPolarHBondContact O-CB 3.43Å; E2898-N2902 VanDerWaalsContact O-CG 3.26Å; E2898-N2902 PolarHBondContact O-N 3.03Å; E2898-N2902 PolarHBondContact O-ND2 3.07Å; E2898-N2902 VanDerWaalsContact O-ND2 3.15Å
2899	T	88.4	Confident	86.3	Confident	68.5 Å²	68.5	66 Å²	66	42%	0.42	33%	0.329	S	S	.	.	H	α-helix	trans	-62.7	-38.8	175.8	58.1	0	0	0	0	112.4	R2895 K2896 L2897 N2902 Q2903	R2895-T2899 WeakPolarHBondContact O-CB 3.31Å; R2895-T2899 WeakPolarHBondContact O-CG2 3.45Å; R2895-T2899 PolarHBondContact O-N 3.26Å; R2895-T2899 PolarHBondContact O-OG1 2.97Å; K2896-T2899 WeakPolarHBondContact CA-OG1 3.42Å; K2896-T2899 PolarHBondContact O-N 3.17Å; K2896-T2899 PolarHBondContact O-OG1 2.95Å; L2897-T2899 PolarHBondContact O-N 3.25Å; T2899-N2902 PolarHBondContact O-N 3.21Å; T2899-Q2903 WeakPolarHBondContact O-CB 3.42Å; T2899-Q2903 VanDerWaalsContact O-CG 3.26Å; T2899-Q2903 WeakPolarHBondContact O-CG 3.18Å; T2899-Q2903 PolarHBondContact O-N 3.04Å
2900	Q	90	Very high	86.6	Confident	79.5 Å²	79.5	64.6 Å²	64.6	37%	0.371	32%	0.322	S	S	.	.	H	α-helix	trans	-65.2	-43.5	174.1	-69.2	179.6	-44	0	0	112	L2832 K2896 L2897 E2898 N2902 Q2903 L2904	L2832-Q2900 HydrophobicContact CD1-CB 4.26Å; K2896-Q2900 WeakPolarHBondContact O-CG 3.18Å; K2896-Q2900 PolarHBondContact O-N 3.03Å; L2897-Q2900 PolarHBondContact O-N 3.09Å; E2898-Q2900 VanDerWaalsContact C-N 3.32Å; E2898-Q2900 PolarHBondContact O-N 3.1Å; Q2900-N2902 VanDerWaalsContact C-N 3.31Å; Q2900-N2902 PolarHBondContact O-N 3.15Å; Q2900-Q2903 PolarHBondContact O-N 3.34Å; Q2900-L2904 VanDerWaalsContact O-CB 3.32Å; Q2900-L2904 WeakPolarHBondContact O-CB 3.36Å; Q2900-L2904 PolarHBondContact O-N 3.07Å
2901	I	89.1	Confident	87	Confident	5.75 Å²	5.75	65.3 Å²	65.3	3%	0.029	32%	0.324	C	S	.	.	H	α-helix	trans	-60.9	-40.9	175.5	-70.4	162.5	0	0	0	110.8	Q2829 L2832 E2833 L2836 L2897 E2898 L2904 K2905	Q2829-I2901 HydrophobicContact CG-CG2 4.46Å; L2832-I2901 HydrophobicContact CB-CD1 4.14Å; L2832-I2901 HydrophobicContact CB-CG1 3.65Å; L2832-I2901 HydrophobicContact CD1-CG1 4.4Å; E2833-I2901 HydrophobicContact CG-CD1 3.94Å; E2833-I2901 HydrophobicContact CG-CG1 4.31Å; E2833-I2901 HydrophobicContact CG-CG2 4.13Å; L2836-I2901 HydrophobicContact CB-CD1 4.33Å; L2836-I2901 HydrophobicContact CD2-CD1 3.87Å; L2897-I2901 HydrophobicContact CG-CD1 4.33Å; L2897-I2901 WeakPolarHBondContact O-CB 3.24Å; L2897-I2901 WeakPolarHBondContact O-CD1 3.39Å; L2897-I2901 VanDerWaalsContact O-CG1 3.27Å; L2897-I2901 WeakPolarHBondContact O-CG1 3.35Å; L2897-I2901 PolarHBondContact O-N 3.24Å; E2898-I2901 PolarHBondContact O-N 3.3Å; I2901-L2904 PolarHBondContact O-N 2.98Å; I2901-K2905 HydrophobicContact CG2-CD 3.94Å; I2901-K2905 VanDerWaalsContact CG2-CE 3.46Å; I2901-K2905 HydrophobicContact CG2-CG 4.48Å; I2901-K2905 VanDerWaalsContact CG2-NZ 3.29Å; I2901-K2905 WeakPolarHBondContact O-CB 3.39Å; I2901-K2905 VanDerWaalsContact O-CG 3.29Å; I2901-K2905 WeakPolarHBondContact O-CG 3.36Å; I2901-K2905 PolarHBondContact O-N 2.99Å
2902	N	86.6	Confident	87.4	Confident	75.25 Å²	75.25	63.8 Å²	63.8	40%	0.402	32%	0.317	S	S	.	.	H	α-helix	trans	-72.6	-38.2	-179.6	-69.3	-20.4	0	0	0	112.6	E2898 T2899 Q2900 L2904 K2905 S2906 S3327	E2898-N2902 WeakPolarHBondContact O-CB 3.43Å; E2898-N2902 VanDerWaalsContact O-CG 3.26Å; E2898-N2902 PolarHBondContact O-N 3.03Å; E2898-N2902 PolarHBondContact O-ND2 3.07Å; E2898-N2902 VanDerWaalsContact O-ND2 3.15Å; T2899-N2902 PolarHBondContact O-N 3.21Å; Q2900-N2902 VanDerWaalsContact C-N 3.31Å; Q2900-N2902 PolarHBondContact O-N 3.15Å; N2902-L2904 VanDerWaalsContact C-N 3.32Å; N2902-L2904 PolarHBondContact O-N 2.98Å; N2902-K2905 PolarHBondContact O-N 3.12Å; N2902-S2906 WeakPolarHBondContact O-CB 3.48Å; N2902-S2906 PolarHBondContact O-N 3.18Å; N2902-S3327 PolarHBondContact ND2-OG 2.74Å
2903	Q	90.1	Very high	87.5	Confident	124.5 Å²	124.5	58.8 Å²	58.8	58%	0.582	30%	0.301	S	S	*	.	H	α-helix	trans	-58.9	-44.7	169.4	-73.8	168.7	1.8	0	0	111.3	T2899 Q2900 S2906 H2907	T2899-Q2903 WeakPolarHBondContact O-CB 3.42Å; T2899-Q2903 VanDerWaalsContact O-CG 3.26Å; T2899-Q2903 WeakPolarHBondContact O-CG 3.18Å; T2899-Q2903 PolarHBondContact O-N 3.04Å; Q2900-Q2903 PolarHBondContact O-N 3.34Å; Q2903-S2906 WeakPolarHBondContact O-CB 3.37Å; Q2903-S2906 PolarHBondContact O-N 3.06Å; Q2903-H2907 PolarHBondContact O-N 3.09Å; Q2903-H2907 VanDerWaalsContact O-N 3.11Å
2904	L	90.2	Very high	87.6	Confident	17.5 Å²	17.5	58.3 Å²	58.3	9%	0.092	29%	0.294	C	S	.	.	H	α-helix	trans	-67.4	-40.5	179.4	-164	65.1	0	0	0	112.4	L2825 E2828 Q2829 L2832 Q2900 I2901 N2902 S2906 H2907 I2908	L2825-L2904 HydrophobicContact CB-CD1 4.14Å; L2825-L2904 HydrophobicContact CD2-CD1 3.7Å; L2825-L2904 HydrophobicContact CD2-CG 4.24Å; L2825-L2904 HydrophobicContact CG-CD1 4.27Å; L2825-L2904 VanDerWaalsContact O-CD2 3.26Å; L2825-L2904 WeakPolarHBondContact O-CD2 3.33Å; E2828-L2904 HydrophobicContact CB-CD2 3.96Å; E2828-L2904 HydrophobicContact CG-CD1 4.42Å; E2828-L2904 HydrophobicContact CG-CD2 3.78Å; Q2829-L2904 HydrophobicContact CB-CD2 3.87Å; Q2829-L2904 HydrophobicContact CB-CG 4.29Å; Q2829-L2904 VanDerWaalsContact N-CD2 3.3Å; L2832-L2904 HydrophobicContact CD1-CD2 4.05Å; Q2900-L2904 VanDerWaalsContact O-CB 3.32Å; Q2900-L2904 WeakPolarHBondContact O-CB 3.36Å; Q2900-L2904 PolarHBondContact O-N 3.07Å; I2901-L2904 PolarHBondContact O-N 2.98Å; N2902-L2904 VanDerWaalsContact C-N 3.32Å; N2902-L2904 PolarHBondContact O-N 2.98Å; L2904-S2906 VanDerWaalsContact C-N 3.34Å; L2904-S2906 PolarHBondContact O-N 3.08Å; L2904-H2907 PolarHBondContact O-N 3.34Å; L2904-I2908 HydrophobicContact CD1-CD1 4.47Å; L2904-I2908 HydrophobicContact CG-CD1 4.24Å; L2904-I2908 VanDerWaalsContact O-CG1 3.3Å; L2904-I2908 WeakPolarHBondContact O-CG1 3.34Å; L2904-I2908 PolarHBondContact O-N 3.18Å
2905	K	89	Confident	87.8	Confident	65.75 Å²	65.75	58 Å²	58	29%	0.286	29%	0.291	S	S	.	.	H	α-helix	trans	-58.9	-43.6	172.1	-77.2	168	179.7	167.3	0	111.8	Q2829 E2833 I2901 N2902 H2907 I2908 I2909 N3492	Q2829-K2905 HydrophobicContact CG-CG 4.41Å; Q2829-K2905 VanDerWaalsContact NE2-CE 3.3Å; E2833-K2905 WeakPolarHBondContact OE1-CE 3.45Å; E2833-K2905 IonicContact OE1-NZ 3.53Å; E2833-K2905 PolarHBondContact OE1-NZ 3.12Å; I2901-K2905 HydrophobicContact CG2-CD 3.94Å; I2901-K2905 VanDerWaalsContact CG2-CE 3.46Å; I2901-K2905 HydrophobicContact CG2-CG 4.48Å; I2901-K2905 VanDerWaalsContact CG2-NZ 3.29Å; I2901-K2905 WeakPolarHBondContact O-CB 3.39Å; I2901-K2905 VanDerWaalsContact O-CG 3.29Å; I2901-K2905 WeakPolarHBondContact O-CG 3.36Å; I2901-K2905 PolarHBondContact O-N 2.99Å; N2902-K2905 PolarHBondContact O-N 3.12Å; K2905-H2907 VanDerWaalsContact C-N 3.35Å; K2905-H2907 PolarHBondContact O-N 3.27Å; K2905-I2908 PolarHBondContact O-N 3.1Å; K2905-I2909 WeakPolarHBondContact O-CD1 3.4Å; K2905-I2909 VanDerWaalsContact O-CG1 3.29Å; K2905-I2909 WeakPolarHBondContact O-CG1 3.42Å; K2905-I2909 PolarHBondContact O-N 2.97Å; K2905-N3492 PolarHBondContact NZ-OD1 3.45Å
2906	S	86	Confident	87.9	Confident	73 Å²	73	53.5 Å²	53.5	51%	0.51	28%	0.281	S	S	.	.	H	α-helix	trans	-59.1	-46.1	175	-172.5	0	0	0	0	111.8	N2902 Q2903 L2904 I2908 I2909 D2910	N2902-S2906 WeakPolarHBondContact O-CB 3.48Å; N2902-S2906 PolarHBondContact O-N 3.18Å; Q2903-S2906 WeakPolarHBondContact O-CB 3.37Å; Q2903-S2906 PolarHBondContact O-N 3.06Å; L2904-S2906 VanDerWaalsContact C-N 3.34Å; L2904-S2906 PolarHBondContact O-N 3.08Å; S2906-I2908 PolarHBondContact O-N 3.11Å; S2906-I2909 WeakPolarHBondContact O-CB 3.38Å; S2906-I2909 PolarHBondContact O-N 3.09Å; S2906-D2910 PolarHBondContact O-N 3.06Å
2907	H	90.8	Very high	87.6	Confident	91.75 Å²	91.75	49.6 Å²	49.6	43%	0.425	27%	0.265	S	S	.	.	H	α-helix	trans	-63.8	-38.6	176.8	-173	-165.1	0	0	0	112.9	Q2903 L2904 K2905 I2909 D2910 L2911	Q2903-H2907 PolarHBondContact O-N 3.09Å; Q2903-H2907 VanDerWaalsContact O-N 3.11Å; L2904-H2907 PolarHBondContact O-N 3.34Å; K2905-H2907 VanDerWaalsContact C-N 3.35Å; K2905-H2907 PolarHBondContact O-N 3.27Å; H2907-I2909 VanDerWaalsContact C-N 3.35Å; H2907-D2910 PolarHBondContact O-N 2.93Å; H2907-L2911 VanDerWaalsContact NE2-CD1 3.35Å; H2907-L2911 WeakPolarHBondContact NE2-CD1 3.1Å; H2907-L2911 VanDerWaalsContact O-CB 3.28Å; H2907-L2911 WeakPolarHBondContact O-CB 3.39Å; H2907-L2911 PolarHBondContact O-N 2.98Å
2908	I	90.3	Very high	87.5	Confident	7.75 Å²	7.75	49.9 Å²	49.9	4%	0.04	27%	0.265	C	S	.	.	H	α-helix	trans	-62.5	-42.1	174.1	-72.7	165.1	0	0	0	111.2	L2259 L2822 L2825 I2826 Q2829 L2904 K2905 S2906 N2912	L2259-I2908 HydrophobicContact CD1-CG2 4.43Å; L2259-I2908 HydrophobicContact CD2-CG2 4.43Å; L2822-I2908 HydrophobicContact CD1-CB 4.37Å; L2822-I2908 HydrophobicContact CD1-CG1 4.41Å; L2822-I2908 HydrophobicContact CD1-CG2 3.96Å; L2825-I2908 HydrophobicContact CB-CD1 4.08Å; L2825-I2908 HydrophobicContact CB-CG1 3.69Å; L2825-I2908 HydrophobicContact CD1-CG1 4.39Å; I2826-I2908 HydrophobicContact CG1-CD1 4.12Å; I2826-I2908 HydrophobicContact CG1-CG1 4.48Å; I2826-I2908 HydrophobicContact CG1-CG2 4.37Å; Q2829-I2908 HydrophobicContact CB-CD1 4.18Å; Q2829-I2908 VanDerWaalsContact OE1-CD1 3.27Å; L2904-I2908 HydrophobicContact CD1-CD1 4.47Å; L2904-I2908 HydrophobicContact CG-CD1 4.24Å; L2904-I2908 VanDerWaalsContact O-CG1 3.3Å; L2904-I2908 WeakPolarHBondContact O-CG1 3.34Å; L2904-I2908 PolarHBondContact O-N 3.18Å; K2905-I2908 PolarHBondContact O-N 3.1Å; S2906-I2908 PolarHBondContact O-N 3.11Å; I2908-N2912 WeakPolarHBondContact O-CB 3.26Å; I2908-N2912 PolarHBondContact O-N 2.94Å
2909	I	87.5	Confident	87.3	Confident	79.25 Å²	79.25	48.1 Å²	48.1	41%	0.406	26%	0.258	S	S	.	.	H	α-helix	trans	-62.2	-49.6	176	-69	162.9	0	0	0	110.7	K2905 S2906 H2907 L2911 N2912 G2913 Y3496	K2905-I2909 WeakPolarHBondContact O-CD1 3.4Å; K2905-I2909 VanDerWaalsContact O-CG1 3.29Å; K2905-I2909 WeakPolarHBondContact O-CG1 3.42Å; K2905-I2909 PolarHBondContact O-N 2.97Å; S2906-I2909 WeakPolarHBondContact O-CB 3.38Å; S2906-I2909 PolarHBondContact O-N 3.09Å; H2907-I2909 VanDerWaalsContact C-N 3.35Å; I2909-L2911 PolarHBondContact O-N 3.45Å; I2909-N2912 PolarHBondContact O-N 2.9Å; I2909-G2913 PolarHBondContact O-N 2.92Å; I2909-Y3496 HydrophobicContact CG2-CE2 4.41Å
2910	D	85.5	Confident	86.9	Confident	59 Å²	59	46.1 Å²	46.1	32%	0.316	25%	0.25	S	S	.	.	H	α-helix	trans	-64.4	-43.9	-177.8	-119.5	22.3	0	0	0	112.4	K2792 K2795 S2906 H2907 G2913 I2914	K2792-D2910 IonicContact NZ-OD1 3.64Å; K2792-D2910 PolarHBondContact NZ-OD1 2.95Å; K2792-D2910 IonicContact NZ-OD2 3.12Å; K2792-D2910 PolarHBondContact NZ-OD2 2.95Å; K2795-D2910 IonicContact NZ-OD1 3.15Å; K2795-D2910 PolarHBondContact NZ-OD1 3.21Å; K2795-D2910 IonicContact NZ-OD2 3.4Å; K2795-D2910 PolarHBondContact NZ-OD2 3.1Å; S2906-D2910 PolarHBondContact O-N 3.06Å; H2907-D2910 PolarHBondContact O-N 2.93Å; D2910-G2913 PolarHBondContact O-N 3.11Å; D2910-I2914 WeakPolarHBondContact O-CG1 3.41Å; D2910-I2914 PolarHBondContact O-N 3.04Å; D2910-I2914 VanDerWaalsContact O-N 3.15Å
2911	L	88.5	Confident	86.5	Confident	23.75 Å²	23.75	43.8 Å²	43.8	12%	0.124	24%	0.24	C	C	.	.	H	α-helix	trans	-71.7	-34.3	178.8	-148.2	152.1	0	0	0	112.3	D2818 T2821 L2822 L2825 H2907 I2909 G2913 I2914 L2915	D2818-L2911 HydrophobicContact CB-CD2 4.25Å; D2818-L2911 WeakPolarHBondContact O-CD2 3.23Å; T2821-L2911 HydrophobicContact CG2-CD1 3.92Å; L2822-L2911 HydrophobicContact CB-CD2 3.76Å; L2822-L2911 HydrophobicContact CD1-CB 4.21Å; L2822-L2911 HydrophobicContact CD1-CD2 3.96Å; L2822-L2911 HydrophobicContact CD2-CD2 4.34Å; L2822-L2911 HydrophobicContact CG-CD2 4.28Å; L2825-L2911 HydrophobicContact CD1-CD1 3.75Å; H2907-L2911 VanDerWaalsContact NE2-CD1 3.35Å; H2907-L2911 WeakPolarHBondContact NE2-CD1 3.1Å; H2907-L2911 VanDerWaalsContact O-CB 3.28Å; H2907-L2911 WeakPolarHBondContact O-CB 3.39Å; H2907-L2911 PolarHBondContact O-N 2.98Å; I2909-L2911 PolarHBondContact O-N 3.45Å; L2911-G2913 VanDerWaalsContact C-N 3.31Å; L2911-G2913 PolarHBondContact O-N 2.99Å; L2911-I2914 HydrophobicContact CD2-CD1 4.43Å; L2911-I2914 PolarHBondContact O-N 3.06Å; L2911-L2915 WeakPolarHBondContact O-CB 3.35Å; L2911-L2915 PolarHBondContact O-N 3.14Å
2912	N	89.5	Confident	86.2	Confident	20.75 Å²	20.75	44.5 Å²	44.5	11%	0.111	24%	0.242	C	C	.	.	H	α-helix	trans	-66.6	-33.4	171.9	-172.8	55.5	0	0	0	112.2	S2258 L2259 N2262 L2822 I2908 I2909 L2915 S2916	S2258-N2912 PolarHBondContact OG-ND2 3.26Å; L2259-N2912 WeakPolarHBondContact CA-OD1 3.34Å; L2259-N2912 HydrophobicContact CD1-CB 3.99Å; L2259-N2912 PolarHBondContact N-ND2 3.26Å; N2262-N2912 PolarHBondContact ND2-O 3.21Å; N2262-N2912 PolarHBondContact ND2-OD1 2.99Å; L2822-N2912 HydrophobicContact CD1-CB 4.38Å; L2822-N2912 HydrophobicContact CD2-CB 4.01Å; I2908-N2912 WeakPolarHBondContact O-CB 3.26Å; I2908-N2912 PolarHBondContact O-N 2.94Å; I2909-N2912 PolarHBondContact O-N 2.9Å; N2912-L2915 PolarHBondContact O-N 3.22Å; N2912-S2916 WeakPolarHBondContact O-CB 3.35Å; N2912-S2916 PolarHBondContact O-N 2.98Å; N2912-S2916 PolarHBondContact O-OG 3.14Å
2913	G	85.1	Confident	86	Confident	27 Å²	27	42.6 Å²	42.6	28%	0.278	23%	0.231	S	C	.	.	H	α-helix	trans	-62.3	-48	171.4	0	0	0	0	0	112.3	I2909 D2910 L2911 L2915 S2916 Q2917	I2909-G2913 PolarHBondContact O-N 2.92Å; D2910-G2913 PolarHBondContact O-N 3.11Å; L2911-G2913 VanDerWaalsContact C-N 3.31Å; L2911-G2913 PolarHBondContact O-N 2.99Å; G2913-L2915 VanDerWaalsContact C-N 3.33Å; G2913-L2915 PolarHBondContact O-N 3.14Å; G2913-S2916 WeakPolarHBondContact O-CB 3.33Å; G2913-S2916 PolarHBondContact O-N 3.06Å; G2913-Q2917 VanDerWaalsContact O-CD 3.3Å; G2913-Q2917 VanDerWaalsContact O-CG 3.3Å; G2913-Q2917 WeakPolarHBondContact O-CG 3.3Å; G2913-Q2917 PolarHBondContact O-N 3.21Å; G2913-Q2917 VanDerWaalsContact O-N 3.14Å; G2913-Q2917 PolarHBondContact O-NE2 3.08Å
2914	I	84.6	Confident	85.4	Confident	37.25 Å²	37.25	40.6 Å²	40.6	19%	0.191	22%	0.221	C	C	.	.	H	α-helix	trans	-59.2	-44.4	175	-68.6	169.1	0	0	0	111.3	F2803 D2818 D2910 L2911 Q2917 R2918	F2803-I2914 HydrophobicContact CZ-CG2 4.19Å; D2818-I2914 WeakPolarHBondContact OD2-CG2 3.19Å; D2910-I2914 WeakPolarHBondContact O-CG1 3.41Å; D2910-I2914 PolarHBondContact O-N 3.04Å; D2910-I2914 VanDerWaalsContact O-N 3.15Å; L2911-I2914 HydrophobicContact CD2-CD1 4.43Å; L2911-I2914 PolarHBondContact O-N 3.06Å; I2914-Q2917 PolarHBondContact O-N 3.07Å; I2914-R2918 WeakPolarHBondContact O-CB 3.15Å; I2914-R2918 PolarHBondContact O-N 3.1Å; I2914-R2918 VanDerWaalsContact O-N 3.1Å
2915	L	88	Confident	84.9	Confident	4.25 Å²	4.25	41.3 Å²	41.3	2%	0.022	23%	0.225	C	C	.	.	H	α-helix	trans	-62.8	-43.3	177.4	177.7	58.7	0	0	0	111.9	N2262 I2815 D2818 Q2819 L2822 L2911 N2912 G2913 Q2917 R2918 L2919	N2262-L2915 HydrophobicContact CB-CD2 3.87Å; N2262-L2915 HydrophobicContact CB-CG 4.17Å; I2815-L2915 HydrophobicContact CB-CD1 4.48Å; I2815-L2915 HydrophobicContact CG1-CD1 4.49Å; I2815-L2915 HydrophobicContact CG2-CD1 4.09Å; D2818-L2915 HydrophobicContact CB-CB 4.48Å; D2818-L2915 HydrophobicContact CB-CD1 4.14Å; Q2819-L2915 HydrophobicContact CG-CD1 4.17Å; Q2819-L2915 HydrophobicContact CG-CD2 3.95Å; L2822-L2915 HydrophobicContact CD2-CD2 3.75Å; L2911-L2915 WeakPolarHBondContact O-CB 3.35Å; L2911-L2915 PolarHBondContact O-N 3.14Å; N2912-L2915 PolarHBondContact O-N 3.22Å; G2913-L2915 VanDerWaalsContact C-N 3.33Å; G2913-L2915 PolarHBondContact O-N 3.14Å; L2915-Q2917 PolarHBondContact O-N 2.94Å; L2915-R2918 PolarHBondContact O-N 3.03Å; L2915-L2919 WeakPolarHBondContact O-CB 3.44Å; L2915-L2919 PolarHBondContact O-N 3.16Å
2916	S	85.3	Confident	84.5	Confident	44.75 Å²	44.75	39.8 Å²	39.8	31%	0.313	22%	0.219	S	C	.	.	H	α-helix	trans	-58.6	-47.6	176.6	-60.2	0	0	0	0	111.8	S2258 N2262 N2912 G2913 R2918 L2919 G2920	S2258-S2916 PolarHBondContact OG-OG 3.11Å; S2258-S2916 VanDerWaalsContact OG-OG 3.05Å; N2262-S2916 PolarHBondContact ND2-OG 3.18Å; N2912-S2916 WeakPolarHBondContact O-CB 3.35Å; N2912-S2916 PolarHBondContact O-N 2.98Å; N2912-S2916 PolarHBondContact O-OG 3.14Å; G2913-S2916 WeakPolarHBondContact O-CB 3.33Å; G2913-S2916 PolarHBondContact O-N 3.06Å; S2916-R2918 VanDerWaalsContact C-N 3.33Å; S2916-R2918 PolarHBondContact O-N 3.2Å; S2916-L2919 WeakPolarHBondContact O-CB 3.38Å; S2916-L2919 PolarHBondContact O-N 3.15Å; S2916-G2920 PolarHBondContact O-N 3.07Å
2917	Q	81.5	Confident	84	Confident	58 Å²	58	37.2 Å²	37.2	27%	0.271	20%	0.199	S	C	.	.	H	α-helix	trans	-60.7	-44.7	178.4	-67	162.8	7.4	0	0	111.4	L2796 N2799 F2803 G2913 I2914 L2915 L2919 G2920 H2921	L2796-Q2917 HydrophobicContact CD1-CG 3.86Å; L2796-Q2917 VanDerWaalsContact CD1-NE2 3.33Å; N2799-Q2917 VanDerWaalsContact CB-OE1 3.3Å; N2799-Q2917 PolarHBondContact ND2-OE1 3.18Å; F2803-Q2917 HydrophobicContact CD2-CB 4.33Å; F2803-Q2917 HydrophobicContact CE2-CB 3.76Å; G2913-Q2917 VanDerWaalsContact O-CD 3.3Å; G2913-Q2917 VanDerWaalsContact O-CG 3.3Å; G2913-Q2917 WeakPolarHBondContact O-CG 3.3Å; G2913-Q2917 PolarHBondContact O-N 3.21Å; G2913-Q2917 VanDerWaalsContact O-N 3.14Å; G2913-Q2917 PolarHBondContact O-NE2 3.08Å; I2914-Q2917 PolarHBondContact O-N 3.07Å; L2915-Q2917 PolarHBondContact O-N 2.94Å; Q2917-L2919 VanDerWaalsContact C-N 3.33Å; Q2917-L2919 PolarHBondContact O-N 3.07Å; Q2917-G2920 PolarHBondContact O-N 3.22Å; Q2917-H2921 PolarHBondContact O-N 3.03Å; Q2917-H2921 VanDerWaalsContact O-N 3.1Å
2918	R	84	Confident	83.3	Confident	21.25 Å²	21.25	36 Å²	36	8%	0.08	19%	0.194	C	C	.	.	H	α-helix	trans	-68.2	-33.6	179	-161.4	179.7	-54.7	144.8	13.4	112.6	F2803 V2811 A2814 I2815 D2818 I2914 L2915 S2916 H2921 Y2922	F2803-R2918 HydrophobicContact CD1-CG 4.26Å; F2803-R2918 HydrophobicContact CD2-CB 4.34Å; F2803-R2918 HydrophobicContact CD2-CG 4.42Å; F2803-R2918 HydrophobicContact CE1-CB 4.37Å; F2803-R2918 HydrophobicContact CE1-CG 4.33Å; F2803-R2918 HydrophobicContact CE2-CB 4.06Å; F2803-R2918 HydrophobicContact CE2-CG 4.4Å; F2803-R2918 HydrophobicContact CG-CG 4.4Å; F2803-R2918 HydrophobicContact CZ-CB 4.11Å; F2803-R2918 HydrophobicContact CZ-CG 4.24Å; V2811-R2918 HydrophobicContact CG1-CG 4.04Å; A2814-R2918 VanDerWaalsContact CB-NH1 3.31Å; A2814-R2918 PolarHBondContact O-NH1 3.06Å; I2815-R2918 HydrophobicContact CD1-CG 4.39Å; I2815-R2918 HydrophobicContact CG1-CB 4.34Å; I2815-R2918 HydrophobicContact CG1-CG 3.93Å; D2818-R2918 IonicContact OD1-CZ 3.2Å; D2818-R2918 IonicContact OD1-NH1 3.2Å; D2818-R2918 PolarHBondContact OD1-NH1 3.04Å; D2818-R2918 IonicContact OD1-NH2 3.45Å; D2818-R2918 IonicContact OD2-CZ 3.19Å; D2818-R2918 IonicContact OD2-NH1 3.56Å; D2818-R2918 PolarHBondContact OD2-NH1 3.25Å; D2818-R2918 IonicContact OD2-NH2 3.13Å; D2818-R2918 PolarHBondContact OD2-NH2 3.22Å; I2914-R2918 WeakPolarHBondContact O-CB 3.15Å; I2914-R2918 PolarHBondContact O-N 3.1Å; I2914-R2918 VanDerWaalsContact O-N 3.1Å; L2915-R2918 PolarHBondContact O-N 3.03Å; S2916-R2918 VanDerWaalsContact C-N 3.33Å; S2916-R2918 PolarHBondContact O-N 3.2Å; R2918-H2921 PolarHBondContact O-N 2.94Å; R2918-Y2922 PolarHBondContact O-N 3.28Å
2919	L	83.9	Confident	82.6	Confident	26.25 Å²	26.25	37.6 Å²	37.6	14%	0.137	20%	0.202	C	C	.	.	H	α-helix	trans	-66.2	-42.4	174.5	-159.2	73.3	0	0	0	111.6	A2267 I2815 L2915 S2916 Q2917 Y2922 Q2923	A2267-L2919 HydrophobicContact CB-CD1 3.92Å; A2267-L2919 HydrophobicContact CB-CD2 3.88Å; A2267-L2919 HydrophobicContact CB-CG 4.47Å; A2267-L2919 WeakPolarHBondContact O-CD1 3.4Å; I2815-L2919 HydrophobicContact CD1-CD1 4.19Å; I2815-L2919 HydrophobicContact CG1-CD1 4.44Å; I2815-L2919 HydrophobicContact CG2-CD1 4.13Å; L2915-L2919 WeakPolarHBondContact O-CB 3.44Å; L2915-L2919 PolarHBondContact O-N 3.16Å; S2916-L2919 WeakPolarHBondContact O-CB 3.38Å; S2916-L2919 PolarHBondContact O-N 3.15Å; Q2917-L2919 VanDerWaalsContact C-N 3.33Å; Q2917-L2919 PolarHBondContact O-N 3.07Å; L2919-Y2922 WeakPolarHBondContact O-CB 3.43Å; L2919-Y2922 PolarHBondContact O-N 3.21Å; L2919-Q2923 WeakPolarHBondContact O-CG 3.33Å; L2919-Q2923 PolarHBondContact O-N 3.04Å
2920	G	80.2	Confident	82.1	Confident	26 Å²	26	36.3 Å²	36.3	27%	0.268	19%	0.194	S	C	.	.	H	α-helix	trans	-60	-46	173	0	0	0	0	0	112.5	S2916 Q2917 Y2922 Q2923 Q2924	S2916-G2920 PolarHBondContact O-N 3.07Å; Q2917-G2920 PolarHBondContact O-N 3.22Å; G2920-Y2922 VanDerWaalsContact C-N 3.33Å; G2920-Y2922 PolarHBondContact O-N 3.1Å; G2920-Q2923 WeakPolarHBondContact O-CB 3.45Å; G2920-Q2923 PolarHBondContact O-N 3.22Å; G2920-Q2923 VanDerWaalsContact O-N 3.1Å; G2920-Q2924 PolarHBondContact O-N 3.29Å; G2920-Q2924 VanDerWaalsContact O-N 3.07Å
2921	H	80	Confident	81.5	Confident	32 Å²	32	35.4 Å²	35.4	15%	0.148	19%	0.186	C	C	.	.	H	α-helix	trans	-59.7	-41.4	174.8	-177.2	-111.8	0	0	0	112.5	F2803 Q2917 R2918 Q2923 Q2924 L2925	F2803-H2921 VanDerWaalsContact C-CE1 3.49Å; F2803-H2921 HydrophobicContact CB-CB 4.33Å; F2803-H2921 HydrophobicContact CD2-CB 4.49Å; F2803-H2921 PolarHBondContact O-CE1 3.25Å; F2803-H2921 PolarHBondContact O-ND1 3.15Å; Q2917-H2921 PolarHBondContact O-N 3.03Å; Q2917-H2921 VanDerWaalsContact O-N 3.1Å; R2918-H2921 PolarHBondContact O-N 2.94Å; H2921-Q2923 PolarHBondContact O-N 2.94Å; H2921-Q2924 PolarHBondContact O-N 3.07Å; H2921-L2925 WeakPolarHBondContact O-CB 3.45Å; H2921-L2925 WeakPolarHBondContact O-CG 3.42Å; H2921-L2925 PolarHBondContact O-N 2.94Å
2922	Y	83.9	Confident	80.7	Confident	19.25 Å²	19.25	41.3 Å²	41.3	8%	0.075	21%	0.207	C	C	.	.	H	α-helix	trans	-62	-42.2	174.9	179.2	-101.2	0	0	0	112.6	L2268 E2808 V2811 R2812 I2815 R2918 L2919 G2920 Q2924 L2925 Q2926	L2268-Y2922 HydrophobicContact CB-CE1 4.43Å; L2268-Y2922 HydrophobicContact CD2-CD1 4.04Å; L2268-Y2922 HydrophobicContact CD2-CE1 3.77Å; L2268-Y2922 HydrophobicContact CD2-CE2 4.36Å; L2268-Y2922 HydrophobicContact CD2-CG 4.32Å; L2268-Y2922 WeakPolarHBondContact O-CE1 3.47Å; E2808-Y2922 HydrophobicContact CG-CD2 4.38Å; E2808-Y2922 HydrophobicContact CG-CE2 4.17Å; V2811-Y2922 HydrophobicContact CG1-CD2 4.05Å; V2811-Y2922 HydrophobicContact CG1-CG 4.38Å; R2812-Y2922 HydrophobicContact CB-CE2 4.1Å; R2812-Y2922 HydrophobicContact CG-CD2 4.24Å; R2812-Y2922 HydrophobicContact CG-CE2 4.18Å; R2812-Y2922 PolarHBondContact NE-OH 3.48Å; R2812-Y2922 PolarHBondContact NH2-OH 2.87Å; I2815-Y2922 HydrophobicContact CD1-CD1 4.43Å; I2815-Y2922 HydrophobicContact CD1-CD2 4.4Å; I2815-Y2922 HydrophobicContact CD1-CG 4.04Å; R2918-Y2922 PolarHBondContact O-N 3.28Å; L2919-Y2922 WeakPolarHBondContact O-CB 3.43Å; L2919-Y2922 PolarHBondContact O-N 3.21Å; G2920-Y2922 VanDerWaalsContact C-N 3.33Å; G2920-Y2922 PolarHBondContact O-N 3.1Å; Y2922-Q2924 PolarHBondContact O-N 3.26Å; Y2922-L2925 PolarHBondContact O-N 3.09Å; Y2922-Q2926 HydrophobicContact CD1-CG 4.36Å; Y2922-Q2926 HydrophobicContact CE1-CG 4Å; Y2922-Q2926 HydrophobicContact CE2-CG 4.35Å; Y2922-Q2926 WeakPolarHBondContact O-CG 3.28Å; Y2922-Q2926 PolarHBondContact O-N 3.09Å; Y2922-Q2926 PolarHBondContact OH-NE2 3.24Å
2923	Q	81.2	Confident	80	Confident	35.5 Å²	35.5	46.1 Å²	46.1	17%	0.166	23%	0.228	C	C	.	.	H	α-helix	trans	-61	-44.8	174.8	-71.1	175.3	-12.3	0	0	111.6	L2919 G2920 H2921 L2925 Q2926 I2927	L2919-Q2923 WeakPolarHBondContact O-CG 3.33Å; L2919-Q2923 PolarHBondContact O-N 3.04Å; G2920-Q2923 WeakPolarHBondContact O-CB 3.45Å; G2920-Q2923 PolarHBondContact O-N 3.22Å; G2920-Q2923 VanDerWaalsContact O-N 3.1Å; H2921-Q2923 PolarHBondContact O-N 2.94Å; Q2923-L2925 VanDerWaalsContact C-N 3.28Å; Q2923-L2925 PolarHBondContact O-N 3.17Å; Q2923-Q2926 PolarHBondContact O-N 3.05Å; Q2923-I2927 WeakPolarHBondContact O-CD1 3.37Å; Q2923-I2927 WeakPolarHBondContact O-CG1 3.34Å; Q2923-I2927 PolarHBondContact O-N 3.16Å; Q2923-I2927 VanDerWaalsContact O-N 3.09Å
2924	Q	78.3	Confident	79.5	Confident	83.5 Å²	83.5	47.6 Å²	47.6	39%	0.39	23%	0.23	S	C	.	.	H	α-helix	trans	-60.8	-43.1	177.2	-163.4	-180	35	0	0	111.6	D2538 G2920 H2921 Y2922 Q2926 I2927 Q2928	D2538-Q2924 PolarHBondContact O-NE2 3.22Å; D2538-Q2924 VanDerWaalsContact O-NE2 3.11Å; G2920-Q2924 PolarHBondContact O-N 3.29Å; G2920-Q2924 VanDerWaalsContact O-N 3.07Å; H2921-Q2924 PolarHBondContact O-N 3.07Å; Y2922-Q2924 PolarHBondContact O-N 3.26Å; Q2924-Q2926 PolarHBondContact O-N 3.46Å; Q2924-I2927 PolarHBondContact O-N 3Å; Q2924-Q2928 WeakPolarHBondContact O-CG 3.42Å; Q2924-Q2928 PolarHBondContact O-N 3.01Å
2925	L	79.3	Confident	78.9	Confident	30.75 Å²	30.75	51 Å²	51	16%	0.161	24%	0.24	C	C	.	.	H	α-helix	trans	-61.4	-44	175.5	-120.3	121.7	0	0	0	112.3	E2808 V2811 H2921 Y2922 Q2923 I2927 Q2928 I2929	E2808-L2925 HydrophobicContact CB-CD2 3.68Å; E2808-L2925 HydrophobicContact CB-CG 4.47Å; E2808-L2925 HydrophobicContact CG-CD2 4.02Å; V2811-L2925 HydrophobicContact CG2-CD1 4.27Å; H2921-L2925 WeakPolarHBondContact O-CB 3.45Å; H2921-L2925 WeakPolarHBondContact O-CG 3.42Å; H2921-L2925 PolarHBondContact O-N 2.94Å; Y2922-L2925 PolarHBondContact O-N 3.09Å; Q2923-L2925 VanDerWaalsContact C-N 3.28Å; Q2923-L2925 PolarHBondContact O-N 3.17Å; L2925-I2927 VanDerWaalsContact C-N 3.3Å; L2925-I2927 PolarHBondContact O-N 3.11Å; L2925-Q2928 PolarHBondContact O-N 3.28Å; L2925-I2929 HydrophobicContact CD1-CD1 4.35Å; L2925-I2929 HydrophobicContact CG-CD1 4.22Å; L2925-I2929 WeakPolarHBondContact O-CB 3.47Å; L2925-I2929 WeakPolarHBondContact O-CD1 3.4Å; L2925-I2929 VanDerWaalsContact O-CG1 3.27Å; L2925-I2929 WeakPolarHBondContact O-CG1 3.39Å; L2925-I2929 PolarHBondContact O-N 3.05Å
2926	Q	81.6	Confident	78.1	Confident	34.5 Å²	34.5	57.7 Å²	57.7	16%	0.161	27%	0.269	C	S	.	.	H	α-helix	trans	-58.8	-42.8	175.9	-70.3	-60.6	-47.5	0	0	111.9	E2808 Y2922 Q2923 Q2924 Q2928 I2929 Q2930	E2808-Q2926 PolarHBondContact OE1-NE2 3.2Å; Y2922-Q2926 HydrophobicContact CD1-CG 4.36Å; Y2922-Q2926 HydrophobicContact CE1-CG 4Å; Y2922-Q2926 HydrophobicContact CE2-CG 4.35Å; Y2922-Q2926 WeakPolarHBondContact O-CG 3.28Å; Y2922-Q2926 PolarHBondContact O-N 3.09Å; Y2922-Q2926 PolarHBondContact OH-NE2 3.24Å; Q2923-Q2926 PolarHBondContact O-N 3.05Å; Q2924-Q2926 PolarHBondContact O-N 3.46Å; Q2926-Q2928 VanDerWaalsContact C-N 3.33Å; Q2926-Q2928 PolarHBondContact O-N 3.48Å; Q2926-I2929 PolarHBondContact O-N 3.05Å; Q2926-Q2930 WeakPolarHBondContact O-CG 3.42Å; Q2926-Q2930 PolarHBondContact O-N 3Å
2927	I	75.5	Confident	77.4	Confident	18.5 Å²	18.5	58.7 Å²	58.7	10%	0.095	28%	0.28	C	S	.	.	H	α-helix	trans	-71.2	-37.4	-179.3	-63	161.3	0	0	0	110.9	F2271 W2536 S2539 L2740 Q2923 Q2924 L2925 I2929 Q2930 R2931	F2271-I2927 HydrophobicContact CD2-CD1 3.78Å; F2271-I2927 HydrophobicContact CD2-CG1 4.25Å; F2271-I2927 HydrophobicContact CE2-CD1 4.01Å; W2536-I2927 HydrophobicContact CH2-CD1 4.46Å; W2536-I2927 HydrophobicContact CH2-CG2 4.4Å; W2536-I2927 HydrophobicContact CZ3-CD1 4.15Å; W2536-I2927 HydrophobicContact CZ3-CG1 4.47Å; W2536-I2927 HydrophobicContact CZ3-CG2 4.17Å; S2539-I2927 WeakPolarHBondContact O-CB 3.41Å; S2539-I2927 WeakPolarHBondContact O-CD1 3.38Å; S2539-I2927 VanDerWaalsContact O-CG2 3.24Å; S2539-I2927 WeakPolarHBondContact O-CG2 3.34Å; L2740-I2927 HydrophobicContact CD1-CG2 4.26Å; L2740-I2927 HydrophobicContact CD2-CG2 4.13Å; Q2923-I2927 WeakPolarHBondContact O-CD1 3.37Å; Q2923-I2927 WeakPolarHBondContact O-CG1 3.34Å; Q2923-I2927 PolarHBondContact O-N 3.16Å; Q2923-I2927 VanDerWaalsContact O-N 3.09Å; Q2924-I2927 PolarHBondContact O-N 3Å; L2925-I2927 VanDerWaalsContact C-N 3.3Å; L2925-I2927 PolarHBondContact O-N 3.11Å; I2927-I2929 PolarHBondContact O-N 2.98Å; I2927-Q2930 PolarHBondContact O-N 2.98Å; I2927-R2931 HydrophobicContact CG2-CG 4.4Å; I2927-R2931 WeakPolarHBondContact O-CB 3.35Å; I2927-R2931 VanDerWaalsContact O-CG 3.24Å; I2927-R2931 WeakPolarHBondContact O-CG 3.21Å; I2927-R2931 PolarHBondContact O-N 3.22Å
2928	Q	75.8	Confident	76.5	Confident	67 Å²	67	60.9 Å²	60.9	31%	0.313	29%	0.291	S	S	.	.	H	α-helix	trans	-61.7	-41.8	170.8	-72.2	-178.8	17.2	0	0	112.4	Q2924 L2925 Q2926 R2931 R2932	Q2924-Q2928 WeakPolarHBondContact O-CG 3.42Å; Q2924-Q2928 PolarHBondContact O-N 3.01Å; L2925-Q2928 PolarHBondContact O-N 3.28Å; Q2926-Q2928 VanDerWaalsContact C-N 3.33Å; Q2926-Q2928 PolarHBondContact O-N 3.48Å; Q2928-R2931 PolarHBondContact O-N 3.26Å; Q2928-R2932 WeakPolarHBondContact O-CB 3.45Å; Q2928-R2932 VanDerWaalsContact O-CG 3.3Å; Q2928-R2932 WeakPolarHBondContact O-CG 3.38Å; Q2928-R2932 PolarHBondContact O-N 3.27Å
2929	I	76.1	Confident	75.4	Confident	41 Å²	41	63.5 Å²	63.5	21%	0.21	31%	0.313	C	S	.	.	H	α-helix	trans	-62.5	-46.2	175.6	-70.1	163.1	0	0	0	110.1	E2808 L2925 Q2926 I2927 R2931 R2932 H2933	E2808-I2929 HydrophobicContact CB-CD1 4.3Å; E2808-I2929 HydrophobicContact CG-CD1 4.23Å; E2808-I2929 VanDerWaalsContact OE2-CD1 3.25Å; E2808-I2929 WeakPolarHBondContact OE2-CD1 3.32Å; L2925-I2929 HydrophobicContact CD1-CD1 4.35Å; L2925-I2929 HydrophobicContact CG-CD1 4.22Å; L2925-I2929 WeakPolarHBondContact O-CB 3.47Å; L2925-I2929 WeakPolarHBondContact O-CD1 3.4Å; L2925-I2929 VanDerWaalsContact O-CG1 3.27Å; L2925-I2929 WeakPolarHBondContact O-CG1 3.39Å; L2925-I2929 PolarHBondContact O-N 3.05Å; Q2926-I2929 PolarHBondContact O-N 3.05Å; I2927-I2929 PolarHBondContact O-N 2.98Å; I2929-R2931 PolarHBondContact O-N 3.28Å; I2929-R2932 WeakPolarHBondContact O-CA 3.49Å; I2929-R2932 WeakPolarHBondContact O-CB 3.44Å; I2929-R2932 PolarHBondContact O-N 3.08Å; I2929-H2933 PolarHBondContact O-CD2 2.97Å; I2929-H2933 VanDerWaalsContact O-CD2 3.3Å; I2929-H2933 PolarHBondContact O-N 3.22Å
2930	Q	75.6	Confident	74.1	Confident	51.25 Å²	51.25	70.9 Å²	70.9	24%	0.239	34%	0.344	C	S	.	.	H	α-helix	trans	-60.3	-45.5	175.4	-72.1	178.1	10.1	0	0	112.3	F2271 Q2926 I2927 R2932 H2933 I2934	F2271-Q2930 PolarHBondContact O-NE2 3.39Å; F2271-Q2930 PolarHBondContact O-OE1 2.83Å; Q2926-Q2930 WeakPolarHBondContact O-CG 3.42Å; Q2926-Q2930 PolarHBondContact O-N 3Å; I2927-Q2930 PolarHBondContact O-N 2.98Å; Q2930-R2932 VanDerWaalsContact C-N 3.31Å; Q2930-R2932 PolarHBondContact O-N 3.18Å; Q2930-H2933 PolarHBondContact O-N 3.26Å; Q2930-H2933 VanDerWaalsContact O-N 3.13Å; Q2930-I2934 WeakPolarHBondContact O-CB 3.07Å; Q2930-I2934 VanDerWaalsContact O-CG1 3.3Å; Q2930-I2934 WeakPolarHBondContact O-CG1 3.41Å; Q2930-I2934 PolarHBondContact O-N 3.02Å
2931	R	73	Confident	72.6	Confident	41.75 Å²	41.75	78.4 Å²	78.4	16%	0.158	37%	0.37	C	S	.	.	H	α-helix	trans	-58.3	-37.5	173.1	-75.2	-177.5	171	176.4	1.1	112.5	S2539 L2740 S2741 V2747 I2927 Q2928 I2929 H2933 I2934 R2935	S2539-R2931 PolarHBondContact OG-NH1 3.39Å; S2539-R2931 VanDerWaalsContact OG-NH1 3.16Å; L2740-R2931 HydrophobicContact CD1-CG 4.48Å; L2740-R2931 HydrophobicContact CD2-CG 3.87Å; L2740-R2931 HydrophobicContact CG-CG 4.29Å; S2741-R2931 VanDerWaalsContact O-CZ 3.27Å; S2741-R2931 PolarHBondContact O-NE 3.18Å; S2741-R2931 VanDerWaalsContact O-NE 3.12Å; S2741-R2931 PolarHBondContact O-NH2 3.12Å; S2741-R2931 PolarHBondContact OG-NH2 3.44Å; V2747-R2931 VanDerWaalsContact CG1-NH2 3.34Å; I2927-R2931 HydrophobicContact CG2-CG 4.4Å; I2927-R2931 WeakPolarHBondContact O-CB 3.35Å; I2927-R2931 VanDerWaalsContact O-CG 3.24Å; I2927-R2931 WeakPolarHBondContact O-CG 3.21Å; I2927-R2931 PolarHBondContact O-N 3.22Å; Q2928-R2931 PolarHBondContact O-N 3.26Å; I2929-R2931 PolarHBondContact O-N 3.28Å; R2931-H2933 PolarHBondContact O-N 3.04Å; R2931-I2934 PolarHBondContact O-N 3.08Å; R2931-R2935 WeakPolarHBondContact O-CB 3.32Å; R2931-R2935 WeakPolarHBondContact O-CG 3.36Å; R2931-R2935 PolarHBondContact O-N 2.92Å; R2931-R2935 PolarHBondContact O-NE 3.22Å
2932	R	72.3	Confident	70.7	Confident	146.25 Å²	146.25	87.3 Å²	87.3	55%	0.552	40%	0.402	S	S	*	.	H	α-helix	trans	-68.6	-41	174.5	-72.4	171.7	-178.2	173.7	3.5	111.9	Q2928 I2929 Q2930 R2935 K2936	Q2928-R2932 WeakPolarHBondContact O-CB 3.45Å; Q2928-R2932 VanDerWaalsContact O-CG 3.3Å; Q2928-R2932 WeakPolarHBondContact O-CG 3.38Å; Q2928-R2932 PolarHBondContact O-N 3.27Å; I2929-R2932 WeakPolarHBondContact O-CA 3.49Å; I2929-R2932 WeakPolarHBondContact O-CB 3.44Å; I2929-R2932 PolarHBondContact O-N 3.08Å; Q2930-R2932 VanDerWaalsContact C-N 3.31Å; Q2930-R2932 PolarHBondContact O-N 3.18Å; R2932-R2935 PolarHBondContact O-N 3.14Å; R2932-K2936 WeakPolarHBondContact O-CB 3.35Å; R2932-K2936 VanDerWaalsContact O-CG 3.29Å; R2932-K2936 WeakPolarHBondContact O-CG 3.4Å; R2932-K2936 PolarHBondContact O-N 3.29Å
2933	H	75.4	Confident	68.4	Low	122.25 Å²	122.25	96.2 Å²	96.2	57%	0.566	44%	0.437	S	S	*	.	H	α-helix	trans	-64.9	-45	175.5	-84	-106.1	0	0	0	112.3	I2929 Q2930 R2931 R2935 K2936 A2937	I2929-H2933 PolarHBondContact O-CD2 2.97Å; I2929-H2933 VanDerWaalsContact O-CD2 3.3Å; I2929-H2933 PolarHBondContact O-N 3.22Å; Q2930-H2933 PolarHBondContact O-N 3.26Å; Q2930-H2933 VanDerWaalsContact O-N 3.13Å; R2931-H2933 PolarHBondContact O-N 3.04Å; H2933-R2935 VanDerWaalsContact C-N 3.35Å; H2933-R2935 PolarHBondContact O-N 2.93Å; H2933-K2936 PolarHBondContact O-N 3.07Å; H2933-A2937 WeakPolarHBondContact O-CB 3.45Å; H2933-A2937 PolarHBondContact O-N 3.16Å
2934	I	74.1	Confident	66.2	Low	59 Å²	59	103 Å²	103	30%	0.303	47%	0.468	S	S	.	.	H	α-helix	trans	-64.7	-43.4	178.1	-63.3	164.6	0	0	0	110.6	L2740 L2742 Q2930 R2931 K2936 A2937 M2938	L2740-I2934 HydrophobicContact CD2-CD1 4.35Å; L2742-I2934 HydrophobicContact CD1-CB 3.89Å; L2742-I2934 HydrophobicContact CD1-CG2 3.47Å; L2742-I2934 VanDerWaalsContact CD1-CG2 3.47Å; L2742-I2934 HydrophobicContact CD2-CB 4.28Å; L2742-I2934 HydrophobicContact CD2-CG2 3.83Å; Q2930-I2934 WeakPolarHBondContact O-CB 3.07Å; Q2930-I2934 VanDerWaalsContact O-CG1 3.3Å; Q2930-I2934 WeakPolarHBondContact O-CG1 3.41Å; Q2930-I2934 PolarHBondContact O-N 3.02Å; R2931-I2934 PolarHBondContact O-N 3.08Å; I2934-K2936 PolarHBondContact O-N 3.16Å; I2934-A2937 PolarHBondContact O-N 3.12Å; I2934-M2938 HydrophobicContact CG2-CE 3.73Å; I2934-M2938 HydrophobicContact CG2-SD 4.23Å; I2934-M2938 WeakPolarHBondContact O-CG 3.31Å; I2934-M2938 PolarHBondContact O-N 3.04Å
2935	R	72.1	Confident	64.3	Low	107.5 Å²	107.5	104.8 Å²	104.8	41%	0.406	49%	0.487	S	S	.	.	H	α-helix	trans	-58.2	-46.1	172.8	-81	-176.7	-124.4	168.6	2	112.2	L2742 E2744 R2931 R2932 H2933 M2938 S2939	L2742-R2935 HydrophobicContact CD1-CG 3.99Å; L2742-R2935 HydrophobicContact CD2-CG 3.88Å; L2742-R2935 HydrophobicContact CG-CG 3.61Å; L2742-R2935 PolarHBondContact O-NE 2.98Å; L2742-R2935 VanDerWaalsContact O-NE 3.13Å; L2742-R2935 PolarHBondContact O-NH2 2.86Å; E2744-R2935 IonicContact OE1-CZ 2.82Å; E2744-R2935 IonicContact OE1-NH1 3.4Å; E2744-R2935 PolarHBondContact OE1-NH1 3.08Å; E2744-R2935 IonicContact OE1-NH2 3.35Å; E2744-R2935 PolarHBondContact OE1-NH2 3.05Å; R2931-R2935 WeakPolarHBondContact O-CB 3.32Å; R2931-R2935 WeakPolarHBondContact O-CG 3.36Å; R2931-R2935 PolarHBondContact O-N 2.92Å; R2931-R2935 PolarHBondContact O-NE 3.22Å; R2932-R2935 PolarHBondContact O-N 3.14Å; H2933-R2935 VanDerWaalsContact C-N 3.35Å; H2933-R2935 PolarHBondContact O-N 2.93Å; R2935-M2938 PolarHBondContact O-N 3.05Å; R2935-S2939 VanDerWaalsContact O-CB 3.29Å; R2935-S2939 WeakPolarHBondContact O-CB 3.39Å; R2935-S2939 PolarHBondContact O-N 3.01Å; R2935-S2939 PolarHBondContact O-OG 3.29Å
2936	K	71	Confident	62	Low	145.75 Å²	145.75	111.8 Å²	111.8	63%	0.634	52%	0.521	S	S	*	.	H	α-helix	trans	-60.8	-46.4	176.2	-76.6	179.8	176.6	-173.3	0	111.8	R2932 H2933 I2934 M2938 S2939 F2940	R2932-K2936 WeakPolarHBondContact O-CB 3.35Å; R2932-K2936 VanDerWaalsContact O-CG 3.29Å; R2932-K2936 WeakPolarHBondContact O-CG 3.4Å; R2932-K2936 PolarHBondContact O-N 3.29Å; H2933-K2936 PolarHBondContact O-N 3.07Å; I2934-K2936 PolarHBondContact O-N 3.16Å; K2936-M2938 VanDerWaalsContact C-N 3.31Å; K2936-M2938 PolarHBondContact O-N 3.19Å; K2936-S2939 WeakPolarHBondContact O-CB 3.17Å; K2936-S2939 PolarHBondContact O-N 3.06Å; K2936-S2939 VanDerWaalsContact O-N 3.13Å; K2936-S2939 PolarHBondContact O-OG 2.82Å; K2936-F2940 VanDerWaalsContact O-CD2 3.24Å; K2936-F2940 WeakPolarHBondContact O-CD2 3.31Å; K2936-F2940 PolarHBondContact O-N 3.14Å; K2936-F2940 VanDerWaalsContact O-N 3.08Å
2937	A	70.4	Confident	59.7	Low	66.25 Å²	66.25	116.7 Å²	116.7	55%	0.548	55%	0.549	S	S	.	.	H	α-helix	trans	-62.1	-39.6	178.7	0	0	0	0	0	113	H2933 I2934	H2933-A2937 WeakPolarHBondContact O-CB 3.45Å; H2933-A2937 PolarHBondContact O-N 3.16Å; I2934-A2937 PolarHBondContact O-N 3.12Å
2938	M	63.9	Low	57.8	Low	103.5 Å²	103.5	125.2 Å²	125.2	51%	0.51	59%	0.585	S	S	.	*	H	α-helix	trans	-74.1	-33.2	175.9	-70.8	-163.9	-77.6	0	0	113.3	L2742 I2934 R2935 K2936 F2940 K2941	L2742-M2938 HydrophobicContact CD1-CE 3.54Å; L2742-M2938 VanDerWaalsContact CD1-CE 3.41Å; L2742-M2938 HydrophobicContact CD1-SD 4.3Å; L2742-M2938 HydrophobicContact CD2-CE 3.57Å; L2742-M2938 VanDerWaalsContact CD2-CE 3.49Å; L2742-M2938 HydrophobicContact CG-CE 4.13Å; I2934-M2938 HydrophobicContact CG2-CE 3.73Å; I2934-M2938 HydrophobicContact CG2-SD 4.23Å; I2934-M2938 WeakPolarHBondContact O-CG 3.31Å; I2934-M2938 PolarHBondContact O-N 3.04Å; R2935-M2938 PolarHBondContact O-N 3.05Å; K2936-M2938 VanDerWaalsContact C-N 3.31Å; K2936-M2938 PolarHBondContact O-N 3.19Å; M2938-F2940 VanDerWaalsContact C-N 3.31Å; M2938-F2940 PolarHBondContact O-N 3.06Å; M2938-K2941 WeakPolarHBondContact O-CB 3.43Å; M2938-K2941 PolarHBondContact O-N 3.15Å; M2938-K2941 VanDerWaalsContact O-N 3.11Å
2939	S	60.9	Low	55.6	Low	75.5 Å²	75.5	127.1 Å²	127.1	53%	0.528	61%	0.605	S	S	.	*	H	α-helix	trans	-61.8	-37.9	175.5	126	0	0	0	0	112.4	R2935 K2936 K2941 R2942	R2935-S2939 VanDerWaalsContact O-CB 3.29Å; R2935-S2939 WeakPolarHBondContact O-CB 3.39Å; R2935-S2939 PolarHBondContact O-N 3.01Å; R2935-S2939 PolarHBondContact O-OG 3.29Å; K2936-S2939 WeakPolarHBondContact O-CB 3.17Å; K2936-S2939 PolarHBondContact O-N 3.06Å; K2936-S2939 VanDerWaalsContact O-N 3.13Å; K2936-S2939 PolarHBondContact O-OG 2.82Å; S2939-K2941 VanDerWaalsContact C-N 3.3Å; S2939-K2941 PolarHBondContact O-N 3.07Å; S2939-K2941 VanDerWaalsContact O-N 3.11Å; S2939-R2942 PolarHBondContact O-N 3.01Å; S2939-R2942 VanDerWaalsContact O-N 3.15Å
2940	F	55.6	Low	53.4	Low	182 Å²	182	130.7 Å²	130.7	80%	0.798	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	-19.3	176.9	-108.1	-82.7	0	0	0	114.1	K2936 M2938 R2942	K2936-F2940 VanDerWaalsContact O-CD2 3.24Å; K2936-F2940 WeakPolarHBondContact O-CD2 3.31Å; K2936-F2940 PolarHBondContact O-N 3.14Å; K2936-F2940 VanDerWaalsContact O-N 3.08Å; M2938-F2940 VanDerWaalsContact C-N 3.31Å; M2938-F2940 PolarHBondContact O-N 3.06Å; F2940-R2942 VanDerWaalsContact C-N 3.32Å; F2940-R2942 PolarHBondContact O-N 3.39Å
2941	K	48.8	Very low	51.3	Low	184.25 Å²	184.25	132.5 Å²	132.5	80%	0.801	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	4.1	-176.7	-132.7	179.8	-178.8	-177	0	114.1	M2938 S2939	M2938-K2941 WeakPolarHBondContact O-CB 3.43Å; M2938-K2941 PolarHBondContact O-N 3.15Å; M2938-K2941 VanDerWaalsContact O-N 3.11Å; S2939-K2941 VanDerWaalsContact C-N 3.3Å; S2939-K2941 PolarHBondContact O-N 3.07Å; S2939-K2941 VanDerWaalsContact O-N 3.11Å
2942	R	40.7	Very low	49.1	Very low	217 Å²	217	136 Å²	136	82%	0.819	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104	3.8	-175.1	-157.8	176	-73.2	-176.4	-3.4	114.7	S2939 F2940	S2939-R2942 PolarHBondContact O-N 3.01Å; S2939-R2942 VanDerWaalsContact O-N 3.15Å; F2940-R2942 VanDerWaalsContact C-N 3.32Å; F2940-R2942 PolarHBondContact O-N 3.39Å
2943	Y	34.4	Very low	46.9	Very low	206.75 Å²	206.75	134.6 Å²	134.6	81%	0.811	70%	0.702	S	S	*	*			trans	-111.5	102.3	171.7	-77.4	-81.2	0	0	0	111.5	P2945	Y2943-P2945 WeakPolarHBondContact O-CD 3.39Å
2944	H	35.5	Very low	44.7	Very low	177.75 Å²	177.75	133.8 Å²	133.8	82%	0.823	71%	0.709	S	S	*	*			trans	-109.2	110.4	162.5	-88.1	-80.1	0	0	0	109.3	M2946	H2944-M2946 PolarHBondContact O-N 3.08Å
2945	P	37.9	Very low	42.6	Very low	123 Å²	123	138 Å²	138	80%	0.799	73%	0.732	S	S	*	*			trans	-75.7	120.4	167.1	1.2	11.8	0	0	0	109.8	Y2943	Y2943-P2945 WeakPolarHBondContact O-CD 3.39Å
2946	M	32	Very low	40.4	Very low	176.5 Å²	176.5	139.5 Å²	139.5	87%	0.869	75%	0.747	S	S	*	*			trans	-72.6	139.5	167.9	-82	-75.1	-171.9	0	0	110.8	H2944	H2944-M2946 PolarHBondContact O-N 3.08Å
2947	N	32.8	Very low	38.4	Very low	138.75 Å²	138.75	137.2 Å²	137.2	74%	0.742	75%	0.749	S	S	*	*			trans	56.3	122	159.5	-82.8	-41.7	0	0	0	117.3
2948	K	34.5	Very low	36.4	Very low	196.5 Å²	196.5	143 Å²	143	85%	0.854	76%	0.763	S	S	*	*				133.3	127.4	126.8	-84.9	163.8	-172.8	176.9	0	115.3
2949	S	29.9	Very low	34.9	Very low	106.5 Å²	106.5	145 Å²	145	75%	0.745	78%	0.775	S	S	*	*			trans	-122.5	138.1	148.2	58.1	0	0	0	0	114.3
2950	S	31.2	Very low	33.5	Very low	117.25 Å²	117.25	149.2 Å²	149.2	82%	0.82	79%	0.792	S	S	*	*			trans	96.8	138.4	161.4	44.4	0	0	0	0	116.3
2951	A	30.4	Very low	32.2	Very low	89.25 Å²	89.25	148.9 Å²	148.9	74%	0.738	79%	0.793	S	S	*	*			trans	64.6	114.9	156.6	0	0	0	0	0	116.6
2952	S	28.2	Very low	31.4	Very low	115.5 Å²	115.5	147.1 Å²	147.1	81%	0.808	79%	0.791	S	S	*	*			trans	61.3	107.1	132.1	-42.5	0	0	0	0	118.1
2953	S	26.1	Very low	30.9	Very low	116.25 Å²	116.25	144.5 Å²	144.5	81%	0.813	79%	0.792	S	S	*	*			trans	7.4	130	152	62.2	0	0	0	0	117.8
2954	S	29.2	Very low	30.5	Very low	104.5 Å²	104.5	139.2 Å²	139.2	73%	0.731	79%	0.786	S	S	*	*			trans	144.3	126.2	150	65	0	0	0	0	115.5
2955	L	28.4	Very low	30.1	Very low	147.25 Å²	147.25	135.7 Å²	135.7	77%	0.771	78%	0.781	S	S	*	*			trans	-166.1	132.6	146.4	-78.7	169.7	0	0	0	114.5	S2957 R3418	L2955-S2957 PolarHBondContact O-N 2.84Å; L2955-S2957 VanDerWaalsContact O-N 3.12Å; L2955-R3418 HydrophobicContact CD2-CG 4.13Å
2956	L	27.4	Very low	29.6	Very low	139.75 Å²	139.75	137.5 Å²	137.5	73%	0.732	78%	0.782	S	S	*	*			trans	24.4	103	147	-59.9	169	0	0	0	116.6	F2958 R3418 S3419	L2956-F2958 HydrophobicContact CD2-CD2 4.49Å; L2956-F2958 HydrophobicContact CD2-CE2 3.77Å; L2956-F2958 HydrophobicContact CD2-CZ 4.21Å; L2956-R3418 HydrophobicContact CD1-CB 4.18Å; L2956-R3418 HydrophobicContact CD1-CG 4.13Å; L2956-R3418 WeakPolarHBondContact CD1-O 3.33Å; L2956-R3418 HydrophobicContact CG-CB 4.5Å; L2956-S3419 WeakPolarHBondContact CD1-OG 3.5Å
2957	S	28	Very low	29.5	Very low	97 Å²	97	135.5 Å²	135.5	68%	0.678	78%	0.78	S	S	*	*			trans	-121.9	118.5	138.4	-171.2	0	0	0	0	111.1	L2955 N2959	L2955-S2957 PolarHBondContact O-N 2.84Å; L2955-S2957 VanDerWaalsContact O-N 3.12Å; S2957-N2959 PolarHBondContact O-N 3.08Å
2958	F	28.4	Very low	29.4	Very low	188.5 Å²	188.5	136.2 Å²	136.2	83%	0.827	78%	0.784	S	S	*	*			trans	-90.5	111	156.8	-78.7	-78.2	0	0	0	111.3	L2956	L2956-F2958 HydrophobicContact CD2-CD2 4.49Å; L2956-F2958 HydrophobicContact CD2-CE2 3.77Å; L2956-F2958 HydrophobicContact CD2-CZ 4.21Å
2959	N	32.8	Very low	29.2	Very low	145.5 Å²	145.5	131.6 Å²	131.6	78%	0.778	78%	0.776	S	S	*	*			trans	-97.6	142.1	160.9	-84.2	-28.4	0	0	0	110.9	S2957 E2961	S2957-N2959 PolarHBondContact O-N 3.08Å; N2959-E2961 VanDerWaalsContact C-N 3.3Å; N2959-E2961 PolarHBondContact O-N 2.91Å; N2959-E2961 VanDerWaalsContact O-N 3.17Å
2960	N	31.5	Very low	29.3	Very low	163 Å²	163	133.6 Å²	133.6	87%	0.872	78%	0.779	S	S	*	*			trans	-74.9	110.4	165.5	-76.4	-21.5	0	0	0	113
2961	E	29	Very low	29.2	Very low	175.5 Å²	175.5	135.1 Å²	135.1	82%	0.82	78%	0.778	S	S	*	*			trans	-115.9	140.2	160.3	-111.3	-177.1	-178.8	0	0	111	N2959	N2959-E2961 VanDerWaalsContact C-N 3.3Å; N2959-E2961 PolarHBondContact O-N 2.91Å; N2959-E2961 VanDerWaalsContact O-N 3.17Å
2962	I	31.9	Very low	29.1	Very low	147 Å²	147	137 Å²	137	75%	0.754	78%	0.78	S	S	*	*			trans	137.9	106.1	160.2	-64.2	173.8	0	0	0	111.5
2963	L	28.6	Very low	29.2	Very low	161.5 Å²	161.5	136.3 Å²	136.3	85%	0.846	77%	0.774	S	S	*	*				-167.3	106.2	128.9	-155.4	92.3	0	0	0	112.1
2964	S	26.7	Very low	29.3	Very low	97 Å²	97	138 Å²	138	68%	0.678	77%	0.774	S	S	*	*			trans	123.2	78.7	165.7	54.4	0	0	0	0	118
2965	S	26.7	Very low	29.3	Very low	103.5 Å²	103.5	139.7 Å²	139.7	72%	0.724	77%	0.773	S	S	*	*			trans	134.3	117.4	142.3	47.1	0	0	0	0	118.1
2966	I	29	Very low	29.3	Very low	162 Å²	162	140.4 Å²	140.4	83%	0.831	77%	0.773	S	S	*	*			trans	76	97.9	154.6	-54.5	169.3	0	0	0	113.7
2967	T	28.9	Very low	29.4	Very low	133.5 Å²	133.5	142.5 Å²	142.5	82%	0.819	78%	0.776	S	S	*	*			trans	-97.5	118.1	151.5	38	0	0	0	0	111.5
2968	N	30.9	Very low	29.5	Very low	153.25 Å²	153.25	142.9 Å²	142.9	82%	0.82	78%	0.778	S	S	*	*			trans	138.1	126	154.5	-122.6	3.4	0	0	0	116.2
2969	S	30.7	Very low	29.7	Very low	100 Å²	100	138.7 Å²	138.7	70%	0.699	77%	0.772	S	S	*	*			trans	-167.2	129.4	150.5	6	0	0	0	0	114.3
2970	N	30.5	Very low	29.6	Very low	148.75 Å²	148.75	137.8 Å²	137.8	80%	0.795	77%	0.768	S	S	*	*			trans	-127.9	130.1	147.2	-74.8	-40.3	0	0	0	110.8
2971	N	29.5	Very low	29.7	Very low	148.75 Å²	148.75	136.3 Å²	136.3	80%	0.795	76%	0.76	S	S	*	*			trans	13	127.1	141.9	-65.2	-36	0	0	0	115.7
2972	V	29.8	Very low	29.9	Very low	129 Å²	129	135 Å²	135	78%	0.782	76%	0.758	S	S	*	*				-176.4	131.5	100.9	156.1	0	0	0	0	111.7
2973	S	28.7	Very low	29.8	Very low	99.75 Å²	99.75	133.3 Å²	133.3	70%	0.698	76%	0.758	S	S	*	*			trans	18.3	136.5	142.8	66.2	0	0	0	0	116.6
2974	L	28.6	Very low	29.9	Very low	152 Å²	152	132.7 Å²	132.7	80%	0.796	76%	0.756	S	S	*	*			trans	123.9	136.7	132.8	-119.4	70.7	0	0	0	117.2
2975	I	29	Very low	30	Very low	140.25 Å²	140.25	138.4 Å²	138.4	72%	0.719	76%	0.762	S	S	*	*			trans	47.7	131.3	154	-71.2	165	0	0	0	117	K2977	I2975-K2977 PolarHBondContact O-N 3.19Å
2976	Q	28.4	Very low	30.2	Very low	163.75 Å²	163.75	140.3 Å²	140.3	77%	0.765	76%	0.763	S	S	*	*				131.7	142.6	88.5	-141.1	175.7	5.1	0	0	111.6
2977	K	30.7	Very low	30.3	Very low	184 Å²	184	139 Å²	139	80%	0.8	76%	0.756	S	S	*	*				-169.7	144.1	94	-110.7	174.7	-178.3	176.8	0	112.5	I2975	I2975-K2977 PolarHBondContact O-N 3.19Å
2978	S	29.5	Very low	30.3	Very low	103.5 Å²	103.5	140.8 Å²	140.8	72%	0.724	76%	0.755	S	S	*	*			trans	-50.5	133.5	169.5	50.8	0	0	0	0	114.9
2979	S	31.7	Very low	30.3	Very low	100.25 Å²	100.25	138.9 Å²	138.9	70%	0.701	75%	0.75	S	S	*	*				139.8	121.3	97.5	174.5	0	0	0	0	113.7
2980	N	31.8	Very low	30.3	Very low	127.25 Å²	127.25	140.7 Å²	140.7	68%	0.68	75%	0.751	S	S	*	*				78.5	133.3	114.8	-79.1	57.7	0	0	0	117.3
2981	D	33.7	Very low	30.2	Very low	132.75 Å²	132.75	140.2 Å²	140.2	71%	0.71	75%	0.749	S	S	*	*			trans	78.7	145.1	130.1	-54.1	-28.3	0	0	0	117.7
2982	D	32.4	Very low	30.2	Very low	147.5 Å²	147.5	139.3 Å²	139.3	79%	0.789	74%	0.744	S	S	*	*				129.6	160	82	-113.4	-18.3	0	0	0	116.8
2983	C	30.2	Very low	30.1	Very low	111.25 Å²	111.25	141.1 Å²	141.1	75%	0.752	74%	0.744	S	S	*	*			trans	-147.6	133.6	-179.4	-92	0	0	0	0	116.1
2984	N	30.7	Very low	30.1	Very low	149 Å²	149	141.5 Å²	141.5	80%	0.797	75%	0.746	S	S	*	*			trans	146.6	118.1	162.3	-110.8	-30.5	0	0	0	115.8
2985	R	28.8	Very low	30	Very low	216.25 Å²	216.25	142.9 Å²	142.9	82%	0.816	75%	0.749	S	S	*	*			trans	174.9	141.7	144.8	-139	176.1	-121.2	-138.3	1.4	116.1
2986	I	29.8	Very low	29.9	Very low	142.75 Å²	142.75	142.1 Å²	142.1	73%	0.732	75%	0.751	S	S	*	*			trans	61.4	130.2	158.7	-36.2	166.2	0	0	0	115.2
2987	I	31.2	Very low	29.7	Very low	135.75 Å²	135.75	144.4 Å²	144.4	70%	0.696	75%	0.754	S	S	*	*			cis	-160.6	136.6	49.2	-92.4	173.1	0	0	0	111.4
2988	Q	29.7	Very low	29.7	Very low	170.5 Å²	170.5	142.9 Å²	142.9	80%	0.797	75%	0.753	S	S	*	*			trans	58.4	165.4	157.8	-69.4	169.3	-6.8	0	0	116.6
2989	T	30.3	Very low	29.6	Very low	114.5 Å²	114.5	145.3 Å²	145.3	70%	0.702	75%	0.753	S	S	*	*			cis	-176.9	144.9	-36.6	43.8	0	0	0	0	112.5
2990	N	30.9	Very low	29.5	Very low	136.75 Å²	136.75	146.8 Å²	146.8	73%	0.731	75%	0.753	S	S	*	*			trans	58.5	125.8	134.1	-68.2	-7.2	0	0	0	120
2991	N	28.4	Very low	29.3	Very low	138 Å²	138	150.5 Å²	150.5	74%	0.738	76%	0.757	S	S	*	*				57.9	136.8	126	-62.6	1.2	0	0	0	118.5
2992	N	29.1	Very low	29.4	Very low	131.5 Å²	131.5	150.5 Å²	150.5	70%	0.703	76%	0.756	S	S	*	*				128.4	160.1	127.8	-83.5	14.9	0	0	0	114.2
2993	E	29.4	Very low	29.4	Very low	166.5 Å²	166.5	149.7 Å²	149.7	78%	0.778	75%	0.752	S	S	*	*				136.2	154.9	79.3	-101.1	162.9	-121.3	0	0	115.5
2994	S	28.7	Very low	29.4	Very low	106.75 Å²	106.75	148.9 Å²	148.9	75%	0.747	75%	0.747	S	S	*	*			trans	156.3	138.5	142.6	-70.5	0	0	0	0	116.4
2995	E	26.1	Very low	29.5	Very low	182 Å²	182	149.7 Å²	149.7	85%	0.85	75%	0.746	S	S	*	*			trans	-89.2	173.8	155.3	-77.4	-173.2	144.7	0	0	116.9
2996	T	26.1	Very low	29.6	Very low	123 Å²	123	144.4 Å²	144.4	76%	0.755	74%	0.742	S	S	*	*			trans	104.9	115	174.6	67.2	0	0	0	0	120.3
2997	Y	25.2	Very low	29.6	Very low	213.5 Å²	213.5	143.7 Å²	143.7	84%	0.837	74%	0.744	S	S	*	*			trans	87.3	130.1	138.7	-113.9	-92.7	0	0	0	120
2998	I	29.3	Very low	29.6	Very low	151.5 Å²	151.5	142.1 Å²	142.1	78%	0.777	75%	0.745	S	S	*	*			trans	139.7	100.4	151.9	-64.6	177.9	0	0	0	115.2
2999	Q	27.4	Very low	29.6	Very low	155 Å²	155	138.9 Å²	138.9	72%	0.724	74%	0.742	S	S	*	*			trans	1.9	137.1	139.4	-145.1	76	-23.3	0	0	118.1
3000	N	29.7	Very low	29.7	Very low	129.75 Å²	129.75	138.9 Å²	138.9	69%	0.694	74%	0.742	S	S	*	*			trans	124.8	139.4	153.8	-90.3	-45.4	0	0	0	116.1
3001	R	28.5	Very low	29.6	Very low	205.667 Å²	205.667	138.4 Å²	138.4	78%	0.776	74%	0.739	S	S	*	*			cis	156.3	163.3	-29.4	-142.7	-174.1	-103.3	-153.8	-2.7	111.3
3002	I	35.4	Very low	29.8	Very low	133.667 Å²	133.667	139.7 Å²	139.7	69%	0.685	74%	0.74	S	S	*	*			trans	122.4	126.4	138.9	-77.6	173.2	0	0	0	113.1
3003	N	31.9	Very low	29.7	Very low	130 Å²	130	140.2 Å²	140.2	70%	0.695	74%	0.742	S	S	*	*				82.1	151.9	84.2	-71.4	-3.9	0	0	0	115.2	H3005	N3003-H3005 PolarHBondContact ND2-NE2 3.11Å
3004	S	30.5	Very low	29.8	Very low	94.3333 Å²	94.3333	138.8 Å²	138.8	66%	0.66	75%	0.746	S	S	*	*			cis	-165.3	144.3	36.2	7.8	0	0	0	0	108.5
3005	H	33.5	Very low	29.9	Very low	166 Å²	166	142.4 Å²	142.4	77%	0.769	75%	0.75	S	S	*	*				-166.4	169.2	50.4	-72.4	-79.3	0	0	0	111.8	N3003	N3003-H3005 PolarHBondContact ND2-NE2 3.11Å
3006	S	30.9	Very low	30.5	Very low	105 Å²	105	139.6 Å²	139.6	73%	0.734	75%	0.748	S	S	*	*			cis	-165.9	156.1	17.3	40.2	0	0	0	0	114.1
3007	T	29.6	Very low	30.7	Very low	127 Å²	127	140.7 Å²	140.7	78%	0.779	75%	0.749	S	S	*	*			cis	-147	149.7	-30.3	34.7	0	0	0	0	109.3
3008	S	30.6	Very low	31	Very low	102.333 Å²	102.333	136.2 Å²	136.2	72%	0.716	74%	0.744	S	S	*	*			trans	18.9	149.2	142.8	60.8	0	0	0	0	117.5
3009	S	30.9	Very low	31.1	Very low	103.333 Å²	103.333	137.6 Å²	137.6	72%	0.723	74%	0.744	S	S	*	*			cis	-175.7	160.1	22.9	-83.9	0	0	0	0	110.7
3010	T	32.8	Very low	31.2	Very low	114.667 Å²	114.667	135.4 Å²	135.4	70%	0.703	74%	0.741	S	S	*	*			trans	81.7	121.4	132	-34	0	0	0	0	120.4
3011	D	27.6	Very low	31.2	Very low	127.333 Å²	127.333	137.5 Å²	137.5	68%	0.681	75%	0.749	S	S	*	*			trans	48.4	121.9	141.6	-47	-31.1	0	0	0	122.7
3012	H	32.4	Very low	31.3	Very low	164 Å²	164	131.8 Å²	131.8	76%	0.759	74%	0.741	S	S	*	*				150.1	144.6	95.2	-87.8	-65	0	0	0	118.8
3013	L	28	Very low	31.3	Very low	143 Å²	143	131.7 Å²	131.7	75%	0.749	74%	0.742	S	S	*	*			trans	26.9	137.8	158.3	-82.6	74.3	0	0	0	122.1
3014	T	31.2	Very low	31.2	Very low	137.667 Å²	137.667	131.8 Å²	131.8	85%	0.845	74%	0.742	S	S	*	*				166.4	133.8	123.6	22.4	0	0	0	0	117.5
3015	H	31.5	Very low	31.4	Very low	182 Å²	182	134.5 Å²	134.5	84%	0.843	75%	0.749	S	S	*	*			trans	-109.3	155.4	160.2	-88.2	-57.4	0	0	0	108.7
3016	P	38.3	Very low	31.1	Very low	123 Å²	123	133 Å²	133	80%	0.799	75%	0.752	S	S	*	*				-150.6	-177.5	87.4	40.6	-22.1	0	0	0	117.2
3017	N	29.9	Very low	31.1	Very low	145 Å²	145	131.4 Å²	131.4	78%	0.775	75%	0.753	S	S	*	*			trans	-113.1	160.4	-179.8	-92.2	-28.2	0	0	0	118.8
3018	T	30.7	Very low	31	Very low	119 Å²	119	133.9 Å²	133.9	73%	0.73	76%	0.755	S	S	*	*			trans	107.9	144.2	156.4	49.3	0	0	0	0	117.4
3019	K	31.6	Very low	30.9	Very low	181.667 Å²	181.667	135.9 Å²	135.9	79%	0.79	76%	0.758	S	S	*	*			cis	156.2	156.6	3.3	-96.3	177.8	-179.3	179.1	0	110.6
3020	T	29.3	Very low	30.8	Very low	108 Å²	108	139.1 Å²	139.1	66%	0.663	76%	0.761	S	S	*	*			cis	-169	156.8	-12.1	8.1	0	0	0	0	110.5
3021	M	30.3	Very low	30.4	Very low	174 Å²	174	140.1 Å²	140.1	86%	0.857	76%	0.762	S	S	*	*			trans	71.6	158.2	162.7	-56.9	-75.4	124.1	0	0	117.2
3022	S	31.5	Very low	30.4	Very low	87 Å²	87	141.3 Å²	141.3	61%	0.608	77%	0.767	S	S	*	*			cis	-169.7	163.8	-4.5	151.2	0	0	0	0	111
3023	N	34	Very low	30	Very low	130.333 Å²	130.333	139 Å²	139	70%	0.697	76%	0.764	S	S	*	*			trans	96.5	139.2	134	-80.7	6.8	0	0	0	115.3
3024	N	30.8	Very low	29.9	Very low	133.333 Å²	133.333	140 Å²	140	71%	0.713	77%	0.765	S	S	*	*			cis	103.3	141.9	41.6	-78.6	1.4	0	0	0	114.6
3025	N	34.2	Very low	29.7	Very low	150.667 Å²	150.667	139.4 Å²	139.4	81%	0.806	76%	0.757	S	S	*	*			trans	109.6	154.8	144.2	-72	-10.9	0	0	0	117
3026	T	27.4	Very low	29.4	Very low	134.667 Å²	134.667	137.3 Å²	137.3	83%	0.826	75%	0.75	S	S	*	*				-151.8	144.1	-79.7	36.1	0	0	0	0	111.2
3027	G	30.4	Very low	28.8	Very low	72.3333 Å²	72.3333	138.7 Å²	138.7	75%	0.746	75%	0.749	S	S	*	*			trans	110.5	146	168.2	0	0	0	0	0	116.9
3028	Q	28.7	Very low	28.6	Very low	178.667 Å²	178.667	136.6 Å²	136.6	84%	0.835	75%	0.746	S	S	*	*			cis	174.4	136.6	4.6	-113.4	174.6	-34.4	0	0	114.9
3029	N	27.1	Very low	28.4	Very low	143.333 Å²	143.333	140.7 Å²	140.7	77%	0.766	76%	0.757	S	S	*	*			trans	25.4	130.5	147.3	-50.9	-15.2	0	0	0	121.4
3030	H	29	Very low	28.1	Very low	171 Å²	171	137.6 Å²	137.6	79%	0.792	76%	0.758	S	S	*	*				170.6	149.5	118.9	-142.8	-86.5	0	0	0	115.6
3031	L	24.1	Very low	27.9	Very low	136.333 Å²	136.333	135.7 Å²	135.7	71%	0.714	76%	0.76	S	S	*	*			trans	-89.3	152.7	176.6	-76.6	70.6	0	0	0	111.8
3032	I	27.7	Very low	27.8	Very low	153.333 Å²	153.333	134.4 Å²	134.4	79%	0.786	76%	0.757	S	S	*	*			trans	178	135.2	131.4	-81.6	166.8	0	0	0	113.5
3033	T	25.2	Very low	27.6	Very low	115 Å²	115	139.9 Å²	139.9	71%	0.706	77%	0.77	S	S	*	*			trans	-52.4	139.2	175.5	-45.6	0	0	0	0	116.2
3034	E	25.7	Very low	27.3	Very low	163 Å²	163	138.2 Å²	138.2	76%	0.762	77%	0.768	S	S	*	*			trans	-167.8	125.9	155.4	-91.1	165.6	-148.3	0	0	114.6
3035	N	25.8	Very low	27.1	Very low	126.667 Å²	126.667	139.3 Å²	139.3	68%	0.677	77%	0.773	S	S	*	*				106.6	138.6	103.2	-87.7	-28.1	0	0	0	117.7
3036	I	25.7	Very low	26.7	Very low	136 Å²	136	137.1 Å²	137.1	70%	0.697	77%	0.77	S	S	*	*				90.9	130.8	119.8	-76.1	170.7	0	0	0	116.2
3037	I	25.4	Very low	26.8	Very low	152.667 Å²	152.667	138.2 Å²	138.2	78%	0.783	77%	0.77	S	S	*	*			trans	89.6	128.9	148.6	-72.7	164.6	0	0	0	116
3038	S	25.5	Very low	26.6	Very low	101.667 Å²	101.667	139.8 Å²	139.8	71%	0.711	77%	0.769	S	S	*	*				152.3	109.5	122.2	52.6	0	0	0	0	114.4	S3040	S3038-S3040 PolarHBondContact O-N 3.46Å; S3038-S3040 VanDerWaalsContact O-N 3.08Å
3039	E	26.7	Very low	26.5	Very low	205.333 Å²	205.333	135.3 Å²	135.3	96%	0.96	76%	0.757	S	S	*	*			trans	-112	93.8	160	-90.4	-166.5	156.7	0	0	111.5
3040	S	25.1	Very low	26.6	Very low	116 Å²	116	137.3 Å²	137.3	81%	0.811	76%	0.76	S	S	*	*			trans	-133.3	97.9	169.7	65.1	0	0	0	0	112.1	S3038	S3038-S3040 PolarHBondContact O-N 3.46Å; S3038-S3040 VanDerWaalsContact O-N 3.08Å
3041	G	25.9	Very low	26.6	Very low	69 Å²	69	137.8 Å²	137.8	71%	0.711	76%	0.764	S	S	*	*			trans	112.9	104.8	165	0	0	0	0	0	114.5
3042	N	27.7	Very low	26.9	Very low	146.667 Å²	146.667	139.4 Å²	139.4	78%	0.784	77%	0.773	S	S	*	*				-145.6	101.9	116.5	-88.8	-51.2	0	0	0	111.1
3043	K	27.3	Very low	26.9	Very low	201.667 Å²	201.667	135.1 Å²	135.1	88%	0.877	77%	0.767	S	S	*	*			trans	-110.7	72.2	164.9	-79.4	-177.1	177.9	170.2	0	109.3
3044	S	27.2	Very low	27	Very low	94.3333 Å²	94.3333	133.3 Å²	133.3	66%	0.66	77%	0.772	S	S	*	*			trans	-93.5	140.8	171.1	51.7	0	0	0	0	110.3	S3046	S3044-S3046 PolarHBondContact O-N 3.35Å
3045	L	27.9	Very low	27.5	Very low	157.333 Å²	157.333	133.6 Å²	133.6	82%	0.824	78%	0.779	S	S	*	*			trans	-85.8	116.7	-177.1	-67.7	131.1	0	0	0	111.5
3046	S	26.2	Very low	28.6	Very low	105 Å²	105	132.8 Å²	132.8	73%	0.734	78%	0.783	S	S	*	*			trans	-103.4	88.4	162	53.2	0	0	0	0	109.8	S3044 S3048	S3044-S3046 PolarHBondContact O-N 3.35Å; S3046-S3048 VanDerWaalsContact C-N 3.31Å; S3046-S3048 PolarHBondContact O-N 3Å; S3046-S3048 VanDerWaalsContact O-N 3.08Å
3047	L	27.6	Very low	30.1	Very low	157.667 Å²	157.667	134.5 Å²	134.5	83%	0.825	79%	0.785	S	S	*	*			trans	-80.8	67.9	174.5	-171.3	69.6	0	0	0	110.4	S3049	L3047-S3049 PolarHBondContact O-N 2.73Å
3048	S	28.1	Very low	32	Very low	105.667 Å²	105.667	132 Å²	132	74%	0.739	78%	0.779	S	S	*	*			trans	-100.1	97.6	176.7	52.9	0	0	0	0	110.7	S3046	S3046-S3048 VanDerWaalsContact C-N 3.31Å; S3046-S3048 PolarHBondContact O-N 3Å; S3046-S3048 VanDerWaalsContact O-N 3.08Å
3049	S	25.8	Very low	34.1	Very low	82.6667 Å²	82.6667	128.5 Å²	128.5	58%	0.578	76%	0.756	S	S	*	*			trans	-115.2	143.9	176.1	56.5	0	0	0	0	111.7	L3047	L3047-S3049 PolarHBondContact O-N 2.73Å
3050	F	28.4	Very low	36.3	Very low	187 Å²	187	121.9 Å²	121.9	82%	0.82	73%	0.725	S	S	*	*	S	Bend	trans	76.7	112	174.2	-51.2	-74.5	0	0	0	117.2
3051	M	30.6	Very low	39	Very low	181.333 Å²	181.333	118.3 Å²	118.3	89%	0.893	70%	0.697	S	S	*	*			trans	92.4	105.1	150.4	-69.3	-67.6	108.3	0	0	114.5
3052	D	29.4	Very low	41.6	Very low	168.667 Å²	168.667	118.2 Å²	118.2	90%	0.902	68%	0.681	S	S	*	*			trans	-128.3	161.5	162.3	-162.5	4.8	0	0	0	110.9
3053	G	27.5	Very low	44.3	Very low	63.6667 Å²	63.6667	116.8 Å²	116.8	66%	0.656	67%	0.666	S	S	*	*			trans	-57.2	115.4	-179.1	0	0	0	0	0	116.5	D3055	G3053-D3055 PolarHBondContact O-N 3.16Å
3054	G	28.2	Very low	47.2	Very low	78 Å²	78	107.8 Å²	107.8	80%	0.804	63%	0.626	S	S	*	*			trans	-83.4	85.2	173.2	0	0	0	0	0	115.8	S3056	G3054-S3056 VanDerWaalsContact C-N 3.32Å; G3054-S3056 PolarHBondContact O-N 3.21Å; G3054-S3056 VanDerWaalsContact O-N 3.08Å
3055	D	35.2	Very low	50.3	Low	168.667 Å²	168.667	104.9 Å²	104.9	90%	0.902	61%	0.606	S	S	*	*			trans	-66.4	94.4	168	-83.3	-23.7	0	0	0	110.7	G3053 K3057	G3053-D3055 PolarHBondContact O-N 3.16Å; D3055-K3057 PolarHBondContact O-N 3.06Å
3056	S	48.5	Very low	53.4	Low	109 Å²	109	97.6 Å²	97.6	76%	0.762	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-67.9	122	170	53.1	0	0	0	0	109.6	G3054	G3054-S3056 VanDerWaalsContact C-N 3.32Å; G3054-S3056 PolarHBondContact O-N 3.21Å; G3054-S3056 VanDerWaalsContact O-N 3.08Å
3057	K	57.4	Low	56.6	Low	172 Å²	172	94.6 Å²	94.6	75%	0.748	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-51	130.1	173.5	-68.4	-178.2	-179.6	178	0	109.4	D3055 A3059	D3055-K3057 PolarHBondContact O-N 3.06Å; K3057-A3059 PolarHBondContact O-N 3.27Å
3058	P	65.6	Low	59.7	Low	101.333 Å²	101.333	87.1 Å²	87.1	66%	0.658	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-62.6	138.6	-176.6	26.2	-34.9	0	0	0	110.3
3059	A	69	Low	62.8	Low	27 Å²	27	83.7 Å²	83.7	22%	0.223	48%	0.477	C	S	.	.	P	Polyproline II helix	trans	-57.5	146.2	-174.5	0	0	0	0	0	112.7	K3057 I3061 R3100 D3102	K3057-A3059 PolarHBondContact O-N 3.27Å; A3059-I3061 PolarHBondContact O-N 3.14Å; A3059-R3100 HydrophobicContact CB-CB 4.09Å; A3059-R3100 VanDerWaalsContact O-CD 3.25Å; A3059-R3100 WeakPolarHBondContact O-CD 3.31Å; A3059-R3100 VanDerWaalsContact O-CG 3.3Å; A3059-R3100 WeakPolarHBondContact O-CG 3.41Å; A3059-R3100 PolarHBondContact O-NE 2.79Å; A3059-R3100 PolarHBondContact O-NH1 2.92Å; A3059-D3102 HydrophobicContact CB-CB 4.03Å; A3059-D3102 WeakPolarHBondContact CB-OD1 3.46Å; A3059-D3102 WeakPolarHBondContact CB-OD2 3.3Å
3060	E	74.5	Confident	65.9	Low	66.6667 Å²	66.6667	82.1 Å²	82.1	31%	0.312	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-60.6	136.2	-174.1	-164.3	-161.7	168.3	0	0	111.9	K2537 V3062 R3100 Q3101	K2537-E3060 WeakPolarHBondContact CE-OE1 3.35Å; K2537-E3060 WeakPolarHBondContact CE-OE2 3.3Å; K2537-E3060 VanDerWaalsContact NZ-CD 3.26Å; K2537-E3060 IonicContact NZ-OE1 3.03Å; K2537-E3060 PolarHBondContact NZ-OE1 3.29Å; K2537-E3060 IonicContact NZ-OE2 2.83Å; K2537-E3060 PolarHBondContact NZ-OE2 3.42Å; E3060-V3062 PolarHBondContact O-N 3.15Å; E3060-R3100 CarbonylContact O-C 3.58Å; E3060-R3100 WeakPolarHBondContact O-CA 3.29Å; E3060-R3100 VanDerWaalsContact O-CB 3.31Å; E3060-R3100 WeakPolarHBondContact O-CB 3.48Å; E3060-Q3101 PolarHBondContact O-N 3.22Å
3061	I	80	Confident	69	Low	42 Å²	42	75 Å²	75	22%	0.215	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	120.9	174.1	-58.1	174	0	0	0	108.5	A2754 A3059 T3098 R3100	A2754-I3061 HydrophobicContact CB-CB 4.43Å; A2754-I3061 HydrophobicContact CB-CG2 4.01Å; A2754-I3061 VanDerWaalsContact CB-O 3.31Å; A2754-I3061 WeakPolarHBondContact CB-O 3.24Å; A3059-I3061 PolarHBondContact O-N 3.14Å; I3061-T3098 HydrophobicContact CD1-CG2 4.23Å; I3061-T3098 HydrophobicContact CG2-CG2 4.3Å; I3061-R3100 HydrophobicContact CG1-CG 4.1Å
3062	V	80.6	Confident	72	Confident	65 Å²	65	66.7 Å²	66.7	39%	0.394	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	-37.7	178.9	177.4	0	0	0	0	110.9	A2754 D2755 E3060 H3099 Q3101	A2754-V3062 WeakPolarHBondContact CA-O 3.31Å; D2755-V3062 PolarHBondContact N-O 3.2Å; E3060-V3062 PolarHBondContact O-N 3.15Å; V3062-H3099 PolarHBondContact N-O 3.28Å; V3062-Q3101 HydrophobicContact CG2-CB 3.78Å; V3062-Q3101 HydrophobicContact CG2-CG 4.34Å
3063	R	85.4	Confident	75.1	Confident	119 Å²	119	64.1 Å²	64.1	45%	0.449	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	142.1	179.7	-170.7	177.7	178.2	111.6	-1.5	112.2	D2755 T3098 H3099	D2755-R3063 HydrophobicContact CB-CG 4.42Å; D2755-R3063 CarbonylContact O-C 3.5Å; D2755-R3063 VanDerWaalsContact O-CA 3.25Å; D2755-R3063 WeakPolarHBondContact O-CA 3.29Å; D2755-R3063 WeakPolarHBondContact O-CG 3.37Å; D2755-R3063 IonicContact OD2-NH1 3.12Å; R3063-T3098 WeakPolarHBondContact O-CA 3.35Å; R3063-H3099 HydrophobicContact CB-CB 4.27Å; R3063-H3099 PolarHBondContact N-O 2.88Å; R3063-H3099 VanDerWaalsContact N-O 3.12Å; R3063-H3099 PolarHBondContact O-N 2.89Å
3064	R	89	Confident	78.4	Confident	11.3333 Å²	11.3333	63.4 Å²	63.4	4%	0.043	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	147.1	172.3	-175	-178.5	-68.2	100.3	-9.7	110.1	Q2483 P2751 D2755 T2756 V2757 E3066 T3096 K3097 T3098	Q2483-R3064 VanDerWaalsContact OE1-NH1 3.1Å; P2751-R3064 PolarHBondContact O-NH2 3.39Å; D2755-R3064 PolarHBondContact O-N 3.12Å; T2756-R3064 WeakPolarHBondContact CA-O 3.37Å; T2756-R3064 HydrophobicContact CG2-CB 4.09Å; T2756-R3064 HydrophobicContact CG2-CG 4.22Å; T2756-R3064 PolarHBondContact OG1-NH1 3.02Å; V2757-R3064 PolarHBondContact N-O 3.04Å; V2757-R3064 VanDerWaalsContact N-O 3.11Å; R3064-E3066 WeakPolarHBondContact CD-OE1 3.35Å; R3064-E3066 HydrophobicContact CG-CG 4.12Å; R3064-T3096 HydrophobicContact CG-CG2 4.17Å; R3064-K3097 CarbonylContact C-O 3.52Å; R3064-K3097 WeakPolarHBondContact CA-O 3.38Å; R3064-T3098 HydrophobicContact CB-CG2 4.46Å; R3064-T3098 HydrophobicContact CG-CG2 4.33Å
3065	S	91	Very high	81.5	Confident	33.6667 Å²	33.6667	64.6 Å²	64.6	24%	0.235	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	121.2	173.8	-57.1	0	0	0	0	109.6	V2757 T3096 K3097	V2757-S3065 WeakPolarHBondContact CG1-OG 3.41Å; V2757-S3065 CarbonylContact O-C 3.54Å; V2757-S3065 VanDerWaalsContact O-CA 3.3Å; V2757-S3065 WeakPolarHBondContact O-CA 3.36Å; S3065-T3096 CarbonylContact O-C 3.56Å; S3065-T3096 WeakPolarHBondContact O-CA 3.36Å; S3065-K3097 PolarHBondContact N-O 3.2Å; S3065-K3097 PolarHBondContact O-N 2.94Å
3066	E	93.3	Very high	84.3	Confident	4.66667 Å²	4.66667	56.9 Å²	56.9	2%	0.022	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	135.6	-174.5	-65.2	172	161.9	0	0	109.5	L2482 Q2483 G2484 V2757 T2758 L2759 R3064 Y3095 T3096	L2482-E3066 HydrophobicContact CD2-CB 4.33Å; Q2483-E3066 VanDerWaalsContact CB-OE1 3.29Å; Q2483-E3066 WeakPolarHBondContact CB-OE1 3.38Å; Q2483-E3066 PolarHBondContact N-OE1 3.17Å; Q2483-E3066 PolarHBondContact N-OE2 2.94Å; G2484-E3066 PolarHBondContact N-OE2 2.92Å; V2757-E3066 PolarHBondContact O-N 3.02Å; T2758-E3066 WeakPolarHBondContact CA-O 3.27Å; T2758-E3066 HydrophobicContact CG2-CB 3.93Å; T2758-E3066 WeakPolarHBondContact CG2-OE2 3.18Å; T2758-E3066 PolarHBondContact OG1-OE2 3.08Å; L2759-E3066 PolarHBondContact N-O 2.86Å; R3064-E3066 WeakPolarHBondContact CD-OE1 3.35Å; R3064-E3066 HydrophobicContact CG-CG 4.12Å; E3066-Y3095 CarbonylContact C-O 3.54Å; E3066-Y3095 VanDerWaalsContact CA-O 3.29Å; E3066-Y3095 WeakPolarHBondContact CA-O 3.41Å; E3066-T3096 HydrophobicContact CG-CG2 4.14Å
3067	V	92.8	Very high	86.4	Confident	41 Å²	41	51.8 Å²	51.8	25%	0.248	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	127.9	172.5	-178.2	0	0	0	0	108.1	L2759 L2784 F3069 Y3095	L2759-V3067 HydrophobicContact CB-CG2 4.39Å; L2759-V3067 HydrophobicContact CD2-CG1 4.32Å; L2759-V3067 CarbonylContact O-C 3.58Å; L2759-V3067 WeakPolarHBondContact O-CA 3.43Å; L2784-V3067 HydrophobicContact CD2-CG2 4.48Å; V3067-F3069 HydrophobicContact CG1-CE1 3.71Å; V3067-F3069 HydrophobicContact CG1-CE2 4.33Å; V3067-F3069 HydrophobicContact CG1-CZ 3.58Å; V3067-Y3095 HydrophobicContact CG2-CD1 4.5Å; V3067-Y3095 PolarHBondContact N-O 3.28Å; V3067-Y3095 PolarHBondContact O-N 3.12Å
3068	C	93.6	Very high	87.7	Confident	0.333333 Å²	0.333333	47.5 Å²	47.5	0%	0.002	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	139.5	-172.7	-173	0	0	0	0	111.7	V2478 L2482 L2759 L2760 H2761 F3093	V2478-C3068 WeakPolarHBondContact CG2-SG 3.42Å; L2482-C3068 HydrophobicContact CD1-CB 3.86Å; L2482-C3068 HydrophobicContact CD2-CB 3.81Å; L2482-C3068 HydrophobicContact CG-CB 4.42Å; L2759-C3068 PolarHBondContact O-N 3.24Å; L2760-C3068 HydrophobicContact CD1-CB 3.9Å; H2761-C3068 PolarHBondContact N-O 3.29Å; C3068-F3093 VanDerWaalsContact CA-O 3.32Å; C3068-F3093 WeakPolarHBondContact CA-O 3.43Å; C3068-F3093 PolarHBondContact SG-O 3.12Å
3069	F	92.3	Very high	88.5	Confident	34.6667 Å²	34.6667	48.4 Å²	48.4	15%	0.152	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	131.7	162.5	33.1	-87.2	0	0	0	110.9	H2761 L2764 V3067 A3072 L3090 F3093	H2761-F3069 HydrophobicContact CB-CB 4.21Å; H2761-F3069 HydrophobicContact CB-CD1 4.2Å; H2761-F3069 AromaticContact CD2-CD1 3.97Å; H2761-F3069 AromaticContact CD2-CE1 3.84Å; H2761-F3069 WeakPolarHBondContact O-CA 3.43Å; H2761-F3069 WeakPolarHBondContact O-CB 3.49Å; L2764-F3069 HydrophobicContact CD1-CB 4.21Å; L2764-F3069 HydrophobicContact CD1-CD1 4.05Å; L2764-F3069 HydrophobicContact CD1-CE1 3.83Å; L2764-F3069 HydrophobicContact CD1-CG 4.24Å; V3067-F3069 HydrophobicContact CG1-CE1 3.71Å; V3067-F3069 HydrophobicContact CG1-CE2 4.33Å; V3067-F3069 HydrophobicContact CG1-CZ 3.58Å; F3069-A3072 HydrophobicContact CB-CB 4.34Å; F3069-A3072 HydrophobicContact CD2-CB 3.53Å; F3069-A3072 HydrophobicContact CE1-CB 4.45Å; F3069-A3072 HydrophobicContact CE2-CB 3.35Å; F3069-A3072 HydrophobicContact CG-CB 4.22Å; F3069-A3072 HydrophobicContact CZ-CB 3.89Å; F3069-L3090 HydrophobicContact CE2-CB 3.73Å; F3069-L3090 HydrophobicContact CE2-CD1 4.4Å; F3069-L3090 HydrophobicContact CZ-CB 4.12Å; F3069-L3090 HydrophobicContact CZ-CD1 3.97Å; F3069-F3093 HydrophobicContact CB-CB 4.2Å; F3069-F3093 HydrophobicContact CD1-CB 3.91Å; F3069-F3093 AromaticContact CD1-CD1 3.54Å; F3069-F3093 HydrophobicContact CD1-CD1 3.54Å; F3069-F3093 HydrophobicContact CD1-CE1 4.35Å; F3069-F3093 AromaticContact CD1-CG 3.94Å; F3069-F3093 HydrophobicContact CD1-CG 3.94Å; F3069-F3093 HydrophobicContact CD2-CB 3.83Å; F3069-F3093 AromaticContact CD2-CD1 3.25Å; F3069-F3093 HydrophobicContact CD2-CD1 3.25Å; F3069-F3093 AromaticContact CD2-CE1 3.81Å; F3069-F3093 HydrophobicContact CD2-CE1 3.81Å; F3069-F3093 AromaticContact CD2-CG 3.77Å; F3069-F3093 HydrophobicContact CD2-CG 3.77Å; F3069-F3093 HydrophobicContact CE1-CB 3.61Å; F3069-F3093 AromaticContact CE1-CD1 3.35Å; F3069-F3093 HydrophobicContact CE1-CD1 3.35Å; F3069-F3093 HydrophobicContact CE1-CD2 4.16Å; F3069-F3093 HydrophobicContact CE1-CE1 4.03Å; F3069-F3093 AromaticContact CE1-CG 3.43Å; F3069-F3093 HydrophobicContact CE1-CG 3.43Å; F3069-F3093 VanDerWaalsContact CE1-CG 3.43Å; F3069-F3093 HydrophobicContact CE2-CB 3.37Å; F3069-F3093 AromaticContact CE2-CD1 3.59Å; F3069-F3093 HydrophobicContact CE2-CD1 3.59Å; F3069-F3093 AromaticContact CE2-CE1 3.61Å; F3069-F3093 HydrophobicContact CE2-CE1 3.61Å; F3069-F3093 HydrophobicContact CE2-CG 4.2Å; F3069-F3093 HydrophobicContact CE2-CZ 4.39Å; F3069-F3093 HydrophobicContact CG-CB 3.97Å; F3069-F3093 HydrophobicContact CG-CD1 4.22Å; F3069-F3093 HydrophobicContact CG-CG 4.49Å; F3069-F3093 HydrophobicContact CZ-CB 3.32Å; F3069-F3093 AromaticContact CZ-CD1 3.95Å; F3069-F3093 HydrophobicContact CZ-CD1 3.98Å; F3069-F3093 HydrophobicContact CZ-CD2 4.09Å; F3069-F3093 HydrophobicContact CZ-CE1 4.45Å; F3069-F3093 AromaticContact CZ-CG 3.53Å; F3069-F3093 HydrophobicContact CZ-CG 3.53Å; F3069-F3093 PolarHBondContact N-O 3.2Å; F3069-F3093 PolarHBondContact O-N 3.17Å
3070	E	91.1	Very high	88.8	Confident	48.3333 Å²	48.3333	50 Å²	50	23%	0.226	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	-42.6	-179.9	-53.7	-172.2	112.2	0	0	111.4	Q2475 V2478 V2479 L2760 H2761 H2762 R3091 G3092	Q2475-E3070 PolarHBondContact NE2-O 3.21Å; V2478-E3070 HydrophobicContact CG2-CG 4.22Å; V2479-E3070 HydrophobicContact CG2-CG 4.06Å; V2479-E3070 WeakPolarHBondContact CG2-OE1 3.45Å; L2760-E3070 HydrophobicContact CD1-CG 4.35Å; H2761-E3070 PolarHBondContact O-N 3.21Å; H2761-E3070 VanDerWaalsContact O-N 3.15Å; H2762-E3070 WeakPolarHBondContact CA-OE2 3.43Å; H2762-E3070 WeakPolarHBondContact CB-OE2 3.39Å; H2762-E3070 IonicContact CD2-OE2 3.48Å; H2762-E3070 PolarHBondContact CD2-OE2 3.25Å; H2762-E3070 VanDerWaalsContact CD2-OE2 3.27Å; H2762-E3070 IonicContact CG-OE2 2.95Å; H2762-E3070 WeakPolarHBondContact O-CB 3.32Å; H2762-E3070 PolarHBondContact O-N 3.13Å; E3070-R3091 CarbonylContact O-C 3.52Å; E3070-R3091 VanDerWaalsContact O-CA 3.24Å; E3070-R3091 WeakPolarHBondContact O-CA 3.35Å; E3070-R3091 WeakPolarHBondContact O-CB 3.48Å; E3070-G3092 PolarHBondContact O-N 3.25Å
3071	H	93.2	Very high	89	Confident	38 Å²	38	47 Å²	47	18%	0.176	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	128	175.8	-174.8	100.5	0	0	0	111.1	H2762 T2763 L2764 R3073 E3089 R3091	H2762-H3071 PolarHBondContact O-N 2.91Å; H2762-H3071 VanDerWaalsContact O-N 3.09Å; T2763-H3071 CarbonylContact C-O 3.55Å; T2763-H3071 WeakPolarHBondContact CA-O 3.34Å; L2764-H3071 PolarHBondContact N-O 3.38Å; H3071-R3073 PolarHBondContact NE2-NE 3.09Å; H3071-E3089 IonicContact CE1-OE1 2.84Å; H3071-E3089 PolarHBondContact CE1-OE1 3.14Å; H3071-E3089 IonicContact ND1-OE1 3.45Å; H3071-E3089 IonicContact NE2-OE1 3.67Å; H3071-R3091 PolarHBondContact ND1-NE 3.2Å
3072	A	94.7	Very high	88.9	Confident	8 Å²	8	52 Å²	52	7%	0.066	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	126.3	169.6	0	0	0	0	0	111.3	L2764 F3069 L3090	L2764-A3072 HydrophobicContact CB-CB 3.99Å; L2764-A3072 HydrophobicContact CD1-CB 4.44Å; L2764-A3072 CarbonylContact O-C 3.53Å; L2764-A3072 VanDerWaalsContact O-CA 3.3Å; L2764-A3072 WeakPolarHBondContact O-CA 3.19Å; F3069-A3072 HydrophobicContact CB-CB 4.34Å; F3069-A3072 HydrophobicContact CD2-CB 3.53Å; F3069-A3072 HydrophobicContact CE1-CB 4.45Å; F3069-A3072 HydrophobicContact CE2-CB 3.35Å; F3069-A3072 HydrophobicContact CG-CB 4.22Å; F3069-A3072 HydrophobicContact CZ-CB 3.89Å; A3072-L3090 HydrophobicContact CB-CB 4.4Å; A3072-L3090 PolarHBondContact N-O 3.43Å; A3072-L3090 PolarHBondContact O-N 3.16Å
3073	R	95	Very high	89.1	Confident	114 Å²	114	52.9 Å²	52.9	43%	0.43	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	125.6	170.9	-146.8	178.7	179.3	175.4	0.1	109.4	L2764 N2765 V2766 H3071 D3087 V3088 E3089	L2764-R3073 PolarHBondContact O-N 3.27Å; N2765-R3073 CarbonylContact C-O 3.48Å; N2765-R3073 WeakPolarHBondContact CA-O 3.29Å; V2766-R3073 PolarHBondContact N-O 3.13Å; H3071-R3073 PolarHBondContact NE2-NE 3.09Å; R3073-D3087 IonicContact CZ-OD2 3.21Å; R3073-D3087 IonicContact NE-OD2 3.31Å; R3073-D3087 PolarHBondContact NE-OD2 2.97Å; R3073-D3087 IonicContact NH2-OD2 3Å; R3073-D3087 PolarHBondContact NH2-OD2 3.36Å; R3073-V3088 CarbonylContact C-O 3.52Å; R3073-V3088 VanDerWaalsContact CA-O 3.3Å; R3073-V3088 WeakPolarHBondContact CA-O 3.37Å; R3073-E3089 HydrophobicContact CG-CB 4.18Å; R3073-E3089 HydrophobicContact CG-CG 3.97Å; R3073-E3089 IonicContact CZ-OE1 3.68Å; R3073-E3089 VanDerWaalsContact CZ-OE1 3.28Å; R3073-E3089 IonicContact NE-OE1 3.75Å; R3073-E3089 PolarHBondContact NE-OE1 3.45Å; R3073-E3089 IonicContact NH2-OE1 3.84Å; R3073-E3089 PolarHBondContact NH2-OE1 3.49Å; R3073-E3089 IonicContact NH2-OE2 3.16Å
3074	W	95.3	Very high	89.2	Confident	49.6667 Å²	49.6667	48.2 Å²	48.2	19%	0.188	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	114.8	-177.3	174.7	28.7	0	0	0	111.4	V2766 T2768 Y2773 M3076 V3088 F3185 F3186	V2766-W3074 HydrophobicContact CB-CB 4.24Å; V2766-W3074 HydrophobicContact CB-CG 4.39Å; V2766-W3074 HydrophobicContact CG1-CG 4.39Å; V2766-W3074 CarbonylContact O-C 3.5Å; V2766-W3074 WeakPolarHBondContact O-CA 3.31Å; T2768-W3074 PolarHBondContact OG1-NE1 3.02Å; Y2773-W3074 AromaticContact CD2-CH2 3.78Å; Y2773-W3074 HydrophobicContact CD2-CH2 3.78Å; Y2773-W3074 AromaticContact CD2-CZ2 3.82Å; Y2773-W3074 HydrophobicContact CD2-CZ2 3.82Å; Y2773-W3074 AromaticContact CE2-CH2 3.86Å; Y2773-W3074 HydrophobicContact CE2-CH2 3.86Å; Y2773-W3074 HydrophobicContact CE2-CZ2 4.3Å; Y2773-W3074 HydrophobicContact CG-CH2 4.49Å; Y2773-W3074 HydrophobicContact CG-CZ2 4.4Å; W3074-M3076 HydrophobicContact CD2-CE 3.8Å; W3074-M3076 HydrophobicContact CD2-CG 4.18Å; W3074-M3076 HydrophobicContact CE3-CE 3.42Å; W3074-M3076 VanDerWaalsContact CE3-CE 3.42Å; W3074-M3076 HydrophobicContact CE3-CG 4.43Å; W3074-M3076 HydrophobicContact CH2-CE 3.63Å; W3074-M3076 HydrophobicContact CH2-CG 4.29Å; W3074-M3076 HydrophobicContact CH2-SD 4.17Å; W3074-M3076 HydrophobicContact CZ2-CE 3.91Å; W3074-M3076 HydrophobicContact CZ2-CG 3.96Å; W3074-M3076 HydrophobicContact CZ2-SD 4.34Å; W3074-M3076 HydrophobicContact CZ3-CE 3.66Å; W3074-M3076 HydrophobicContact CZ3-SD 4.27Å; W3074-V3088 HydrophobicContact CB-CB 4.39Å; W3074-V3088 HydrophobicContact CE3-CB 4.17Å; W3074-V3088 HydrophobicContact CE3-CG1 4.4Å; W3074-V3088 HydrophobicContact CE3-CG2 4.08Å; W3074-V3088 PolarHBondContact N-O 3.12Å; W3074-V3088 PolarHBondContact O-N 3.05Å; W3074-F3185 HydrophobicContact CH2-CE1 4.35Å; W3074-F3185 AromaticContact CZ2-CE1 3.93Å; W3074-F3185 HydrophobicContact CZ2-CE1 3.93Å; W3074-F3185 HydrophobicContact CZ2-CZ 4.17Å; W3074-F3186 AromaticContact CH2-CE1 3.97Å; W3074-F3186 HydrophobicContact CH2-CE1 3.97Å; W3074-F3186 HydrophobicContact CH2-CZ 4.16Å; W3074-F3186 HydrophobicContact CZ3-CE1 4.42Å
3075	R	94.4	Very high	89.4	Confident	102.667 Å²	102.667	48.3 Å²	48.3	39%	0.387	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	122	168.4	-177.4	159.3	-69.3	159.8	4.6	110.4	V2766 S2767 T2768 T3077 A3086 D3087 L3119	V2766-R3075 PolarHBondContact O-N 3.27Å; S2767-R3075 CarbonylContact C-O 3.57Å; S2767-R3075 VanDerWaalsContact CA-O 3.25Å; S2767-R3075 WeakPolarHBondContact CA-O 3.44Å; T2768-R3075 PolarHBondContact N-O 2.91Å; R3075-T3077 HydrophobicContact CG-CG2 4.06Å; R3075-A3086 WeakPolarHBondContact CA-O 3.46Å; R3075-D3087 WeakPolarHBondContact CB-OD1 3.45Å; R3075-D3087 WeakPolarHBondContact CG-OD1 3.26Å; R3075-D3087 IonicContact CZ-OD1 2.83Å; R3075-D3087 VanDerWaalsContact CZ-OD1 3.3Å; R3075-D3087 IonicContact CZ-OD2 3.12Å; R3075-D3087 IonicContact NE-OD1 3.25Å; R3075-D3087 PolarHBondContact NE-OD1 3.07Å; R3075-D3087 IonicContact NE-OD2 3.69Å; R3075-D3087 VanDerWaalsContact NH2-CG 3.34Å; R3075-D3087 IonicContact NH2-OD1 3.66Å; R3075-D3087 PolarHBondContact NH2-OD1 3.32Å; R3075-D3087 IonicContact NH2-OD2 3.08Å; R3075-D3087 PolarHBondContact NH2-OD2 3.02Å; R3075-L3119 HydrophobicContact CG-CD1 4.43Å
3076	M	93.8	Very high	89.6	Confident	6 Å²	6	46.7 Å²	46.7	3%	0.03	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	131.3	170.7	-60.6	165	152.1	0	0	108.1	W3074 L3085 A3086 V3088 M3182 F3185 F3186	W3074-M3076 HydrophobicContact CD2-CE 3.8Å; W3074-M3076 HydrophobicContact CD2-CG 4.18Å; W3074-M3076 HydrophobicContact CE3-CE 3.42Å; W3074-M3076 VanDerWaalsContact CE3-CE 3.42Å; W3074-M3076 HydrophobicContact CE3-CG 4.43Å; W3074-M3076 HydrophobicContact CH2-CE 3.63Å; W3074-M3076 HydrophobicContact CH2-CG 4.29Å; W3074-M3076 HydrophobicContact CH2-SD 4.17Å; W3074-M3076 HydrophobicContact CZ2-CE 3.91Å; W3074-M3076 HydrophobicContact CZ2-CG 3.96Å; W3074-M3076 HydrophobicContact CZ2-SD 4.34Å; W3074-M3076 HydrophobicContact CZ3-CE 3.66Å; W3074-M3076 HydrophobicContact CZ3-SD 4.27Å; M3076-L3085 HydrophobicContact CB-CB 4.49Å; M3076-L3085 WeakPolarHBondContact O-CB 3.42Å; M3076-L3085 PolarHBondContact O-N 3.15Å; M3076-A3086 HydrophobicContact CB-CB 4.36Å; M3076-A3086 HydrophobicContact CG-CB 4.43Å; M3076-A3086 PolarHBondContact N-O 3.19Å; M3076-A3086 PolarHBondContact O-N 3.03Å; M3076-A3086 HydrophobicContact SD-CB 3.99Å; M3076-V3088 HydrophobicContact CE-CG2 3.47Å; M3076-V3088 VanDerWaalsContact CE-CG2 3.47Å; M3076-V3088 HydrophobicContact CG-CG2 4.35Å; M3076-V3088 HydrophobicContact SD-CG2 4.04Å; M3076-M3182 HydrophobicContact CE-CE 3.99Å; M3076-M3182 HydrophobicContact CE-SD 3.39Å; M3076-M3182 WeakPolarHBondContact CE-SD 3.28Å; M3076-M3182 HydrophobicContact CG-CE 4.42Å; M3076-M3182 HydrophobicContact SD-CE 3.41Å; M3076-M3182 WeakPolarHBondContact SD-CE 3.36Å; M3076-M3182 HydrophobicContact SD-SD 4.19Å; M3076-F3185 HydrophobicContact CB-CD2 4.5Å; M3076-F3185 HydrophobicContact CB-CE1 4.34Å; M3076-F3185 HydrophobicContact CB-CE2 3.97Å; M3076-F3185 HydrophobicContact CB-CZ 3.95Å; M3076-F3185 HydrophobicContact CE-CD1 3.24Å; M3076-F3185 HydrophobicContact CE-CD2 4.28Å; M3076-F3185 HydrophobicContact CE-CE1 3.28Å; M3076-F3185 HydrophobicContact CE-CE2 4.28Å; M3076-F3185 HydrophobicContact CE-CG 3.8Å; M3076-F3185 HydrophobicContact CE-CZ 3.83Å; M3076-F3185 HydrophobicContact CG-CE1 3.94Å; M3076-F3185 HydrophobicContact CG-CE2 4.41Å; M3076-F3185 HydrophobicContact CG-CZ 3.8Å; M3076-F3186 HydrophobicContact CE-CD2 4.48Å; M3076-F3186 HydrophobicContact CE-CE1 4.17Å; M3076-F3186 HydrophobicContact CE-CE2 3.72Å; M3076-F3186 HydrophobicContact CE-CZ 3.57Å; M3076-F3186 VanDerWaalsContact CE-CZ 3.45Å; M3076-F3186 HydrophobicContact SD-CZ 4.26Å
3077	T	91.6	Very high	89.7	Confident	2 Å²	2	47.8 Å²	47.8	1%	0.012	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	162.3	-178.4	61.5	0	0	0	0	113.2	S2767 T2768 N2769 R3075 G3081 I3083 F3185	S2767-T3077 WeakPolarHBondContact OG-CG2 3.34Å; T2768-T3077 VanDerWaalsContact C-OG1 3.23Å; T2768-T3077 PolarHBondContact O-N 3.17Å; T2768-T3077 PolarHBondContact O-OG1 3.26Å; N2769-T3077 WeakPolarHBondContact CA-OG1 3.33Å; N2769-T3077 PolarHBondContact N-OG1 3.11Å; R3075-T3077 HydrophobicContact CG-CG2 4.06Å; T3077-G3081 WeakPolarHBondContact OG1-CA 3.4Å; T3077-I3083 CarbonylContact C-O 3.53Å; T3077-I3083 WeakPolarHBondContact CA-O 3.42Å; T3077-I3083 VanDerWaalsContact CB-O 3.3Å; T3077-I3083 WeakPolarHBondContact CB-O 3.42Å; T3077-F3185 WeakPolarHBondContact O-CE2 3.38Å
3078	E	86.3	Confident	89.8	Confident	82 Å²	82	46.4 Å²	46.4	38%	0.383	22%	0.222	S	C	.	.			trans	-63.7	170.7	165.5	-66.2	-167.4	-170.2	0	0	111.6	N2769 D3080 G3081 I3083 L3085	N2769-E3078 WeakPolarHBondContact CB-O 3.34Å; E3078-D3080 PolarHBondContact O-N 3Å; E3078-D3080 VanDerWaalsContact O-N 3.1Å; E3078-G3081 PolarHBondContact O-N 3.46Å; E3078-I3083 HydrophobicContact CB-CB 4.19Å; E3078-I3083 HydrophobicContact CG-CB 4Å; E3078-I3083 HydrophobicContact CG-CG2 4.11Å; E3078-I3083 PolarHBondContact N-O 3.26Å; E3078-L3085 HydrophobicContact CG-CD1 4.02Å; E3078-L3085 HydrophobicContact CG-CD2 3.39Å; E3078-L3085 VanDerWaalsContact CG-CD2 3.42Å; E3078-L3085 HydrophobicContact CG-CG 3.82Å; E3078-L3085 WeakPolarHBondContact OE1-CD2 3.28Å
3079	N	81	Confident	89.9	Confident	120 Å²	120	47.8 Å²	47.8	64%	0.642	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-26.5	-174.8	-65.9	7.9	0	0	0	113.2	N2769 S2770 G3081	N2769-N3079 PolarHBondContact ND2-O 2.93Å; S2770-N3079 PolarHBondContact OG-OD1 3.14Å; S2770-N3079 VanDerWaalsContact OG-OD1 3.07Å; N3079-G3081 VanDerWaalsContact C-N 3.25Å; N3079-G3081 PolarHBondContact O-N 3.16Å
3080	D	75.8	Confident	90	Very high	61.3333 Å²	61.3333	47.9 Å²	47.9	33%	0.328	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-13.5	176.6	75.4	-13.8	0	0	0	114.3	E3078 Q3082 I3083	E3078-D3080 PolarHBondContact O-N 3Å; E3078-D3080 VanDerWaalsContact O-N 3.1Å; D3080-Q3082 VanDerWaalsContact C-N 3.28Å; D3080-Q3082 PolarHBondContact O-N 3.1Å; D3080-Q3082 PolarHBondContact OD1-N 3.11Å; D3080-Q3082 WeakPolarHBondContact OD2-CB 3.48Å; D3080-I3083 PolarHBondContact OD1-N 3.02Å
3081	G	78.8	Confident	90.1	Very high	2.66667 Å²	2.66667	47.5 Å²	47.5	3%	0.027	23%	0.227	C	C	.	.	S	Bend	trans	77.4	-0.5	-176.9	0	0	0	0	0	115.2	Q2708 T3077 E3078 N3079	Q2708-G3081 PolarHBondContact NE2-O 3.31Å; T3077-G3081 WeakPolarHBondContact OG1-CA 3.4Å; E3078-G3081 PolarHBondContact O-N 3.46Å; N3079-G3081 VanDerWaalsContact C-N 3.25Å; N3079-G3081 PolarHBondContact O-N 3.16Å
3082	Q	78	Confident	89.9	Confident	146.667 Å²	146.667	45.8 Å²	45.8	69%	0.685	22%	0.22	S	C	*	.			trans	-106.1	-43.3	-171.5	-56.2	-179.4	43.3	0	0	112.6	D3080 G3084	D3080-Q3082 VanDerWaalsContact C-N 3.28Å; D3080-Q3082 PolarHBondContact O-N 3.1Å; D3080-Q3082 PolarHBondContact OD1-N 3.11Å; D3080-Q3082 WeakPolarHBondContact OD2-CB 3.48Å; Q3082-G3084 PolarHBondContact O-N 3.26Å
3083	I	83.8	Confident	89.9	Confident	85.3333 Å²	85.3333	47.3 Å²	47.3	44%	0.438	23%	0.225	S	C	.	.	S	Bend	trans	-82.2	117.7	-177.1	-60.2	178.5	0	0	0	109.8	T3077 E3078 D3080	T3077-I3083 CarbonylContact C-O 3.53Å; T3077-I3083 WeakPolarHBondContact CA-O 3.42Å; T3077-I3083 VanDerWaalsContact CB-O 3.3Å; T3077-I3083 WeakPolarHBondContact CB-O 3.42Å; E3078-I3083 HydrophobicContact CB-CB 4.19Å; E3078-I3083 HydrophobicContact CG-CB 4Å; E3078-I3083 HydrophobicContact CG-CG2 4.11Å; E3078-I3083 PolarHBondContact N-O 3.26Å; D3080-I3083 PolarHBondContact OD1-N 3.02Å
3084	G	88.9	Confident	89.9	Confident	20.3333 Å²	20.3333	42.2 Å²	42.2	21%	0.21	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	129.5	174.2	0	0	0	0	0	112.4	Q3082 L3119	Q3082-G3084 PolarHBondContact O-N 3.26Å; G3084-L3119 VanDerWaalsContact O-CB 3.29Å; G3084-L3119 WeakPolarHBondContact O-CB 3.3Å
3085	L	92.1	Very high	89.8	Confident	13.3333 Å²	13.3333	42.8 Å²	42.8	7%	0.07	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	-44.4	178.6	-63	179.4	0	0	0	112.1	M3076 E3078 L3119 I3181 M3182 F3185	M3076-L3085 HydrophobicContact CB-CB 4.49Å; M3076-L3085 WeakPolarHBondContact O-CB 3.42Å; M3076-L3085 PolarHBondContact O-N 3.15Å; E3078-L3085 HydrophobicContact CG-CD1 4.02Å; E3078-L3085 HydrophobicContact CG-CD2 3.39Å; E3078-L3085 VanDerWaalsContact CG-CD2 3.42Å; E3078-L3085 HydrophobicContact CG-CG 3.82Å; E3078-L3085 WeakPolarHBondContact OE1-CD2 3.28Å; L3085-L3119 PolarHBondContact O-N 3.21Å; L3085-I3181 HydrophobicContact CB-CG2 3.99Å; L3085-I3181 HydrophobicContact CD1-CG2 3.74Å; L3085-I3181 HydrophobicContact CD2-CG2 3.52Å; L3085-I3181 VanDerWaalsContact CD2-CG2 3.44Å; L3085-I3181 HydrophobicContact CG-CG2 3.94Å; L3085-M3182 HydrophobicContact CB-SD 4.47Å; L3085-F3185 HydrophobicContact CD1-CD2 4.25Å
3086	A	94.7	Very high	89.7	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	148.6	179	0	0	0	0	0	111.3	R3075 M3076 C3117 F3178 M3182	R3075-A3086 WeakPolarHBondContact CA-O 3.46Å; M3076-A3086 HydrophobicContact CB-CB 4.36Å; M3076-A3086 HydrophobicContact CG-CB 4.43Å; M3076-A3086 PolarHBondContact N-O 3.19Å; M3076-A3086 PolarHBondContact O-N 3.03Å; M3076-A3086 HydrophobicContact SD-CB 3.99Å; A3086-C3117 CarbonylContact C-O 3.45Å; A3086-C3117 WeakPolarHBondContact CA-O 3.39Å; A3086-C3117 WeakPolarHBondContact CB-O 3.35Å; A3086-F3178 HydrophobicContact CB-CE2 3.9Å; A3086-F3178 HydrophobicContact CB-CZ 4.14Å; A3086-M3182 HydrophobicContact CB-CE 3.59Å; A3086-M3182 HydrophobicContact CB-SD 4.22Å
3087	D	95.6	Very high	89.6	Confident	26.6667 Å²	26.6667	42 Å²	42	14%	0.143	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	127	162.2	-86.7	-1.2	0	0	0	108.2	R3073 R3075 V3116 C3117	R3073-D3087 IonicContact CZ-OD2 3.21Å; R3073-D3087 IonicContact NE-OD2 3.31Å; R3073-D3087 PolarHBondContact NE-OD2 2.97Å; R3073-D3087 IonicContact NH2-OD2 3Å; R3073-D3087 PolarHBondContact NH2-OD2 3.36Å; R3075-D3087 WeakPolarHBondContact CB-OD1 3.45Å; R3075-D3087 WeakPolarHBondContact CG-OD1 3.26Å; R3075-D3087 IonicContact CZ-OD1 2.83Å; R3075-D3087 VanDerWaalsContact CZ-OD1 3.3Å; R3075-D3087 IonicContact CZ-OD2 3.12Å; R3075-D3087 IonicContact NE-OD1 3.25Å; R3075-D3087 PolarHBondContact NE-OD1 3.07Å; R3075-D3087 IonicContact NE-OD2 3.69Å; R3075-D3087 VanDerWaalsContact NH2-CG 3.34Å; R3075-D3087 IonicContact NH2-OD1 3.66Å; R3075-D3087 PolarHBondContact NH2-OD1 3.32Å; R3075-D3087 IonicContact NH2-OD2 3.08Å; R3075-D3087 PolarHBondContact NH2-OD2 3.02Å; D3087-V3116 CarbonylContact O-C 3.5Å; D3087-V3116 WeakPolarHBondContact O-CA 3.45Å; D3087-C3117 HydrophobicContact CB-CB 4.44Å; D3087-C3117 PolarHBondContact N-O 3.18Å; D3087-C3117 PolarHBondContact O-N 2.9Å
3088	V	95.9	Very high	89.5	Confident	12.3333 Å²	12.3333	42.5 Å²	42.5	8%	0.075	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	136.8	171.7	-177.5	0	0	0	0	108.7	R3073 W3074 M3076 L3090 R3115 V3116	R3073-V3088 CarbonylContact C-O 3.52Å; R3073-V3088 VanDerWaalsContact CA-O 3.3Å; R3073-V3088 WeakPolarHBondContact CA-O 3.37Å; W3074-V3088 HydrophobicContact CB-CB 4.39Å; W3074-V3088 HydrophobicContact CE3-CB 4.17Å; W3074-V3088 HydrophobicContact CE3-CG1 4.4Å; W3074-V3088 HydrophobicContact CE3-CG2 4.08Å; W3074-V3088 PolarHBondContact N-O 3.12Å; W3074-V3088 PolarHBondContact O-N 3.05Å; M3076-V3088 HydrophobicContact CE-CG2 3.47Å; M3076-V3088 VanDerWaalsContact CE-CG2 3.47Å; M3076-V3088 HydrophobicContact CG-CG2 4.35Å; M3076-V3088 HydrophobicContact SD-CG2 4.04Å; V3088-L3090 HydrophobicContact CG1-CD2 4.13Å; V3088-L3090 HydrophobicContact CG1-CG 4.11Å; V3088-R3115 CarbonylContact C-O 3.54Å; V3088-R3115 WeakPolarHBondContact CA-O 3.39Å; V3088-V3116 HydrophobicContact CG1-CG2 4.25Å; V3088-V3116 HydrophobicContact CG2-CG1 4.24Å; V3088-V3116 HydrophobicContact CG2-CG2 4.19Å
3089	E	95.6	Very high	89.4	Confident	29 Å²	29	41.8 Å²	41.8	14%	0.136	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	130.3	173.3	-172.9	-176.2	-178.6	0	0	108.7	H3071 R3073 R3091 I3114 R3115	H3071-E3089 IonicContact CE1-OE1 2.84Å; H3071-E3089 PolarHBondContact CE1-OE1 3.14Å; H3071-E3089 IonicContact ND1-OE1 3.45Å; H3071-E3089 IonicContact NE2-OE1 3.67Å; R3073-E3089 HydrophobicContact CG-CB 4.18Å; R3073-E3089 HydrophobicContact CG-CG 3.97Å; R3073-E3089 IonicContact CZ-OE1 3.68Å; R3073-E3089 VanDerWaalsContact CZ-OE1 3.28Å; R3073-E3089 IonicContact NE-OE1 3.75Å; R3073-E3089 PolarHBondContact NE-OE1 3.45Å; R3073-E3089 IonicContact NH2-OE1 3.84Å; R3073-E3089 PolarHBondContact NH2-OE1 3.49Å; R3073-E3089 IonicContact NH2-OE2 3.16Å; E3089-R3091 IonicContact OE1-CZ 3.14Å; E3089-R3091 VanDerWaalsContact OE1-CZ 3.24Å; E3089-R3091 IonicContact OE1-NE 2.96Å; E3089-R3091 PolarHBondContact OE1-NE 3.2Å; E3089-R3091 IonicContact OE1-NH2 2.73Å; E3089-R3091 PolarHBondContact OE1-NH2 2.98Å; E3089-I3114 CarbonylContact O-C 3.56Å; E3089-I3114 VanDerWaalsContact O-CA 3.28Å; E3089-I3114 WeakPolarHBondContact O-CA 3.38Å; E3089-R3115 HydrophobicContact CB-CB 4.07Å; E3089-R3115 PolarHBondContact N-O 3.3Å; E3089-R3115 PolarHBondContact O-N 3.03Å
3090	L	94.4	Very high	89.4	Confident	36.6667 Å²	36.6667	39 Å²	39	19%	0.192	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	131.5	-179.3	-59.5	172.2	0	0	0	107.8	F3069 A3072 V3088 L3111 W3113 I3114	F3069-L3090 HydrophobicContact CE2-CB 3.73Å; F3069-L3090 HydrophobicContact CE2-CD1 4.4Å; F3069-L3090 HydrophobicContact CZ-CB 4.12Å; F3069-L3090 HydrophobicContact CZ-CD1 3.97Å; A3072-L3090 HydrophobicContact CB-CB 4.4Å; A3072-L3090 PolarHBondContact N-O 3.43Å; A3072-L3090 PolarHBondContact O-N 3.16Å; V3088-L3090 HydrophobicContact CG1-CD2 4.13Å; V3088-L3090 HydrophobicContact CG1-CG 4.11Å; L3090-L3111 HydrophobicContact CB-CD1 4.06Å; L3090-L3111 HydrophobicContact CD2-CD1 4.07Å; L3090-L3111 HydrophobicContact CD2-CD2 3.85Å; L3090-L3111 HydrophobicContact CD2-CG 4.48Å; L3090-W3113 WeakPolarHBondContact CA-O 3.42Å; L3090-I3114 HydrophobicContact CD2-CB 4.19Å; L3090-I3114 HydrophobicContact CD2-CD1 3.74Å; L3090-I3114 HydrophobicContact CD2-CG1 3.7Å
3091	R	92.3	Very high	89.4	Confident	41 Å²	41	40.6 Å²	40.6	16%	0.155	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	149	171.8	-50.7	-168.7	-169.5	177	11.5	112.1	E2472 E3070 H3071 E3089 G3112 W3113	E2472-R3091 VanDerWaalsContact CD-NH1 3.29Å; E2472-R3091 IonicContact OE1-CZ 3.33Å; E2472-R3091 VanDerWaalsContact OE1-CZ 3.29Å; E2472-R3091 IonicContact OE1-NH1 3.19Å; E2472-R3091 PolarHBondContact OE1-NH1 3.15Å; E2472-R3091 IonicContact OE1-NH2 3.2Å; E2472-R3091 PolarHBondContact OE1-NH2 2.86Å; E2472-R3091 IonicContact OE2-CZ 3.07Å; E2472-R3091 IonicContact OE2-NH1 3.83Å; E2472-R3091 PolarHBondContact OE2-NH1 2.92Å; E2472-R3091 IonicContact OE2-NH2 2.71Å; E3070-R3091 CarbonylContact O-C 3.52Å; E3070-R3091 VanDerWaalsContact O-CA 3.24Å; E3070-R3091 WeakPolarHBondContact O-CA 3.35Å; E3070-R3091 WeakPolarHBondContact O-CB 3.48Å; H3071-R3091 PolarHBondContact ND1-NE 3.2Å; E3089-R3091 IonicContact OE1-CZ 3.14Å; E3089-R3091 VanDerWaalsContact OE1-CZ 3.24Å; E3089-R3091 IonicContact OE1-NE 2.96Å; E3089-R3091 PolarHBondContact OE1-NE 3.2Å; E3089-R3091 IonicContact OE1-NH2 2.73Å; E3089-R3091 PolarHBondContact OE1-NH2 2.98Å; R3091-G3112 CarbonylContact O-C 3.51Å; R3091-G3112 VanDerWaalsContact O-CA 3.28Å; R3091-G3112 WeakPolarHBondContact O-CA 3.31Å; R3091-G3112 PolarHBondContact O-N 3.18Å; R3091-W3113 HydrophobicContact CB-CB 4.04Å; R3091-W3113 HydrophobicContact CG-CB 4.42Å; R3091-W3113 PolarHBondContact N-O 3.14Å; R3091-W3113 VanDerWaalsContact N-O 3.08Å; R3091-W3113 PolarHBondContact O-N 2.87Å
3092	G	90.6	Very high	89.3	Confident	2.66667 Å²	2.66667	43.6 Å²	43.6	3%	0.027	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	58.9	53.8	180	0	0	0	0	0	112.5	E3070 L3111 G3112	E3070-G3092 PolarHBondContact O-N 3.25Å; G3092-L3111 CarbonylContact O-C 3.48Å; G3092-L3111 WeakPolarHBondContact O-CA 3.24Å; G3092-G3112 PolarHBondContact O-N 3.14Å
3093	F	94.2	Very high	89.3	Confident	38.6667 Å²	38.6667	40.1 Å²	40.1	17%	0.17	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	127.9	174.1	175.3	-91	0	0	0	110.5	C3068 F3069 L3109 E3110 L3111	C3068-F3093 VanDerWaalsContact CA-O 3.32Å; C3068-F3093 WeakPolarHBondContact CA-O 3.43Å; C3068-F3093 PolarHBondContact SG-O 3.12Å; F3069-F3093 HydrophobicContact CB-CB 4.2Å; F3069-F3093 HydrophobicContact CD1-CB 3.91Å; F3069-F3093 AromaticContact CD1-CD1 3.54Å; F3069-F3093 HydrophobicContact CD1-CD1 3.54Å; F3069-F3093 HydrophobicContact CD1-CE1 4.35Å; F3069-F3093 AromaticContact CD1-CG 3.94Å; F3069-F3093 HydrophobicContact CD1-CG 3.94Å; F3069-F3093 HydrophobicContact CD2-CB 3.83Å; F3069-F3093 AromaticContact CD2-CD1 3.25Å; F3069-F3093 HydrophobicContact CD2-CD1 3.25Å; F3069-F3093 AromaticContact CD2-CE1 3.81Å; F3069-F3093 HydrophobicContact CD2-CE1 3.81Å; F3069-F3093 AromaticContact CD2-CG 3.77Å; F3069-F3093 HydrophobicContact CD2-CG 3.77Å; F3069-F3093 HydrophobicContact CE1-CB 3.61Å; F3069-F3093 AromaticContact CE1-CD1 3.35Å; F3069-F3093 HydrophobicContact CE1-CD1 3.35Å; F3069-F3093 HydrophobicContact CE1-CD2 4.16Å; F3069-F3093 HydrophobicContact CE1-CE1 4.03Å; F3069-F3093 AromaticContact CE1-CG 3.43Å; F3069-F3093 HydrophobicContact CE1-CG 3.43Å; F3069-F3093 VanDerWaalsContact CE1-CG 3.43Å; F3069-F3093 HydrophobicContact CE2-CB 3.37Å; F3069-F3093 AromaticContact CE2-CD1 3.59Å; F3069-F3093 HydrophobicContact CE2-CD1 3.59Å; F3069-F3093 AromaticContact CE2-CE1 3.61Å; F3069-F3093 HydrophobicContact CE2-CE1 3.61Å; F3069-F3093 HydrophobicContact CE2-CG 4.2Å; F3069-F3093 HydrophobicContact CE2-CZ 4.39Å; F3069-F3093 HydrophobicContact CG-CB 3.97Å; F3069-F3093 HydrophobicContact CG-CD1 4.22Å; F3069-F3093 HydrophobicContact CG-CG 4.49Å; F3069-F3093 HydrophobicContact CZ-CB 3.32Å; F3069-F3093 AromaticContact CZ-CD1 3.95Å; F3069-F3093 HydrophobicContact CZ-CD1 3.98Å; F3069-F3093 HydrophobicContact CZ-CD2 4.09Å; F3069-F3093 HydrophobicContact CZ-CE1 4.45Å; F3069-F3093 AromaticContact CZ-CG 3.53Å; F3069-F3093 HydrophobicContact CZ-CG 3.53Å; F3069-F3093 PolarHBondContact N-O 3.2Å; F3069-F3093 PolarHBondContact O-N 3.17Å; F3093-L3109 HydrophobicContact CE2-CD1 4.02Å; F3093-L3109 HydrophobicContact CE2-CD2 4.38Å; F3093-L3109 HydrophobicContact CE2-CG 4.03Å; F3093-L3109 HydrophobicContact CZ-CD1 4.36Å; F3093-L3109 HydrophobicContact CZ-CG 4.5Å; F3093-E3110 WeakPolarHBondContact CA-O 3.33Å; F3093-L3111 HydrophobicContact CB-CD1 4.14Å; F3093-L3111 HydrophobicContact CD2-CD1 4.41Å
3094	I	93.9	Very high	89.3	Confident	8 Å²	8	36.4 Å²	36.4	4%	0.041	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	132.3	168.6	-146.8	171.8	0	0	0	109.7	V2478 Q2481 L2482 L3109 E3110	V2478-I3094 HydrophobicContact CB-CB 4.39Å; V2478-I3094 HydrophobicContact CB-CD1 3.7Å; V2478-I3094 HydrophobicContact CB-CG1 3.69Å; V2478-I3094 HydrophobicContact CG1-CB 4.25Å; V2478-I3094 HydrophobicContact CG1-CD1 3.71Å; V2478-I3094 HydrophobicContact CG1-CG1 3.71Å; V2478-I3094 HydrophobicContact CG1-CG2 4.08Å; Q2481-I3094 HydrophobicContact CB-CD1 3.89Å; Q2481-I3094 HydrophobicContact CG-CD1 4.34Å; L2482-I3094 HydrophobicContact CD2-CD1 3.67Å; L2482-I3094 HydrophobicContact CD2-CG1 4.15Å; L2482-I3094 HydrophobicContact CD2-CG2 4.48Å; I3094-L3109 CarbonylContact O-C 3.59Å; I3094-L3109 WeakPolarHBondContact O-CA 3.39Å; I3094-E3110 HydrophobicContact CG2-CB 3.82Å; I3094-E3110 HydrophobicContact CG2-CG 4.2Å; I3094-E3110 PolarHBondContact N-O 3.01Å; I3094-E3110 PolarHBondContact O-N 2.94Å
3095	Y	94.5	Very high	89.2	Confident	62 Å²	62	35.9 Å²	35.9	24%	0.243	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	125.6	167.4	173.8	-106.1	0	0	0	110	E3066 V3067 K3097 H3107 R3108 L3109	E3066-Y3095 CarbonylContact C-O 3.54Å; E3066-Y3095 VanDerWaalsContact CA-O 3.29Å; E3066-Y3095 WeakPolarHBondContact CA-O 3.41Å; V3067-Y3095 HydrophobicContact CG2-CD1 4.5Å; V3067-Y3095 PolarHBondContact N-O 3.28Å; V3067-Y3095 PolarHBondContact O-N 3.12Å; Y3095-K3097 HydrophobicContact CE1-CB 4.16Å; Y3095-H3107 HydrophobicContact CE2-CB 4.47Å; Y3095-H3107 AromaticContact CE2-ND1 3.88Å; Y3095-H3107 AromaticContact CZ-ND1 3.76Å; Y3095-H3107 PolarHBondContact OH-CE1 3.18Å; Y3095-H3107 VanDerWaalsContact OH-CE1 3.28Å; Y3095-H3107 PolarHBondContact OH-ND1 3.14Å; Y3095-R3108 CarbonylContact C-O 3.52Å; Y3095-R3108 WeakPolarHBondContact CA-O 3.34Å; Y3095-R3108 VanDerWaalsContact CD2-O 3.32Å; Y3095-R3108 WeakPolarHBondContact CD2-O 3.45Å; Y3095-L3109 HydrophobicContact CD2-CB 4.2Å; Y3095-L3109 HydrophobicContact CD2-CD1 4.38Å
3096	T	92.8	Very high	89.1	Confident	23 Å²	23	36.9 Å²	36.9	14%	0.141	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	126.9	176.4	-51.4	0	0	0	0	109.7	R3064 S3065 E3066 T3098 H3107 R3108	R3064-T3096 HydrophobicContact CG-CG2 4.17Å; S3065-T3096 CarbonylContact O-C 3.56Å; S3065-T3096 WeakPolarHBondContact O-CA 3.36Å; E3066-T3096 HydrophobicContact CG-CG2 4.14Å; T3096-T3098 HydrophobicContact CG2-CG2 4.38Å; T3096-H3107 CarbonylContact O-C 3.57Å; T3096-H3107 WeakPolarHBondContact O-CA 3.39Å; T3096-R3108 PolarHBondContact N-O 3.13Å; T3096-R3108 PolarHBondContact O-N 3.16Å
3097	K	91.1	Very high	89	Confident	67.6667 Å²	67.6667	39.6 Å²	39.6	29%	0.294	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	132.5	169.8	-177.9	-177.5	179.4	-173.6	0	109.5	R3064 S3065 Y3095 S3106	R3064-K3097 CarbonylContact C-O 3.52Å; R3064-K3097 WeakPolarHBondContact CA-O 3.38Å; S3065-K3097 PolarHBondContact N-O 3.2Å; S3065-K3097 PolarHBondContact O-N 2.94Å; Y3095-K3097 HydrophobicContact CE1-CB 4.16Å; K3097-S3106 WeakPolarHBondContact CA-O 3.2Å
3098	T	89	Confident	88.9	Confident	12.6667 Å²	12.6667	43.3 Å²	43.3	8%	0.078	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	141.7	173.6	63.6	0	0	0	0	111.2	I3061 R3063 R3064 T3096 G3105 S3106	I3061-T3098 HydrophobicContact CD1-CG2 4.23Å; I3061-T3098 HydrophobicContact CG2-CG2 4.3Å; R3063-T3098 WeakPolarHBondContact O-CA 3.35Å; R3064-T3098 HydrophobicContact CB-CG2 4.46Å; R3064-T3098 HydrophobicContact CG-CG2 4.33Å; T3096-T3098 HydrophobicContact CG2-CG2 4.38Å; T3098-G3105 WeakPolarHBondContact O-CA 3.28Å; T3098-S3106 PolarHBondContact N-O 3.14Å; T3098-S3106 PolarHBondContact O-N 3.16Å; T3098-S3106 VanDerWaalsContact O-N 3.11Å; T3098-S3106 PolarHBondContact OG1-N 2.99Å; T3098-S3106 PolarHBondContact OG1-OG 3.19Å
3099	H	84	Confident	88.8	Confident	68.3333 Å²	68.3333	44.8 Å²	44.8	32%	0.316	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	130.3	172.8	-163.2	-60.9	0	0	0	108.7	V3062 R3063 D3103	V3062-H3099 PolarHBondContact N-O 3.28Å; R3063-H3099 HydrophobicContact CB-CB 4.27Å; R3063-H3099 PolarHBondContact N-O 2.88Å; R3063-H3099 VanDerWaalsContact N-O 3.12Å; R3063-H3099 PolarHBondContact O-N 2.89Å; H3099-D3103 IonicContact CE1-OD1 3.09Å; H3099-D3103 PolarHBondContact CE1-OD1 2.94Å
3100	R	82.3	Confident	88.7	Confident	61 Å²	61	44 Å²	44	23%	0.23	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	174.3	-179.9	-64.6	166.8	177.2	-116.8	6.3	111.1	A3059 E3060 I3061 D3102 S3104	A3059-R3100 HydrophobicContact CB-CB 4.09Å; A3059-R3100 VanDerWaalsContact O-CD 3.25Å; A3059-R3100 WeakPolarHBondContact O-CD 3.31Å; A3059-R3100 VanDerWaalsContact O-CG 3.3Å; A3059-R3100 WeakPolarHBondContact O-CG 3.41Å; A3059-R3100 PolarHBondContact O-NE 2.79Å; A3059-R3100 PolarHBondContact O-NH1 2.92Å; E3060-R3100 CarbonylContact O-C 3.58Å; E3060-R3100 WeakPolarHBondContact O-CA 3.29Å; E3060-R3100 VanDerWaalsContact O-CB 3.31Å; E3060-R3100 WeakPolarHBondContact O-CB 3.48Å; I3061-R3100 HydrophobicContact CG1-CG 4.1Å; R3100-D3102 VanDerWaalsContact C-N 3.31Å; R3100-D3102 WeakPolarHBondContact CB-OD1 3.37Å; R3100-D3102 PolarHBondContact O-N 2.86Å; R3100-S3104 WeakPolarHBondContact CB-O 3.28Å; R3100-S3104 WeakPolarHBondContact CB-OG 3.39Å; R3100-S3104 WeakPolarHBondContact CD-OG 3.36Å; R3100-S3104 PolarHBondContact N-O 3.26Å; R3100-S3104 PolarHBondContact NH1-OG 3.5Å
3101	Q	74.9	Confident	88.7	Confident	95 Å²	95	42.9 Å²	42.9	44%	0.444	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-23.5	-175.5	-169.7	-180	61.8	0	0	114	E3060 V3062 D3103	E3060-Q3101 PolarHBondContact O-N 3.22Å; V3062-Q3101 HydrophobicContact CG2-CB 3.78Å; V3062-Q3101 HydrophobicContact CG2-CG 4.34Å; Q3101-D3103 VanDerWaalsContact C-N 3.32Å
3102	D	77	Confident	88.6	Confident	66 Å²	66	41.2 Å²	41.2	35%	0.353	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97	20.5	-177.3	66	-24.8	0	0	0	113.3	A3059 R3100 S3104 A3152	A3059-D3102 HydrophobicContact CB-CB 4.03Å; A3059-D3102 WeakPolarHBondContact CB-OD1 3.46Å; A3059-D3102 WeakPolarHBondContact CB-OD2 3.3Å; R3100-D3102 VanDerWaalsContact C-N 3.31Å; R3100-D3102 WeakPolarHBondContact CB-OD1 3.37Å; R3100-D3102 PolarHBondContact O-N 2.86Å; D3102-S3104 VanDerWaalsContact CG-OG 3.23Å; D3102-S3104 PolarHBondContact O-N 3.28Å; D3102-S3104 VanDerWaalsContact O-N 3.13Å; D3102-S3104 VanDerWaalsContact OD1-CB 3.23Å; D3102-S3104 WeakPolarHBondContact OD1-CB 3.27Å; D3102-S3104 PolarHBondContact OD1-N 3.14Å; D3102-S3104 VanDerWaalsContact OD1-N 3.09Å; D3102-S3104 PolarHBondContact OD1-OG 3.09Å; D3102-S3104 WeakPolarHBondContact OD2-CB 3.47Å; D3102-S3104 PolarHBondContact OD2-OG 3.07Å; D3102-S3104 VanDerWaalsContact OD2-OG 3.05Å; D3102-A3152 HydrophobicContact CB-CB 4.43Å; D3102-A3152 VanDerWaalsContact O-CB 3.25Å; D3102-A3152 WeakPolarHBondContact O-CB 3.37Å
3103	D	77.2	Confident	88.5	Confident	72 Å²	72	43.1 Å²	43.1	39%	0.385	21%	0.206	S	C	.	.	S	Bend	trans	58	8.4	-169.6	-64.2	-29.4	0	0	0	115.2	V2793 H3099 Q3101 A3152 P3153	V2793-D3103 WeakPolarHBondContact CG1-OD2 3.45Å; H3099-D3103 IonicContact CE1-OD1 3.09Å; H3099-D3103 PolarHBondContact CE1-OD1 2.94Å; Q3101-D3103 VanDerWaalsContact C-N 3.32Å; D3103-A3152 HydrophobicContact CB-CB 4.22Å; D3103-P3153 HydrophobicContact CB-CG 4.18Å
3104	S	84.7	Confident	88.5	Confident	7.66667 Å²	7.66667	42.8 Å²	42.8	5%	0.054	21%	0.205	C	C	.	.			trans	-76.2	167.2	167	79.7	0	0	0	0	111.2	R3100 D3102 D3150	R3100-S3104 WeakPolarHBondContact CB-O 3.28Å; R3100-S3104 WeakPolarHBondContact CB-OG 3.39Å; R3100-S3104 WeakPolarHBondContact CD-OG 3.36Å; R3100-S3104 PolarHBondContact N-O 3.26Å; R3100-S3104 PolarHBondContact NH1-OG 3.5Å; D3102-S3104 VanDerWaalsContact CG-OG 3.23Å; D3102-S3104 PolarHBondContact O-N 3.28Å; D3102-S3104 VanDerWaalsContact O-N 3.13Å; D3102-S3104 VanDerWaalsContact OD1-CB 3.23Å; D3102-S3104 WeakPolarHBondContact OD1-CB 3.27Å; D3102-S3104 PolarHBondContact OD1-N 3.14Å; D3102-S3104 VanDerWaalsContact OD1-N 3.09Å; D3102-S3104 PolarHBondContact OD1-OG 3.09Å; D3102-S3104 WeakPolarHBondContact OD2-CB 3.47Å; D3102-S3104 PolarHBondContact OD2-OG 3.07Å; D3102-S3104 VanDerWaalsContact OD2-OG 3.05Å; S3104-D3150 CarbonylContact C-O 3.55Å; S3104-D3150 VanDerWaalsContact CA-O 3.3Å; S3104-D3150 WeakPolarHBondContact CA-O 3.31Å; S3104-D3150 VanDerWaalsContact CB-O 3.26Å; S3104-D3150 WeakPolarHBondContact CB-O 3.22Å
3105	G	87.3	Confident	88.5	Confident	9.33333 Å²	9.33333	46.8 Å²	46.8	10%	0.096	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.7	-175.3	-174.9	0	0	0	0	0	114.8	T3098 D3150	T3098-G3105 WeakPolarHBondContact O-CA 3.28Å; G3105-D3150 PolarHBondContact N-O 3.17Å; G3105-D3150 PolarHBondContact O-N 3.31Å
3106	S	89.8	Confident	88.6	Confident	35.6667 Å²	35.6667	44.8 Å²	44.8	25%	0.249	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	155.1	170.6	72.6	0	0	0	0	112.2	K3097 T3098 C3148	K3097-S3106 WeakPolarHBondContact CA-O 3.2Å; T3098-S3106 PolarHBondContact N-O 3.14Å; T3098-S3106 PolarHBondContact O-N 3.16Å; T3098-S3106 VanDerWaalsContact O-N 3.11Å; T3098-S3106 PolarHBondContact OG1-N 2.99Å; T3098-S3106 PolarHBondContact OG1-OG 3.19Å; S3106-C3148 CarbonylContact C-O 3.51Å; S3106-C3148 VanDerWaalsContact CA-O 3.22Å; S3106-C3148 WeakPolarHBondContact CA-O 3.4Å; S3106-C3148 WeakPolarHBondContact CB-O 3.3Å
3107	H	92	Very high	88.7	Confident	55.3333 Å²	55.3333	44.9 Å²	44.9	26%	0.256	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	127.1	172.9	-67.5	-100.9	0	0	0	108.7	Y3095 T3096 A3147 C3148 D3150	Y3095-H3107 HydrophobicContact CE2-CB 4.47Å; Y3095-H3107 AromaticContact CE2-ND1 3.88Å; Y3095-H3107 AromaticContact CZ-ND1 3.76Å; Y3095-H3107 PolarHBondContact OH-CE1 3.18Å; Y3095-H3107 VanDerWaalsContact OH-CE1 3.28Å; Y3095-H3107 PolarHBondContact OH-ND1 3.14Å; T3096-H3107 CarbonylContact O-C 3.57Å; T3096-H3107 WeakPolarHBondContact O-CA 3.39Å; H3107-A3147 CarbonylContact O-C 3.55Å; H3107-A3147 WeakPolarHBondContact O-CA 3.31Å; H3107-C3148 HydrophobicContact CB-CB 4.41Å; H3107-C3148 PolarHBondContact N-O 3.05Å; H3107-C3148 PolarHBondContact O-N 3.31Å; H3107-D3150 IonicContact CD2-OD1 3.08Å; H3107-D3150 PolarHBondContact CD2-OD1 3.03Å
3108	R	93.1	Very high	88.8	Confident	105.667 Å²	105.667	41.9 Å²	41.9	40%	0.399	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	129.3	170.8	-175.5	175.5	176.9	-162.9	-10.2	108.3	Y3095 T3096 E3110 I3146	Y3095-R3108 CarbonylContact C-O 3.52Å; Y3095-R3108 WeakPolarHBondContact CA-O 3.34Å; Y3095-R3108 VanDerWaalsContact CD2-O 3.32Å; Y3095-R3108 WeakPolarHBondContact CD2-O 3.45Å; T3096-R3108 PolarHBondContact N-O 3.13Å; T3096-R3108 PolarHBondContact O-N 3.16Å; R3108-E3110 HydrophobicContact CG-CG 4.39Å; R3108-E3110 IonicContact CZ-OE1 2.97Å; R3108-E3110 VanDerWaalsContact CZ-OE1 3.31Å; R3108-E3110 IonicContact CZ-OE2 3.87Å; R3108-E3110 VanDerWaalsContact NE-CD 3.31Å; R3108-E3110 IonicContact NE-OE1 3.41Å; R3108-E3110 PolarHBondContact NE-OE1 3.35Å; R3108-E3110 IonicContact NE-OE2 3.31Å; R3108-E3110 IonicContact NH2-OE1 2.78Å; R3108-E3110 PolarHBondContact NH2-OE1 3.02Å; R3108-E3110 IonicContact NH2-OE2 2.98Å; R3108-E3110 PolarHBondContact NH2-OE2 3Å; R3108-I3146 CarbonylContact C-O 3.57Å; R3108-I3146 WeakPolarHBondContact CA-O 3.38Å
3109	L	94.8	Very high	89	Confident	43.6667 Å²	43.6667	44.3 Å²	44.3	23%	0.229	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	126.8	170.9	-177.9	156.5	0	0	0	107.5	F3093 I3094 Y3095 L3144 R3145 I3146	F3093-L3109 HydrophobicContact CE2-CD1 4.02Å; F3093-L3109 HydrophobicContact CE2-CD2 4.38Å; F3093-L3109 HydrophobicContact CE2-CG 4.03Å; F3093-L3109 HydrophobicContact CZ-CD1 4.36Å; F3093-L3109 HydrophobicContact CZ-CG 4.5Å; I3094-L3109 CarbonylContact O-C 3.59Å; I3094-L3109 WeakPolarHBondContact O-CA 3.39Å; Y3095-L3109 HydrophobicContact CD2-CB 4.2Å; Y3095-L3109 HydrophobicContact CD2-CD1 4.38Å; L3109-L3144 HydrophobicContact CD2-CD2 4.29Å; L3109-L3144 HydrophobicContact CD2-CG 4.49Å; L3109-R3145 CarbonylContact O-C 3.51Å; L3109-R3145 WeakPolarHBondContact O-CA 3.33Å; L3109-I3146 HydrophobicContact CB-CB 4.34Å; L3109-I3146 PolarHBondContact N-O 3.17Å; L3109-I3146 PolarHBondContact O-N 3.27Å
3110	E	93.4	Very high	89.1	Confident	12.6667 Å²	12.6667	41.7 Å²	41.7	6%	0.059	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	145.4	171.4	-64.4	-174.4	-175.8	0	0	110.3	F3093 I3094 R3108 P3142 L3144 R3145	F3093-E3110 WeakPolarHBondContact CA-O 3.33Å; I3094-E3110 HydrophobicContact CG2-CB 3.82Å; I3094-E3110 HydrophobicContact CG2-CG 4.2Å; I3094-E3110 PolarHBondContact N-O 3.01Å; I3094-E3110 PolarHBondContact O-N 2.94Å; R3108-E3110 HydrophobicContact CG-CG 4.39Å; R3108-E3110 IonicContact CZ-OE1 2.97Å; R3108-E3110 VanDerWaalsContact CZ-OE1 3.31Å; R3108-E3110 IonicContact CZ-OE2 3.87Å; R3108-E3110 VanDerWaalsContact NE-CD 3.31Å; R3108-E3110 IonicContact NE-OE1 3.41Å; R3108-E3110 PolarHBondContact NE-OE1 3.35Å; R3108-E3110 IonicContact NE-OE2 3.31Å; R3108-E3110 IonicContact NH2-OE1 2.78Å; R3108-E3110 PolarHBondContact NH2-OE1 3.02Å; R3108-E3110 IonicContact NH2-OE2 2.98Å; R3108-E3110 PolarHBondContact NH2-OE2 3Å; E3110-P3142 HydrophobicContact CB-CB 4.35Å; E3110-P3142 HydrophobicContact CG-CG 4.45Å; E3110-L3144 WeakPolarHBondContact CA-O 3.4Å; E3110-R3145 HydrophobicContact CB-CG 4.36Å; E3110-R3145 HydrophobicContact CG-CB 3.91Å; E3110-R3145 HydrophobicContact CG-CG 3.84Å; E3110-R3145 WeakPolarHBondContact OE1-CD 3.28Å; E3110-R3145 WeakPolarHBondContact OE1-CG 3.36Å; E3110-R3145 IonicContact OE1-CZ 3.37Å; E3110-R3145 IonicContact OE1-NE 3.06Å; E3110-R3145 PolarHBondContact OE1-NE 3.25Å; E3110-R3145 IonicContact OE1-NH1 2.77Å; E3110-R3145 PolarHBondContact OE1-NH1 2.95Å; E3110-R3145 IonicContact OE1-NH2 2.93Å; E3110-R3145 IonicContact OE2-CZ 2.64Å; E3110-R3145 IonicContact OE2-NE 2.63Å; E3110-R3145 PolarHBondContact OE2-NE 3.22Å; E3110-R3145 IonicContact OE2-NH2 3.46Å; E3110-R3145 PolarHBondContact OE2-NH2 2.97Å
3111	L	93.5	Very high	89.2	Confident	12.6667 Å²	12.6667	43.9 Å²	43.9	7%	0.066	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	119.3	175.7	177.7	65	0	0	0	107.7	L3090 G3092 F3093 W3113 I3114 P3142 I3143 L3144	L3090-L3111 HydrophobicContact CB-CD1 4.06Å; L3090-L3111 HydrophobicContact CD2-CD1 4.07Å; L3090-L3111 HydrophobicContact CD2-CD2 3.85Å; L3090-L3111 HydrophobicContact CD2-CG 4.48Å; G3092-L3111 CarbonylContact O-C 3.48Å; G3092-L3111 WeakPolarHBondContact O-CA 3.24Å; F3093-L3111 HydrophobicContact CB-CD1 4.14Å; F3093-L3111 HydrophobicContact CD2-CD1 4.41Å; L3111-W3113 WeakPolarHBondContact CD1-O 3.41Å; L3111-W3113 WeakPolarHBondContact CG-O 3.43Å; L3111-I3114 HydrophobicContact CD2-CB 4.06Å; L3111-I3114 HydrophobicContact CD2-CD1 4.35Å; L3111-P3142 CarbonylContact O-C 3.55Å; L3111-P3142 VanDerWaalsContact O-CA 3.31Å; L3111-P3142 WeakPolarHBondContact O-CA 3.31Å; L3111-P3142 VanDerWaalsContact O-CB 3.28Å; L3111-P3142 WeakPolarHBondContact O-CB 3.37Å; L3111-I3143 HydrophobicContact CB-CG2 4.5Å; L3111-I3143 HydrophobicContact CD2-CD1 4.12Å; L3111-I3143 HydrophobicContact CD2-CG2 4.38Å; L3111-I3143 HydrophobicContact CG-CD1 4.3Å; L3111-I3143 HydrophobicContact CG-CG1 4.31Å; L3111-I3143 HydrophobicContact CG-CG2 4.17Å; L3111-I3143 WeakPolarHBondContact O-CG1 3.36Å; L3111-I3143 VanDerWaalsContact O-CG2 3.3Å; L3111-I3143 WeakPolarHBondContact O-CG2 3.36Å; L3111-I3143 PolarHBondContact O-N 3.07Å; L3111-L3144 HydrophobicContact CB-CB 4.33Å; L3111-L3144 PolarHBondContact N-O 2.78Å; L3111-L3144 PolarHBondContact O-N 3.28Å
3112	G	90.1	Very high	89.6	Confident	4.66667 Å²	4.66667	46.8 Å²	46.8	5%	0.048	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	-51.8	178.8	0	0	0	0	0	112.5	R3091 G3092 Y3138 I3143	R3091-G3112 CarbonylContact O-C 3.51Å; R3091-G3112 VanDerWaalsContact O-CA 3.28Å; R3091-G3112 WeakPolarHBondContact O-CA 3.31Å; R3091-G3112 PolarHBondContact O-N 3.18Å; G3092-G3112 PolarHBondContact O-N 3.14Å; G3112-Y3138 PolarHBondContact O-OH 3.2Å; G3112-Y3138 VanDerWaalsContact O-OH 3.06Å; G3112-I3143 WeakPolarHBondContact O-CG2 3.32Å; G3112-I3143 PolarHBondContact O-N 3.32Å; G3112-I3143 VanDerWaalsContact O-N 3.16Å
3113	W	89.3	Confident	89.9	Confident	43.3333 Å²	43.3333	44.9 Å²	44.9	16%	0.164	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	146.4	-174.1	-171.9	-97.5	0	0	0	112.1	P2473 L3090 R3091 L3111 P3131 V3133 Y3138	P2473-W3113 HydrophobicContact CG-CD2 4.29Å; P2473-W3113 HydrophobicContact CG-CE3 3.62Å; P2473-W3113 HydrophobicContact CG-CH2 4.37Å; P2473-W3113 HydrophobicContact CG-CZ3 3.56Å; P2473-W3113 VanDerWaalsContact CG-CZ3 3.44Å; L3090-W3113 WeakPolarHBondContact CA-O 3.42Å; R3091-W3113 HydrophobicContact CB-CB 4.04Å; R3091-W3113 HydrophobicContact CG-CB 4.42Å; R3091-W3113 PolarHBondContact N-O 3.14Å; R3091-W3113 VanDerWaalsContact N-O 3.08Å; R3091-W3113 PolarHBondContact O-N 2.87Å; L3111-W3113 WeakPolarHBondContact CD1-O 3.41Å; L3111-W3113 WeakPolarHBondContact CG-O 3.43Å; W3113-P3131 HydrophobicContact CD2-CG 3.85Å; W3113-P3131 HydrophobicContact CE3-CB 4.35Å; W3113-P3131 HydrophobicContact CE3-CG 3.61Å; W3113-P3131 HydrophobicContact CH2-CB 4.18Å; W3113-P3131 HydrophobicContact CH2-CG 3.76Å; W3113-P3131 HydrophobicContact CZ2-CG 3.98Å; W3113-P3131 HydrophobicContact CZ3-CB 4.03Å; W3113-P3131 HydrophobicContact CZ3-CG 3.56Å; W3113-P3131 VanDerWaalsContact CZ3-CG 3.49Å; W3113-V3133 HydrophobicContact CH2-CG1 4.01Å; W3113-V3133 HydrophobicContact CZ3-CG1 4.19Å; W3113-Y3138 HydrophobicContact CZ3-CE1 4.37Å
3114	I	93.2	Very high	90.3	Very high	32.6667 Å²	32.6667	49 Å²	49	17%	0.168	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	137.3	167.8	-170	163.6	0	0	0	110.8	E3089 L3090 L3111 V3116 L3129 P3131 I3143	E3089-I3114 CarbonylContact O-C 3.56Å; E3089-I3114 VanDerWaalsContact O-CA 3.28Å; E3089-I3114 WeakPolarHBondContact O-CA 3.38Å; L3090-I3114 HydrophobicContact CD2-CB 4.19Å; L3090-I3114 HydrophobicContact CD2-CD1 3.74Å; L3090-I3114 HydrophobicContact CD2-CG1 3.7Å; L3111-I3114 HydrophobicContact CD2-CB 4.06Å; L3111-I3114 HydrophobicContact CD2-CD1 4.35Å; I3114-V3116 HydrophobicContact CD1-CG2 4.42Å; I3114-V3116 HydrophobicContact CG1-CG2 4.34Å; I3114-L3129 HydrophobicContact CD1-CD2 4.01Å; I3114-L3129 HydrophobicContact CG1-CD2 4.34Å; I3114-L3129 HydrophobicContact CG2-CD2 4.09Å; I3114-L3129 HydrophobicContact CG2-CG 4.29Å; I3114-P3131 WeakPolarHBondContact O-CD 3.3Å; I3114-I3143 HydrophobicContact CB-CD1 3.56Å; I3114-I3143 HydrophobicContact CB-CG2 4.5Å; I3114-I3143 HydrophobicContact CG2-CD1 3.52Å; I3114-I3143 HydrophobicContact CG2-CG1 4.21Å; I3114-I3143 HydrophobicContact CG2-CG2 4.02Å
3115	R	94.1	Very high	90.5	Very high	92 Å²	92	51.4 Å²	51.4	35%	0.347	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	140.1	167.4	-159.1	-177.1	-168.6	166	12.4	109.1	E2470 V3088 E3089 E3127 L3129	E2470-R3115 IonicContact OE2-NH1 3.25Å; V3088-R3115 CarbonylContact C-O 3.54Å; V3088-R3115 WeakPolarHBondContact CA-O 3.39Å; E3089-R3115 HydrophobicContact CB-CB 4.07Å; E3089-R3115 PolarHBondContact N-O 3.3Å; E3089-R3115 PolarHBondContact O-N 3.03Å; R3115-E3127 IonicContact CZ-OE1 3.75Å; R3115-E3127 IonicContact NE-OE1 3.16Å; R3115-E3127 PolarHBondContact NE-OE1 2.87Å; R3115-E3127 IonicContact NH2-OE1 3.33Å; R3115-E3127 PolarHBondContact NH2-OE1 2.91Å; R3115-E3127 IonicContact NH2-OE2 3.87Å; R3115-L3129 CarbonylContact C-O 3.55Å; R3115-L3129 WeakPolarHBondContact CA-O 3.33Å
3116	V	96.1	Very high	90.7	Very high	19.6667 Å²	19.6667	60.1 Å²	60.1	12%	0.119	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	124	172.8	-177.3	0	0	0	0	109	D3087 V3088 I3114 V3128 L3129 F3178	D3087-V3116 CarbonylContact O-C 3.5Å; D3087-V3116 WeakPolarHBondContact O-CA 3.45Å; V3088-V3116 HydrophobicContact CG1-CG2 4.25Å; V3088-V3116 HydrophobicContact CG2-CG1 4.24Å; V3088-V3116 HydrophobicContact CG2-CG2 4.19Å; I3114-V3116 HydrophobicContact CD1-CG2 4.42Å; I3114-V3116 HydrophobicContact CG1-CG2 4.34Å; V3116-V3128 HydrophobicContact CG1-CB 4.37Å; V3116-V3128 PolarHBondContact O-N 3.23Å; V3116-L3129 HydrophobicContact CB-CB 3.92Å; V3116-L3129 HydrophobicContact CG2-CB 3.9Å; V3116-L3129 HydrophobicContact CG2-CD2 4.18Å; V3116-L3129 PolarHBondContact N-O 3.01Å; V3116-L3129 PolarHBondContact O-N 3.08Å; V3116-F3178 HydrophobicContact CG1-CZ 4.1Å
3117	C	95.5	Very high	90.8	Very high	25 Å²	25	61.4 Å²	61.4	17%	0.169	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	131.3	177.4	-70.7	0	0	0	0	111	A3086 D3087 R3126	A3086-C3117 CarbonylContact C-O 3.45Å; A3086-C3117 WeakPolarHBondContact CA-O 3.39Å; A3086-C3117 WeakPolarHBondContact CB-O 3.35Å; D3087-C3117 HydrophobicContact CB-CB 4.44Å; D3087-C3117 PolarHBondContact N-O 3.18Å; D3087-C3117 PolarHBondContact O-N 2.9Å; C3117-R3126 CarbonylContact C-O 3.47Å; C3117-R3126 WeakPolarHBondContact CA-O 3.38Å; C3117-R3126 WeakPolarHBondContact CB-O 3.26Å
3118	S	93.8	Very high	90.9	Very high	5 Å²	5	59.1 Å²	59.1	4%	0.035	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	128.7	168.2	177.5	0	0	0	0	110.3	A3120 S3123 R3126 F3178	S3118-A3120 PolarHBondContact OG-N 3.2Å; S3118-S3123 WeakPolarHBondContact OG-CB 3.43Å; S3118-S3123 PolarHBondContact OG-OG 3.2Å; S3118-S3123 VanDerWaalsContact OG-OG 3.1Å; S3118-R3126 PolarHBondContact N-O 3.09Å; S3118-F3178 WeakPolarHBondContact OG-CD2 3.48Å
3119	L	92.4	Very high	90.9	Very high	62.6667 Å²	62.6667	55.7 Å²	55.7	33%	0.328	27%	0.272	S	S	.	.			trans	-95.9	-4.2	171.8	-61.3	177.3	0	0	0	112.6	R3075 G3084 L3085	R3075-L3119 HydrophobicContact CG-CD1 4.43Å; G3084-L3119 VanDerWaalsContact O-CB 3.29Å; G3084-L3119 WeakPolarHBondContact O-CB 3.3Å; L3085-L3119 PolarHBondContact O-N 3.21Å
3120	A	86.4	Confident	90.8	Very high	13.3333 Å²	13.3333	54 Å²	54	11%	0.11	27%	0.265	C	S	.	.	S	Bend	trans	-59.8	136	-179.5	0	0	0	0	0	112.2	S3118 N3122 S3123 I3181	S3118-A3120 PolarHBondContact OG-N 3.2Å; A3120-N3122 PolarHBondContact O-N 3.18Å; A3120-S3123 WeakPolarHBondContact O-CB 3.3Å; A3120-S3123 PolarHBondContact O-N 3.19Å; A3120-S3123 VanDerWaalsContact O-N 3.15Å; A3120-I3181 HydrophobicContact CB-CD1 4.06Å
3121	P	83.8	Confident	90.5	Very high	107 Å²	107	53.8 Å²	53.8	70%	0.695	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	137.1	-177.1	25.1	-34.3	0	0	0	111.3	S3123 Q3177	P3121-S3123 PolarHBondContact O-N 3.17Å; P3121-Q3177 PolarHBondContact O-NE2 3.46Å
3122	N	83.7	Confident	90.2	Very high	157.333 Å²	157.333	54.1 Å²	54.1	84%	0.841	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	26.6	-177.2	-55.2	-41.2	0	0	0	115	A3120 F3124	A3120-N3122 PolarHBondContact O-N 3.18Å; N3122-F3124 PolarHBondContact O-N 2.97Å; N3122-F3124 VanDerWaalsContact O-N 3.13Å
3123	S	84.7	Confident	89.6	Confident	25.6667 Å²	25.6667	57.9 Å²	57.9	18%	0.179	29%	0.288	C	S	.	.			trans	-62.9	119.1	175.8	-164	0	0	0	0	111.6	S3118 A3120 P3121 Y3125	S3118-S3123 WeakPolarHBondContact OG-CB 3.43Å; S3118-S3123 PolarHBondContact OG-OG 3.2Å; S3118-S3123 VanDerWaalsContact OG-OG 3.1Å; A3120-S3123 WeakPolarHBondContact O-CB 3.3Å; A3120-S3123 PolarHBondContact O-N 3.19Å; A3120-S3123 VanDerWaalsContact O-N 3.15Å; P3121-S3123 PolarHBondContact O-N 3.17Å; S3123-Y3125 PolarHBondContact O-N 2.98Å; S3123-Y3125 PolarHBondContact OG-N 2.87Å; S3123-Y3125 PolarHBondContact OG-O 3.03Å
3124	F	84.4	Confident	88.7	Confident	158.333 Å²	158.333	60.5 Å²	60.5	69%	0.694	31%	0.313	S	S	*	.	S	Bend	trans	-63.5	-24	179.1	-98.6	-84.2	0	0	0	113.7	N3122 K3582	N3122-F3124 PolarHBondContact O-N 2.97Å; N3122-F3124 VanDerWaalsContact O-N 3.13Å; F3124-K3582 HydrophobicContact CB-CD 3.84Å; F3124-K3582 HydrophobicContact CD1-CD 3.93Å; F3124-K3582 VanDerWaalsContact CD1-NZ 3.31Å; F3124-K3582 HydrophobicContact CD2-CD 4.05Å; F3124-K3582 VanDerWaalsContact CD2-NZ 3.28Å; F3124-K3582 HydrophobicContact CG-CD 3.63Å
3125	Y	89.6	Confident	87.2	Confident	58.6667 Å²	58.6667	61.1 Å²	61.1	23%	0.23	33%	0.328	C	S	.	.			trans	-120.7	97.6	171	-58.9	-54.6	0	0	0	107.3	S3123 Q3173 K3582	S3123-Y3125 PolarHBondContact O-N 2.98Å; S3123-Y3125 PolarHBondContact OG-N 2.87Å; S3123-Y3125 PolarHBondContact OG-O 3.03Å; Y3125-Q3173 WeakPolarHBondContact CB-O 3.31Å; Y3125-Q3173 HydrophobicContact CD1-CB 3.79Å; Y3125-Q3173 HydrophobicContact CD1-CG 4.27Å; Y3125-Q3173 VanDerWaalsContact CD1-OE1 3.26Å; Y3125-Q3173 HydrophobicContact CD2-CB 4.1Å; Y3125-Q3173 HydrophobicContact CE1-CB 4.36Å; Y3125-Q3173 HydrophobicContact CG-CB 3.65Å; Y3125-K3582 HydrophobicContact CE2-CB 3.76Å
3126	R	90.8	Very high	85.8	Confident	191 Å²	191	60.2 Å²	60.2	72%	0.721	35%	0.347	S	S	*	.	S	Bend	trans	-70.9	-43.4	176.1	180	177.6	170.6	-176.8	-3.9	110.5	C3117 S3118	C3117-R3126 CarbonylContact C-O 3.47Å; C3117-R3126 WeakPolarHBondContact CA-O 3.38Å; C3117-R3126 WeakPolarHBondContact CB-O 3.26Å; S3118-R3126 PolarHBondContact N-O 3.09Å
3127	E	91.8	Very high	84.1	Confident	63.6667 Å²	63.6667	68.1 Å²	68.1	30%	0.298	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	120.8	169.7	-174.9	165.3	-103.7	0	0	108.7	R3115 A3130	R3115-E3127 IonicContact CZ-OE1 3.75Å; R3115-E3127 IonicContact NE-OE1 3.16Å; R3115-E3127 PolarHBondContact NE-OE1 2.87Å; R3115-E3127 IonicContact NH2-OE1 3.33Å; R3115-E3127 PolarHBondContact NH2-OE1 2.91Å; R3115-E3127 IonicContact NH2-OE2 3.87Å; E3127-A3130 HydrophobicContact CG-CB 3.97Å
3128	V	94	Very high	82.7	Confident	5.66667 Å²	5.66667	68.6 Å²	68.6	3%	0.034	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	-38.2	-173.5	178.9	0	0	0	0	111.7	V3116 L3172 Q3173 M3174 F3178	V3116-V3128 HydrophobicContact CG1-CB 4.37Å; V3116-V3128 PolarHBondContact O-N 3.23Å; V3128-L3172 HydrophobicContact CG1-CD1 4.37Å; V3128-L3172 CarbonylContact O-C 3.56Å; V3128-L3172 VanDerWaalsContact O-CA 3.32Å; V3128-L3172 WeakPolarHBondContact O-CA 3.25Å; V3128-L3172 WeakPolarHBondContact O-CD1 3.21Å; V3128-Q3173 WeakPolarHBondContact CA-O 3.42Å; V3128-Q3173 PolarHBondContact O-N 2.91Å; V3128-M3174 HydrophobicContact CG1-CB 4.3Å; V3128-M3174 HydrophobicContact CG1-CG 4.43Å; V3128-F3178 HydrophobicContact CB-CE1 4.32Å; V3128-F3178 HydrophobicContact CB-CZ 4.44Å; V3128-F3178 HydrophobicContact CG1-CD1 3.95Å; V3128-F3178 HydrophobicContact CG1-CE1 3.71Å; V3128-F3178 HydrophobicContact CG1-CZ 4.32Å; V3128-F3178 HydrophobicContact CG2-CD1 4.23Å; V3128-F3178 HydrophobicContact CG2-CD2 4.28Å; V3128-F3178 HydrophobicContact CG2-CE1 4.18Å; V3128-F3178 HydrophobicContact CG2-CE2 4.22Å; V3128-F3178 HydrophobicContact CG2-CG 4.27Å; V3128-F3178 HydrophobicContact CG2-CZ 4.16Å
3129	L	94	Very high	81.4	Confident	34.6667 Å²	34.6667	73.5 Å²	73.5	18%	0.182	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	129.4	175	179.2	65.6	0	0	0	109.2	I3114 R3115 V3116 I3170 V3171 L3172	I3114-L3129 HydrophobicContact CD1-CD2 4.01Å; I3114-L3129 HydrophobicContact CG1-CD2 4.34Å; I3114-L3129 HydrophobicContact CG2-CD2 4.09Å; I3114-L3129 HydrophobicContact CG2-CG 4.29Å; R3115-L3129 CarbonylContact C-O 3.55Å; R3115-L3129 WeakPolarHBondContact CA-O 3.33Å; V3116-L3129 HydrophobicContact CB-CB 3.92Å; V3116-L3129 HydrophobicContact CG2-CB 3.9Å; V3116-L3129 HydrophobicContact CG2-CD2 4.18Å; V3116-L3129 PolarHBondContact N-O 3.01Å; V3116-L3129 PolarHBondContact O-N 3.08Å; L3129-I3170 HydrophobicContact CD1-CB 4.16Å; L3129-I3170 HydrophobicContact CD1-CD1 4.05Å; L3129-I3170 HydrophobicContact CD1-CG1 4.5Å; L3129-I3170 HydrophobicContact CD1-CG2 4.48Å; L3129-V3171 WeakPolarHBondContact CA-O 3.44Å; L3129-L3172 HydrophobicContact CD1-CB 4.46Å; L3129-L3172 HydrophobicContact CD1-CD1 4.39Å
3130	A	91.6	Very high	80.3	Confident	9.33333 Å²	9.33333	72.3 Å²	72.3	8%	0.077	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	163.2	173.6	0	0	0	0	0	110.7	E3127 I3170 V3171	E3127-A3130 HydrophobicContact CG-CB 3.97Å; A3130-I3170 CarbonylContact O-C 3.58Å; A3130-I3170 WeakPolarHBondContact O-CA 3.38Å; A3130-V3171 PolarHBondContact N-O 2.87Å; A3130-V3171 VanDerWaalsContact N-O 3.12Å; A3130-V3171 PolarHBondContact O-N 3.1Å
3131	P	88.6	Confident	80	Confident	7.66667 Å²	7.66667	73.2 Å²	73.2	5%	0.05	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	144.8	175.3	-16.4	34.4	0	0	0	111.2	W3113 I3114 V3133 Y3138 I3143	W3113-P3131 HydrophobicContact CD2-CG 3.85Å; W3113-P3131 HydrophobicContact CE3-CB 4.35Å; W3113-P3131 HydrophobicContact CE3-CG 3.61Å; W3113-P3131 HydrophobicContact CH2-CB 4.18Å; W3113-P3131 HydrophobicContact CH2-CG 3.76Å; W3113-P3131 HydrophobicContact CZ2-CG 3.98Å; W3113-P3131 HydrophobicContact CZ3-CB 4.03Å; W3113-P3131 HydrophobicContact CZ3-CG 3.56Å; W3113-P3131 VanDerWaalsContact CZ3-CG 3.49Å; I3114-P3131 WeakPolarHBondContact O-CD 3.3Å; P3131-V3133 VanDerWaalsContact C-N 3.33Å; P3131-V3133 PolarHBondContact O-N 3Å; P3131-V3133 VanDerWaalsContact O-N 3.12Å; P3131-Y3138 HydrophobicContact CB-CD2 4.44Å; P3131-Y3138 HydrophobicContact CB-CE2 4.33Å; P3131-I3143 HydrophobicContact CB-CD1 3.83Å; P3131-I3143 HydrophobicContact CB-CG2 3.97Å; P3131-I3143 HydrophobicContact CG-CD1 3.63Å; P3131-I3143 HydrophobicContact CG-CG2 3.92Å
3132	D	86.9	Confident	80.2	Confident	19.6667 Å²	19.6667	69.9 Å²	69.9	11%	0.105	41%	0.405	C	S	.	.			trans	-83.1	80.2	175.6	-176.8	21.6	0	0	0	111.7	S3134 P3169 V3171 R3578	D3132-S3134 VanDerWaalsContact C-N 3.27Å; D3132-S3134 PolarHBondContact O-N 3.28Å; D3132-S3134 VanDerWaalsContact OD1-CB 3.28Å; D3132-S3134 WeakPolarHBondContact OD1-CB 3.41Å; D3132-S3134 PolarHBondContact OD1-N 3.03Å; D3132-S3134 PolarHBondContact OD1-OG 3.03Å; D3132-P3169 HydrophobicContact CB-CB 3.81Å; D3132-P3169 PolarHBondContact N-O 3.19Å; D3132-V3171 HydrophobicContact CB-CG2 3.79Å; D3132-R3578 VanDerWaalsContact CG-NH1 3.29Å; D3132-R3578 IonicContact OD1-CZ 3.17Å; D3132-R3578 IonicContact OD1-NH1 2.72Å; D3132-R3578 PolarHBondContact OD1-NH1 3.15Å; D3132-R3578 IonicContact OD1-NH2 2.75Å; D3132-R3578 PolarHBondContact OD1-NH2 3.02Å; D3132-R3578 IonicContact OD2-CZ 3.65Å; D3132-R3578 IonicContact OD2-NH1 2.75Å; D3132-R3578 IonicContact OD2-NH2 2.75Å; D3132-R3578 PolarHBondContact OD2-NH2 2.66Å
3133	V	77.5	Confident	80.5	Confident	83.3333 Å²	83.3333	62.6 Å²	62.6	51%	0.505	37%	0.366	S	S	.	.			trans	-70.8	-19.1	171.1	-63.3	0	0	0	0	112.9	W3113 P3131 G3135 G3136 Y3138	W3113-V3133 HydrophobicContact CH2-CG1 4.01Å; W3113-V3133 HydrophobicContact CZ3-CG1 4.19Å; P3131-V3133 VanDerWaalsContact C-N 3.33Å; P3131-V3133 PolarHBondContact O-N 3Å; P3131-V3133 VanDerWaalsContact O-N 3.12Å; V3133-G3135 VanDerWaalsContact C-N 3.28Å; V3133-G3135 PolarHBondContact O-N 3.16Å; V3133-G3136 PolarHBondContact O-N 3.35Å; V3133-Y3138 HydrophobicContact CG1-CD1 4.45Å
3134	S	69.9	Low	80.9	Confident	97.3333 Å²	97.3333	63.4 Å²	63.4	68%	0.681	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-4.9	-166.5	-2.4	0	0	0	0	115.3	D3132	D3132-S3134 VanDerWaalsContact C-N 3.27Å; D3132-S3134 PolarHBondContact O-N 3.28Å; D3132-S3134 VanDerWaalsContact OD1-CB 3.28Å; D3132-S3134 WeakPolarHBondContact OD1-CB 3.41Å; D3132-S3134 PolarHBondContact OD1-N 3.03Å; D3132-S3134 PolarHBondContact OD1-OG 3.03Å
3135	G	62.3	Low	81.4	Confident	46.3333 Å²	46.3333	60.1 Å²	60.1	48%	0.478	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.7	6.7	-177.9	0	0	0	0	0	115.8	V3133 R3137	V3133-G3135 VanDerWaalsContact C-N 3.28Å; V3133-G3135 PolarHBondContact O-N 3.16Å; G3135-R3137 WeakPolarHBondContact O-CG 3.33Å; G3135-R3137 PolarHBondContact O-N 3.23Å; G3135-R3137 VanDerWaalsContact O-N 3.08Å
3136	G	63.1	Low	81.6	Confident	72.3333 Å²	72.3333	59.5 Å²	59.5	75%	0.746	35%	0.352	S	S	*	.	S	Bend	trans	63.5	10.2	-176.4	0	0	0	0	0	115	V3133 Y3138	V3133-G3136 PolarHBondContact O-N 3.35Å; G3136-Y3138 VanDerWaalsContact C-N 3.32Å
3137	R	60.2	Low	81.8	Confident	185.333 Å²	185.333	52 Å²	52	70%	0.699	33%	0.331	S	S	*	.			trans	-82.5	-13.7	-177.2	-57.7	-175.5	-174.8	-83.3	0.6	113.4	G3135 A3139 P3169	G3135-R3137 WeakPolarHBondContact O-CG 3.33Å; G3135-R3137 PolarHBondContact O-N 3.23Å; G3135-R3137 VanDerWaalsContact O-N 3.08Å; R3137-A3139 PolarHBondContact O-N 3.24Å; R3137-P3169 HydrophobicContact CB-CB 4.37Å; R3137-P3169 HydrophobicContact CB-CG 4.01Å
3138	Y	67.9	Low	81.8	Confident	37 Å²	37	49.5 Å²	49.5	15%	0.145	32%	0.32	C	S	.	.			trans	-100.8	104.9	-178.7	178.3	-106.1	0	0	0	109.8	P2473 G3112 W3113 P3131 V3133 G3136 G3140 G3141 I3143 A3168	P2473-Y3138 HydrophobicContact CB-CE1 4.26Å; P2473-Y3138 HydrophobicContact CG-CE1 4.37Å; G3112-Y3138 PolarHBondContact O-OH 3.2Å; G3112-Y3138 VanDerWaalsContact O-OH 3.06Å; W3113-Y3138 HydrophobicContact CZ3-CE1 4.37Å; P3131-Y3138 HydrophobicContact CB-CD2 4.44Å; P3131-Y3138 HydrophobicContact CB-CE2 4.33Å; V3133-Y3138 HydrophobicContact CG1-CD1 4.45Å; G3136-Y3138 VanDerWaalsContact C-N 3.32Å; Y3138-G3140 VanDerWaalsContact C-N 3.3Å; Y3138-G3140 PolarHBondContact O-N 2.95Å; Y3138-G3141 VanDerWaalsContact CE2-O 3.27Å; Y3138-G3141 WeakPolarHBondContact CE2-O 3.32Å; Y3138-G3141 VanDerWaalsContact CZ-O 3.22Å; Y3138-G3141 PolarHBondContact OH-O 3.44Å; Y3138-G3141 VanDerWaalsContact OH-O 3.05Å; Y3138-I3143 HydrophobicContact CE2-CB 4.41Å; Y3138-I3143 HydrophobicContact CE2-CG2 3.72Å; Y3138-A3168 HydrophobicContact CD2-CB 3.9Å; Y3138-A3168 HydrophobicContact CE2-CB 4.03Å
3139	A	65.8	Low	81.7	Confident	106.667 Å²	106.667	50.4 Å²	50.4	88%	0.882	33%	0.327	S	S	*	.			trans	-88.8	27.9	-174.7	0	0	0	0	0	114.1	R3137 G3141	R3137-A3139 PolarHBondContact O-N 3.24Å; A3139-G3141 PolarHBondContact O-N 2.93Å
3140	G	69.9	Low	81.4	Confident	37 Å²	37	50 Å²	50	38%	0.381	33%	0.325	S	S	.	.	S	Bend	trans	74.3	15.9	178.1	0	0	0	0	0	116.2	Y3138	Y3138-G3140 VanDerWaalsContact C-N 3.3Å; Y3138-G3140 PolarHBondContact O-N 2.95Å
3141	G	78.5	Confident	81.2	Confident	33.3333 Å²	33.3333	52.8 Å²	52.8	34%	0.344	34%	0.338	S	S	.	.	S	Bend	trans	-80.4	174.7	169.5	0	0	0	0	0	112.8	Y3138 A3139 I3143	Y3138-G3141 VanDerWaalsContact CE2-O 3.27Å; Y3138-G3141 WeakPolarHBondContact CE2-O 3.32Å; Y3138-G3141 VanDerWaalsContact CZ-O 3.22Å; Y3138-G3141 PolarHBondContact OH-O 3.44Å; Y3138-G3141 VanDerWaalsContact OH-O 3.05Å; A3139-G3141 PolarHBondContact O-N 2.93Å; G3141-I3143 PolarHBondContact O-N 3.32Å
3142	P	87.9	Confident	80.9	Confident	37.3333 Å²	37.3333	54.1 Å²	54.1	24%	0.242	35%	0.349	C	S	.	.			trans	-63.1	137.4	177.6	26	-33.9	0	0	0	112.1	E3110 L3111 L3144 R3145	E3110-P3142 HydrophobicContact CB-CB 4.35Å; E3110-P3142 HydrophobicContact CG-CG 4.45Å; L3111-P3142 CarbonylContact O-C 3.55Å; L3111-P3142 VanDerWaalsContact O-CA 3.31Å; L3111-P3142 WeakPolarHBondContact O-CA 3.31Å; L3111-P3142 VanDerWaalsContact O-CB 3.28Å; L3111-P3142 WeakPolarHBondContact O-CB 3.37Å; P3142-L3144 VanDerWaalsContact C-N 3.28Å; P3142-L3144 PolarHBondContact O-N 3.15Å; P3142-R3145 HydrophobicContact CG-CB 4.35Å; P3142-R3145 HydrophobicContact CG-CG 3.87Å
3143	I	91.1	Very high	80.7	Confident	3.66667 Å²	3.66667	55.3 Å²	55.3	2%	0.019	36%	0.359	C	S	.	.	S	Bend	trans	-67.2	-26.9	177.2	154.8	153.1	0	0	0	113.6	L3111 G3112 I3114 P3131 Y3138 G3141 V3167 A3168 I3170	L3111-I3143 HydrophobicContact CB-CG2 4.5Å; L3111-I3143 HydrophobicContact CD2-CD1 4.12Å; L3111-I3143 HydrophobicContact CD2-CG2 4.38Å; L3111-I3143 HydrophobicContact CG-CD1 4.3Å; L3111-I3143 HydrophobicContact CG-CG1 4.31Å; L3111-I3143 HydrophobicContact CG-CG2 4.17Å; L3111-I3143 WeakPolarHBondContact O-CG1 3.36Å; L3111-I3143 VanDerWaalsContact O-CG2 3.3Å; L3111-I3143 WeakPolarHBondContact O-CG2 3.36Å; L3111-I3143 PolarHBondContact O-N 3.07Å; G3112-I3143 WeakPolarHBondContact O-CG2 3.32Å; G3112-I3143 PolarHBondContact O-N 3.32Å; G3112-I3143 VanDerWaalsContact O-N 3.16Å; I3114-I3143 HydrophobicContact CB-CD1 3.56Å; I3114-I3143 HydrophobicContact CB-CG2 4.5Å; I3114-I3143 HydrophobicContact CG2-CD1 3.52Å; I3114-I3143 HydrophobicContact CG2-CG1 4.21Å; I3114-I3143 HydrophobicContact CG2-CG2 4.02Å; P3131-I3143 HydrophobicContact CB-CD1 3.83Å; P3131-I3143 HydrophobicContact CB-CG2 3.97Å; P3131-I3143 HydrophobicContact CG-CD1 3.63Å; P3131-I3143 HydrophobicContact CG-CG2 3.92Å; Y3138-I3143 HydrophobicContact CE2-CB 4.41Å; Y3138-I3143 HydrophobicContact CE2-CG2 3.72Å; G3141-I3143 PolarHBondContact O-N 3.32Å; I3143-V3167 CarbonylContact O-C 3.49Å; I3143-V3167 WeakPolarHBondContact O-CA 3.46Å; I3143-A3168 HydrophobicContact CB-CB 4.33Å; I3143-A3168 HydrophobicContact CG1-CB 4.27Å; I3143-A3168 HydrophobicContact CG2-CB 4.32Å; I3143-A3168 PolarHBondContact O-N 3.06Å; I3143-I3170 HydrophobicContact CD1-CG2 3.55Å; I3143-I3170 VanDerWaalsContact CD1-CG2 3.46Å; I3143-I3170 HydrophobicContact CG1-CG2 3.95Å
3144	L	93	Very high	80.7	Confident	42.6667 Å²	42.6667	55.1 Å²	55.1	22%	0.223	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	126.8	176.7	174.5	65.3	0	0	0	109.4	L3109 E3110 L3111 P3142 I3146 I3165 S3166 V3167	L3109-L3144 HydrophobicContact CD2-CD2 4.29Å; L3109-L3144 HydrophobicContact CD2-CG 4.49Å; E3110-L3144 WeakPolarHBondContact CA-O 3.4Å; L3111-L3144 HydrophobicContact CB-CB 4.33Å; L3111-L3144 PolarHBondContact N-O 2.78Å; L3111-L3144 PolarHBondContact O-N 3.28Å; P3142-L3144 VanDerWaalsContact C-N 3.28Å; P3142-L3144 PolarHBondContact O-N 3.15Å; L3144-I3146 HydrophobicContact CD1-CD1 4.34Å; L3144-I3146 HydrophobicContact CD1-CG1 4.02Å; L3144-I3146 HydrophobicContact CD2-CD1 4.42Å; L3144-I3146 HydrophobicContact CG-CG1 4.32Å; L3144-I3165 HydrophobicContact CD1-CG2 4.26Å; L3144-S3166 WeakPolarHBondContact CA-O 3.36Å; L3144-V3167 HydrophobicContact CD1-CG2 3.99Å
3145	R	93.8	Very high	80.9	Confident	90 Å²	90	53.6 Å²	53.6	34%	0.34	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	128.1	166.7	-154.6	175.4	140.9	165.5	1.2	109.5	L3109 E3110 P3142 E3164 I3165 S3166	L3109-R3145 CarbonylContact O-C 3.51Å; L3109-R3145 WeakPolarHBondContact O-CA 3.33Å; E3110-R3145 HydrophobicContact CB-CG 4.36Å; E3110-R3145 HydrophobicContact CG-CB 3.91Å; E3110-R3145 HydrophobicContact CG-CG 3.84Å; E3110-R3145 WeakPolarHBondContact OE1-CD 3.28Å; E3110-R3145 WeakPolarHBondContact OE1-CG 3.36Å; E3110-R3145 IonicContact OE1-CZ 3.37Å; E3110-R3145 IonicContact OE1-NE 3.06Å; E3110-R3145 PolarHBondContact OE1-NE 3.25Å; E3110-R3145 IonicContact OE1-NH1 2.77Å; E3110-R3145 PolarHBondContact OE1-NH1 2.95Å; E3110-R3145 IonicContact OE1-NH2 2.93Å; E3110-R3145 IonicContact OE2-CZ 2.64Å; E3110-R3145 IonicContact OE2-NE 2.63Å; E3110-R3145 PolarHBondContact OE2-NE 3.22Å; E3110-R3145 IonicContact OE2-NH2 3.46Å; E3110-R3145 PolarHBondContact OE2-NH2 2.97Å; P3142-R3145 HydrophobicContact CG-CB 4.35Å; P3142-R3145 HydrophobicContact CG-CG 3.87Å; R3145-E3164 IonicContact CZ-OE1 3.14Å; R3145-E3164 IonicContact CZ-OE2 2.77Å; R3145-E3164 VanDerWaalsContact CZ-OE2 3.28Å; R3145-E3164 IonicContact NE-OE1 2.66Å; R3145-E3164 IonicContact NE-OE2 3.89Å; R3145-E3164 PolarHBondContact NE-OE2 2.91Å; R3145-E3164 IonicContact NH2-OE1 2.71Å; R3145-E3164 PolarHBondContact NH2-OE1 3.49Å; R3145-E3164 IonicContact NH2-OE2 3.76Å; R3145-E3164 PolarHBondContact NH2-OE2 3.27Å; R3145-I3165 CarbonylContact O-C 3.55Å; R3145-I3165 WeakPolarHBondContact O-CA 3.42Å; R3145-S3166 PolarHBondContact N-O 3.12Å; R3145-S3166 PolarHBondContact O-N 3.21Å
3146	I	95.1	Very high	81.3	Confident	45.6667 Å²	45.6667	53.5 Å²	53.5	23%	0.234	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	119.4	168.9	-55.7	174	0	0	0	107.2	R3108 L3109 L3144 M3163 E3164 I3165	R3108-I3146 CarbonylContact C-O 3.57Å; R3108-I3146 WeakPolarHBondContact CA-O 3.38Å; L3109-I3146 HydrophobicContact CB-CB 4.34Å; L3109-I3146 PolarHBondContact N-O 3.17Å; L3109-I3146 PolarHBondContact O-N 3.27Å; L3144-I3146 HydrophobicContact CD1-CD1 4.34Å; L3144-I3146 HydrophobicContact CD1-CG1 4.02Å; L3144-I3146 HydrophobicContact CD2-CD1 4.42Å; L3144-I3146 HydrophobicContact CG-CG1 4.32Å; I3146-M3163 HydrophobicContact CG2-CE 3.76Å; I3146-E3164 WeakPolarHBondContact CA-O 3.47Å; I3146-I3165 HydrophobicContact CG1-CG1 4.41Å; I3146-I3165 HydrophobicContact CG1-CG2 4.33Å; I3146-I3165 HydrophobicContact CG2-CG1 4.41Å
3147	A	94.4	Very high	81.8	Confident	34.3333 Å²	34.3333	54.3 Å²	54.3	28%	0.284	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	133.9	170.5	0	0	0	0	0	109.1	H3107 M3163 E3164	H3107-A3147 CarbonylContact O-C 3.55Å; H3107-A3147 WeakPolarHBondContact O-CA 3.31Å; A3147-M3163 CarbonylContact O-C 3.54Å; A3147-M3163 WeakPolarHBondContact O-CA 3.38Å; A3147-E3164 HydrophobicContact CB-CB 4.38Å; A3147-E3164 PolarHBondContact N-O 3.02Å; A3147-E3164 PolarHBondContact O-N 3.31Å
3148	C	93.1	Very high	82.7	Confident	11 Å²	11	48 Å²	48	7%	0.074	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	129	179.2	-172.2	0	0	0	0	110	S3106 H3107 D3150 K3160 A3162 M3163	S3106-C3148 CarbonylContact C-O 3.51Å; S3106-C3148 VanDerWaalsContact CA-O 3.22Å; S3106-C3148 WeakPolarHBondContact CA-O 3.4Å; S3106-C3148 WeakPolarHBondContact CB-O 3.3Å; H3107-C3148 HydrophobicContact CB-CB 4.41Å; H3107-C3148 PolarHBondContact N-O 3.05Å; H3107-C3148 PolarHBondContact O-N 3.31Å; C3148-D3150 PolarHBondContact SG-OD1 3.37Å; C3148-K3160 VanDerWaalsContact SG-CE 3.57Å; C3148-K3160 WeakPolarHBondContact SG-CE 3.42Å; C3148-K3160 PolarHBondContact SG-NZ 2.99Å; C3148-K3160 VanDerWaalsContact SG-NZ 3.44Å; C3148-A3162 CarbonylContact C-O 3.52Å; C3148-A3162 VanDerWaalsContact CA-O 3.29Å; C3148-A3162 WeakPolarHBondContact CA-O 3.38Å; C3148-A3162 PolarHBondContact SG-O 3.28Å; C3148-A3162 VanDerWaalsContact SG-O 3.39Å; C3148-M3163 HydrophobicContact CB-CB 4.46Å; C3148-M3163 HydrophobicContact CB-CG 4.23Å
3149	S	91.5	Very high	83.6	Confident	24.3333 Å²	24.3333	47.6 Å²	47.6	17%	0.17	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	139	170.7	52.9	0	0	0	0	111.3	K3160 E3161 A3162	S3149-K3160 CarbonylContact O-C 3.58Å; S3149-K3160 WeakPolarHBondContact O-CA 3.43Å; S3149-E3161 VanDerWaalsContact CB-OE2 3.23Å; S3149-E3161 WeakPolarHBondContact CB-OE2 3.36Å; S3149-E3161 PolarHBondContact O-N 3.32Å; S3149-E3161 WeakPolarHBondContact OG-CB 3.37Å; S3149-E3161 PolarHBondContact OG-OE2 3.11Å; S3149-A3162 PolarHBondContact N-O 3.25Å; S3149-A3162 PolarHBondContact OG-N 3.15Å; S3149-A3162 VanDerWaalsContact OG-N 3.09Å; S3149-A3162 PolarHBondContact OG-O 3.42Å
3150	D	87.8	Confident	84.6	Confident	26.3333 Å²	26.3333	45.5 Å²	45.5	14%	0.141	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	128	179.8	-76.9	53.7	0	0	0	108	S3104 G3105 H3107 C3148 S3158 V3159 K3160	S3104-D3150 CarbonylContact C-O 3.55Å; S3104-D3150 VanDerWaalsContact CA-O 3.3Å; S3104-D3150 WeakPolarHBondContact CA-O 3.31Å; S3104-D3150 VanDerWaalsContact CB-O 3.26Å; S3104-D3150 WeakPolarHBondContact CB-O 3.22Å; G3105-D3150 PolarHBondContact N-O 3.17Å; G3105-D3150 PolarHBondContact O-N 3.31Å; H3107-D3150 IonicContact CD2-OD1 3.08Å; H3107-D3150 PolarHBondContact CD2-OD1 3.03Å; C3148-D3150 PolarHBondContact SG-OD1 3.37Å; D3150-S3158 PolarHBondContact OD2-OG 2.99Å; D3150-V3159 CarbonylContact C-O 3.53Å; D3150-V3159 WeakPolarHBondContact CA-O 3.41Å; D3150-K3160 VanDerWaalsContact OD1-CD 3.31Å; D3150-K3160 WeakPolarHBondContact OD1-CD 3.45Å; D3150-K3160 IonicContact OD1-NZ 3.33Å; D3150-K3160 PolarHBondContact OD1-NZ 3.21Å; D3150-K3160 WeakPolarHBondContact OD2-CD 3.44Å; D3150-K3160 WeakPolarHBondContact OD2-CE 3.49Å; D3150-K3160 IonicContact OD2-NZ 3.41Å; D3150-K3160 PolarHBondContact OD2-NZ 3.32Å
3151	L	87.7	Confident	85.5	Confident	66.6667 Å²	66.6667	48.8 Å²	48.8	35%	0.349	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	164.3	170.8	-66	173.5	0	0	0	111	V3159 E3161 L3568	L3151-V3159 HydrophobicContact CB-CB 4.26Å; L3151-V3159 HydrophobicContact CB-CG1 4.33Å; L3151-V3159 HydrophobicContact CD1-CG1 4.26Å; L3151-V3159 PolarHBondContact N-O 3.39Å; L3151-E3161 HydrophobicContact CD1-CB 4.1Å; L3151-E3161 HydrophobicContact CD1-CG 4.23Å; L3151-E3161 HydrophobicContact CD2-CB 4.14Å; L3151-E3161 HydrophobicContact CD2-CG 4.11Å; L3151-E3161 HydrophobicContact CG-CB 3.89Å; L3151-E3161 HydrophobicContact CG-CG 4.49Å; L3151-L3568 HydrophobicContact CD1-CD1 3.96Å
3152	A	82.3	Confident	86.1	Confident	35 Å²	35	49.1 Å²	49.1	29%	0.289	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-48	126.7	173.9	0	0	0	0	0	111.7	D3102 D3103 V3154	D3102-A3152 HydrophobicContact CB-CB 4.43Å; D3102-A3152 VanDerWaalsContact O-CB 3.25Å; D3102-A3152 WeakPolarHBondContact O-CB 3.37Å; D3103-A3152 HydrophobicContact CB-CB 4.22Å; A3152-V3154 PolarHBondContact O-N 2.85Å
3153	P	81.5	Confident	86.4	Confident	46.6667 Å²	46.6667	49.6 Å²	49.6	30%	0.303	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	129.7	-172	-9.9	13.9	0	0	0	113.9	D3103 G3155 I3157	D3103-P3153 HydrophobicContact CB-CG 4.18Å; P3153-G3155 PolarHBondContact O-N 3.24Å; P3153-I3157 CarbonylContact C-O 3.53Å; P3153-I3157 VanDerWaalsContact CA-O 3.28Å; P3153-I3157 WeakPolarHBondContact CA-O 3.38Å; P3153-I3157 WeakPolarHBondContact CB-O 3.38Å
3154	V	78.1	Confident	86.5	Confident	77.6667 Å²	77.6667	52.5 Å²	52.5	47%	0.471	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	114.9	178.7	-178.1	0	0	0	0	109.3	A3152 G3156 I3157 V3159	A3152-V3154 PolarHBondContact O-N 2.85Å; V3154-G3156 PolarHBondContact O-N 3.03Å; V3154-I3157 PolarHBondContact N-O 2.94Å; V3154-I3157 VanDerWaalsContact N-O 3.07Å; V3154-I3157 WeakPolarHBondContact O-CB 3.4Å; V3154-I3157 PolarHBondContact O-N 3.02Å; V3154-V3159 HydrophobicContact CB-CG2 4.32Å; V3154-V3159 HydrophobicContact CG2-CG2 4Å
3155	G	73	Confident	86.6	Confident	67 Å²	67	52.5 Å²	52.5	69%	0.691	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.1	22.3	-178.3	0	0	0	0	0	114.4	P3153 I3157	P3153-G3155 PolarHBondContact O-N 3.24Å; G3155-I3157 VanDerWaalsContact C-N 3.31Å
3156	G	70.7	Confident	86.5	Confident	43.6667 Å²	43.6667	50.4 Å²	50.4	45%	0.45	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.1	0.6	-173.6	0	0	0	0	0	114.7	V3154	V3154-G3156 PolarHBondContact O-N 3.03Å
3157	I	74.3	Confident	86.4	Confident	88 Å²	88	50.5 Å²	50.5	45%	0.451	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	125.7	172.4	-53.7	176.9	0	0	0	108.4	P3153 V3154 G3155 V3159 A3561 V3566	P3153-I3157 CarbonylContact C-O 3.53Å; P3153-I3157 VanDerWaalsContact CA-O 3.28Å; P3153-I3157 WeakPolarHBondContact CA-O 3.38Å; P3153-I3157 WeakPolarHBondContact CB-O 3.38Å; V3154-I3157 PolarHBondContact N-O 2.94Å; V3154-I3157 VanDerWaalsContact N-O 3.07Å; V3154-I3157 WeakPolarHBondContact O-CB 3.4Å; V3154-I3157 PolarHBondContact O-N 3.02Å; G3155-I3157 VanDerWaalsContact C-N 3.31Å; I3157-V3159 PolarHBondContact O-N 2.71Å; I3157-A3561 HydrophobicContact CG1-CB 3.76Å; I3157-V3566 HydrophobicContact CG2-CG2 3.92Å
3158	S	79.9	Confident	86.1	Confident	53.6667 Å²	53.6667	49.6 Å²	49.6	38%	0.375	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	131.8	173.5	-169.3	0	0	0	0	110.2	D3150 K3565 V3566	D3150-S3158 PolarHBondContact OD2-OG 2.99Å; S3158-K3565 WeakPolarHBondContact O-CA 3.43Å; S3158-V3566 PolarHBondContact O-N 3.27Å
3159	V	85.1	Confident	86	Confident	28.6667 Å²	28.6667	50.8 Å²	50.8	17%	0.174	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	117.6	176.6	179.8	0	0	0	0	108.1	D3150 L3151 V3154 I3157 V3566 L3568	D3150-V3159 CarbonylContact C-O 3.53Å; D3150-V3159 WeakPolarHBondContact CA-O 3.41Å; L3151-V3159 HydrophobicContact CB-CB 4.26Å; L3151-V3159 HydrophobicContact CB-CG1 4.33Å; L3151-V3159 HydrophobicContact CD1-CG1 4.26Å; L3151-V3159 PolarHBondContact N-O 3.39Å; V3154-V3159 HydrophobicContact CB-CG2 4.32Å; V3154-V3159 HydrophobicContact CG2-CG2 4Å; I3157-V3159 PolarHBondContact O-N 2.71Å; V3159-V3566 HydrophobicContact CG1-CB 4.38Å; V3159-V3566 HydrophobicContact CG2-CB 4.26Å; V3159-V3566 HydrophobicContact CG2-CG2 4.39Å; V3159-L3568 HydrophobicContact CG1-CD1 4Å; V3159-L3568 HydrophobicContact CG1-CD2 4.41Å; V3159-L3568 HydrophobicContact CG1-CG 4.01Å
3160	K	87.4	Confident	86	Confident	63.3333 Å²	63.3333	51.4 Å²	51.4	28%	0.275	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	123.7	171.9	-62.9	-83	-168.1	-176.5	0	109	C3148 S3149 D3150 M3163 V3566 F3567 L3568	C3148-K3160 VanDerWaalsContact SG-CE 3.57Å; C3148-K3160 WeakPolarHBondContact SG-CE 3.42Å; C3148-K3160 PolarHBondContact SG-NZ 2.99Å; C3148-K3160 VanDerWaalsContact SG-NZ 3.44Å; S3149-K3160 CarbonylContact O-C 3.58Å; S3149-K3160 WeakPolarHBondContact O-CA 3.43Å; D3150-K3160 VanDerWaalsContact OD1-CD 3.31Å; D3150-K3160 WeakPolarHBondContact OD1-CD 3.45Å; D3150-K3160 IonicContact OD1-NZ 3.33Å; D3150-K3160 PolarHBondContact OD1-NZ 3.21Å; D3150-K3160 WeakPolarHBondContact OD2-CD 3.44Å; D3150-K3160 WeakPolarHBondContact OD2-CE 3.49Å; D3150-K3160 IonicContact OD2-NZ 3.41Å; D3150-K3160 PolarHBondContact OD2-NZ 3.32Å; K3160-M3163 HydrophobicContact CD-SD 4.38Å; K3160-M3163 PolarHBondContact NZ-SD 3.43Å; K3160-V3566 PolarHBondContact N-O 3.47Å; K3160-F3567 HydrophobicContact CB-CD1 3.73Å; K3160-F3567 HydrophobicContact CB-CE1 4.22Å; K3160-F3567 HydrophobicContact CB-CG 4.39Å; K3160-F3567 HydrophobicContact CG-CD1 3.86Å; K3160-F3567 HydrophobicContact CG-CE1 3.83Å; K3160-F3567 WeakPolarHBondContact O-CA 3.39Å; K3160-L3568 PolarHBondContact O-N 2.9Å
3161	E	89.8	Confident	86.2	Confident	105 Å²	105	51.5 Å²	51.5	49%	0.491	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	-65.1	177	170.9	-168.9	-120.1	0	0	109.7	S3149 L3151 Y3569	S3149-E3161 VanDerWaalsContact CB-OE2 3.23Å; S3149-E3161 WeakPolarHBondContact CB-OE2 3.36Å; S3149-E3161 PolarHBondContact O-N 3.32Å; S3149-E3161 WeakPolarHBondContact OG-CB 3.37Å; S3149-E3161 PolarHBondContact OG-OE2 3.11Å; L3151-E3161 HydrophobicContact CD1-CB 4.1Å; L3151-E3161 HydrophobicContact CD1-CG 4.23Å; L3151-E3161 HydrophobicContact CD2-CB 4.14Å; L3151-E3161 HydrophobicContact CD2-CG 4.11Å; L3151-E3161 HydrophobicContact CG-CB 3.89Å; L3151-E3161 HydrophobicContact CG-CG 4.49Å; E3161-Y3569 WeakPolarHBondContact O-CB 3.39Å; E3161-Y3569 PolarHBondContact O-N 3.14Å
3162	A	91.2	Very high	86.5	Confident	40 Å²	40	51.5 Å²	51.5	33%	0.331	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	141.3	179.3	0	0	0	0	0	111.1	C3148 S3149 Y3569	C3148-A3162 CarbonylContact C-O 3.52Å; C3148-A3162 VanDerWaalsContact CA-O 3.29Å; C3148-A3162 WeakPolarHBondContact CA-O 3.38Å; C3148-A3162 PolarHBondContact SG-O 3.28Å; C3148-A3162 VanDerWaalsContact SG-O 3.39Å; S3149-A3162 PolarHBondContact N-O 3.25Å; S3149-A3162 PolarHBondContact OG-N 3.15Å; S3149-A3162 VanDerWaalsContact OG-N 3.09Å; S3149-A3162 PolarHBondContact OG-O 3.42Å; A3162-Y3569 WeakPolarHBondContact CA-O 3.29Å; A3162-Y3569 HydrophobicContact CB-CD1 4.36Å
3163	M	93.4	Very high	87	Confident	49 Å²	49	52.8 Å²	52.8	24%	0.241	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	108.3	169.2	-175.4	174	179.8	0	0	109.3	I3146 A3147 C3148 K3160 I3165 F3567 Y3569 I3570 K3571 W3611	I3146-M3163 HydrophobicContact CG2-CE 3.76Å; A3147-M3163 CarbonylContact O-C 3.54Å; A3147-M3163 WeakPolarHBondContact O-CA 3.38Å; C3148-M3163 HydrophobicContact CB-CB 4.46Å; C3148-M3163 HydrophobicContact CB-CG 4.23Å; K3160-M3163 HydrophobicContact CD-SD 4.38Å; K3160-M3163 PolarHBondContact NZ-SD 3.43Å; M3163-I3165 HydrophobicContact CE-CD1 3.84Å; M3163-I3165 HydrophobicContact CE-CG1 4.14Å; M3163-I3165 HydrophobicContact CG-CG1 4.31Å; M3163-I3165 HydrophobicContact SD-CD1 4.38Å; M3163-F3567 HydrophobicContact SD-CE1 4.23Å; M3163-Y3569 PolarHBondContact N-O 3.02Å; M3163-I3570 HydrophobicContact CB-CG1 4.4Å; M3163-I3570 HydrophobicContact CB-CG2 4.21Å; M3163-I3570 HydrophobicContact CG-CG2 4.43Å; M3163-I3570 CarbonylContact O-C 3.57Å; M3163-I3570 WeakPolarHBondContact O-CA 3.35Å; M3163-I3570 HydrophobicContact SD-CG2 4.39Å; M3163-K3571 PolarHBondContact O-N 2.62Å; M3163-W3611 HydrophobicContact CE-CH2 3.78Å; M3163-W3611 HydrophobicContact CE-CZ3 3.86Å; M3163-W3611 HydrophobicContact SD-CH2 3.99Å; M3163-W3611 HydrophobicContact SD-CZ3 3.94Å
3164	E	93.7	Very high	87.5	Confident	63.3333 Å²	63.3333	53.3 Å²	53.3	30%	0.296	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	127.6	173.7	-173.2	176.6	-143.7	0	0	109.9	R3145 I3146 A3147 K3571 P3573	R3145-E3164 IonicContact CZ-OE1 3.14Å; R3145-E3164 IonicContact CZ-OE2 2.77Å; R3145-E3164 VanDerWaalsContact CZ-OE2 3.28Å; R3145-E3164 IonicContact NE-OE1 2.66Å; R3145-E3164 IonicContact NE-OE2 3.89Å; R3145-E3164 PolarHBondContact NE-OE2 2.91Å; R3145-E3164 IonicContact NH2-OE1 2.71Å; R3145-E3164 PolarHBondContact NH2-OE1 3.49Å; R3145-E3164 IonicContact NH2-OE2 3.76Å; R3145-E3164 PolarHBondContact NH2-OE2 3.27Å; I3146-E3164 WeakPolarHBondContact CA-O 3.47Å; A3147-E3164 HydrophobicContact CB-CB 4.38Å; A3147-E3164 PolarHBondContact N-O 3.02Å; A3147-E3164 PolarHBondContact O-N 3.31Å; E3164-K3571 VanDerWaalsContact CA-O 3.32Å; E3164-K3571 WeakPolarHBondContact CA-O 3.41Å; E3164-K3571 VanDerWaalsContact OE1-CD 3.31Å; E3164-K3571 WeakPolarHBondContact OE1-CD 3.27Å; E3164-K3571 WeakPolarHBondContact OE1-CE 3.4Å; E3164-K3571 IonicContact OE1-NZ 3.63Å; E3164-K3571 PolarHBondContact OE1-NZ 3.01Å; E3164-P3573 HydrophobicContact CG-CG 4.34Å; E3164-P3573 WeakPolarHBondContact OE1-CG 3.46Å
3165	I	94.4	Very high	88.1	Confident	42.3333 Å²	42.3333	50.3 Å²	50.3	22%	0.217	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	106.9	172.1	-55	175.6	0	0	0	107.4	L3144 R3145 I3146 M3163 V3167 K3571 I3572 P3573 F3614	L3144-I3165 HydrophobicContact CD1-CG2 4.26Å; R3145-I3165 CarbonylContact O-C 3.55Å; R3145-I3165 WeakPolarHBondContact O-CA 3.42Å; I3146-I3165 HydrophobicContact CG1-CG1 4.41Å; I3146-I3165 HydrophobicContact CG1-CG2 4.33Å; I3146-I3165 HydrophobicContact CG2-CG1 4.41Å; M3163-I3165 HydrophobicContact CE-CD1 3.84Å; M3163-I3165 HydrophobicContact CE-CG1 4.14Å; M3163-I3165 HydrophobicContact CG-CG1 4.31Å; M3163-I3165 HydrophobicContact SD-CD1 4.38Å; I3165-V3167 HydrophobicContact CG2-CG2 3.98Å; I3165-K3571 PolarHBondContact N-O 2.67Å; I3165-I3572 HydrophobicContact CB-CG1 4.18Å; I3165-I3572 HydrophobicContact CB-CG2 4.37Å; I3165-I3572 HydrophobicContact CD1-CD1 4.19Å; I3165-I3572 HydrophobicContact CD1-CG1 4.37Å; I3165-I3572 WeakPolarHBondContact O-CG2 3.33Å; I3165-P3573 VanDerWaalsContact O-CD 3.27Å; I3165-P3573 WeakPolarHBondContact O-CD 3.2Å; I3165-F3614 HydrophobicContact CD1-CE1 4.03Å; I3165-F3614 HydrophobicContact CD1-CZ 3.78Å
3166	S	92.5	Very high	88.8	Confident	47.6667 Å²	47.6667	51.9 Å²	51.9	33%	0.333	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	128.9	171.7	-93.2	0	0	0	0	109.5	L3144 R3145	L3144-S3166 WeakPolarHBondContact CA-O 3.36Å; R3145-S3166 PolarHBondContact N-O 3.12Å; R3145-S3166 PolarHBondContact O-N 3.21Å
3167	V	91.7	Very high	89.7	Confident	46.6667 Å²	46.6667	54.5 Å²	54.5	28%	0.283	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	129.4	176.9	-165.1	0	0	0	0	107.9	I3143 L3144 I3165 I3170 F3575	I3143-V3167 CarbonylContact O-C 3.49Å; I3143-V3167 WeakPolarHBondContact O-CA 3.46Å; L3144-V3167 HydrophobicContact CD1-CG2 3.99Å; I3165-V3167 HydrophobicContact CG2-CG2 3.98Å; V3167-I3170 HydrophobicContact CG1-CD1 4.14Å; V3167-I3170 HydrophobicContact CG1-CG1 4.44Å; V3167-F3575 HydrophobicContact CB-CD1 4.09Å; V3167-F3575 HydrophobicContact CB-CD2 3.97Å; V3167-F3575 HydrophobicContact CB-CE1 3.88Å; V3167-F3575 HydrophobicContact CB-CE2 3.75Å; V3167-F3575 HydrophobicContact CB-CG 4.14Å; V3167-F3575 HydrophobicContact CB-CZ 3.7Å; V3167-F3575 HydrophobicContact CG1-CD2 4.05Å; V3167-F3575 HydrophobicContact CG1-CE2 3.6Å; V3167-F3575 HydrophobicContact CG1-CZ 3.9Å; V3167-F3575 HydrophobicContact CG2-CE1 4.02Å; V3167-F3575 HydrophobicContact CG2-CE2 4.46Å; V3167-F3575 HydrophobicContact CG2-CZ 3.94Å; V3167-F3575 WeakPolarHBondContact O-CB 3.24Å
3168	A	89.9	Confident	90.5	Very high	16 Å²	16	50.9 Å²	50.9	13%	0.132	27%	0.272	C	S	.	.			trans	-71.5	164.8	174.2	0	0	0	0	0	111.1	Y3138 I3143 I3170	Y3138-A3168 HydrophobicContact CD2-CB 3.9Å; Y3138-A3168 HydrophobicContact CE2-CB 4.03Å; I3143-A3168 HydrophobicContact CB-CB 4.33Å; I3143-A3168 HydrophobicContact CG1-CB 4.27Å; I3143-A3168 HydrophobicContact CG2-CB 4.32Å; I3143-A3168 PolarHBondContact O-N 3.06Å; A3168-I3170 PolarHBondContact O-N 3.43Å
3169	P	90.6	Very high	91	Very high	35 Å²	35	53.2 Å²	53.2	23%	0.227	27%	0.273	C	S	.	.			trans	-51.3	127.2	170.7	-30.3	39	0	0	0	112.4	D3132 R3137 P3576	D3132-P3169 HydrophobicContact CB-CB 3.81Å; D3132-P3169 PolarHBondContact N-O 3.19Å; R3137-P3169 HydrophobicContact CB-CB 4.37Å; R3137-P3169 HydrophobicContact CB-CG 4.01Å; P3169-P3576 HydrophobicContact CB-CG 3.98Å; P3169-P3576 HydrophobicContact CG-CG 3.94Å
3170	I	91.3	Very high	91.1	Very high	37.6667 Å²	37.6667	59.2 Å²	59.2	19%	0.193	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	145.9	-178.5	50.7	167.2	0	0	0	112.4	L3129 A3130 I3143 V3167 A3168 F3575 P3576 I3577 R3578	L3129-I3170 HydrophobicContact CD1-CB 4.16Å; L3129-I3170 HydrophobicContact CD1-CD1 4.05Å; L3129-I3170 HydrophobicContact CD1-CG1 4.5Å; L3129-I3170 HydrophobicContact CD1-CG2 4.48Å; A3130-I3170 CarbonylContact O-C 3.58Å; A3130-I3170 WeakPolarHBondContact O-CA 3.38Å; I3143-I3170 HydrophobicContact CD1-CG2 3.55Å; I3143-I3170 VanDerWaalsContact CD1-CG2 3.46Å; I3143-I3170 HydrophobicContact CG1-CG2 3.95Å; V3167-I3170 HydrophobicContact CG1-CD1 4.14Å; V3167-I3170 HydrophobicContact CG1-CG1 4.44Å; A3168-I3170 PolarHBondContact O-N 3.43Å; I3170-F3575 HydrophobicContact CD1-CE2 4.35Å; I3170-F3575 HydrophobicContact CG1-CE2 4.37Å; I3170-P3576 PolarHBondContact N-O 3.4Å; I3170-I3577 HydrophobicContact CD1-CD1 4.01Å; I3170-I3577 HydrophobicContact CD1-CG1 4.18Å; I3170-I3577 HydrophobicContact CG1-CB 4.42Å; I3170-I3577 HydrophobicContact CG1-CD1 4.26Å; I3170-I3577 HydrophobicContact CG1-CG1 3.85Å; I3170-I3577 HydrophobicContact CG1-CG2 4.2Å; I3170-I3577 CarbonylContact O-C 3.59Å; I3170-I3577 WeakPolarHBondContact O-CA 3.28Å; I3170-R3578 PolarHBondContact O-N 2.87Å
3171	V	92.4	Very high	91.2	Very high	27.6667 Å²	27.6667	58.4 Å²	58.4	17%	0.168	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	122.6	172.8	-172.3	0	0	0	0	108.5	L3129 A3130 D3132 Q3173 R3578	L3129-V3171 WeakPolarHBondContact CA-O 3.44Å; A3130-V3171 PolarHBondContact N-O 2.87Å; A3130-V3171 VanDerWaalsContact N-O 3.12Å; A3130-V3171 PolarHBondContact O-N 3.1Å; D3132-V3171 HydrophobicContact CB-CG2 3.79Å; V3171-Q3173 HydrophobicContact CG1-CG 3.88Å; V3171-R3578 HydrophobicContact CG1-CB 4.36Å; V3171-R3578 HydrophobicContact CG2-CB 4.38Å
3172	L	93.6	Very high	91.2	Very high	68.3333 Å²	68.3333	54.2 Å²	54.2	36%	0.358	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	110.8	179.4	175.5	62.2	0	0	0	109.8	V3128 L3129 M3174 I3577 R3578 L3579 S3580	V3128-L3172 HydrophobicContact CG1-CD1 4.37Å; V3128-L3172 CarbonylContact O-C 3.56Å; V3128-L3172 VanDerWaalsContact O-CA 3.32Å; V3128-L3172 WeakPolarHBondContact O-CA 3.25Å; V3128-L3172 WeakPolarHBondContact O-CD1 3.21Å; L3129-L3172 HydrophobicContact CD1-CB 4.46Å; L3129-L3172 HydrophobicContact CD1-CD1 4.39Å; L3172-M3174 HydrophobicContact CD1-CB 4.42Å; L3172-I3577 HydrophobicContact CB-CG2 4.32Å; L3172-R3578 PolarHBondContact N-O 3.05Å; L3172-L3579 HydrophobicContact CB-CD2 4.13Å; L3172-L3579 HydrophobicContact CD2-CD2 3.88Å; L3172-L3579 HydrophobicContact CG-CD2 4.21Å; L3172-L3579 CarbonylContact O-C 3.53Å; L3172-L3579 WeakPolarHBondContact O-CA 3.37Å; L3172-S3580 PolarHBondContact O-N 2.88Å
3173	Q	93.4	Very high	91	Very high	62.3333 Å²	62.3333	55 Å²	55	29%	0.291	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	82.3	-175.9	-53.7	-173	34.3	0	0	110.8	Y3125 V3128 V3171 S3580	Y3125-Q3173 WeakPolarHBondContact CB-O 3.31Å; Y3125-Q3173 HydrophobicContact CD1-CB 3.79Å; Y3125-Q3173 HydrophobicContact CD1-CG 4.27Å; Y3125-Q3173 VanDerWaalsContact CD1-OE1 3.26Å; Y3125-Q3173 HydrophobicContact CD2-CB 4.1Å; Y3125-Q3173 HydrophobicContact CE1-CB 4.36Å; Y3125-Q3173 HydrophobicContact CG-CB 3.65Å; V3128-Q3173 WeakPolarHBondContact CA-O 3.42Å; V3128-Q3173 PolarHBondContact O-N 2.91Å; V3171-Q3173 HydrophobicContact CG1-CG 3.88Å; Q3173-S3580 CarbonylContact C-O 3.51Å; Q3173-S3580 WeakPolarHBondContact CA-O 3.3Å
3174	M	90.3	Very high	90.6	Very high	56.6667 Å²	56.6667	55.6 Å²	55.6	28%	0.279	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	130.1	-171.6	-173.9	165.8	63.6	0	0	113.2	V3128 L3172 F3178 Y3179 S3580 Y3581 K3582	V3128-M3174 HydrophobicContact CG1-CB 4.3Å; V3128-M3174 HydrophobicContact CG1-CG 4.43Å; L3172-M3174 HydrophobicContact CD1-CB 4.42Å; M3174-F3178 HydrophobicContact CG-CD1 4.17Å; M3174-F3178 HydrophobicContact SD-CD1 4.21Å; M3174-Y3179 HydrophobicContact CE-CD2 3.95Å; M3174-Y3179 HydrophobicContact CE-CG 4.45Å; M3174-Y3179 HydrophobicContact SD-CD2 4.09Å; M3174-Y3179 HydrophobicContact SD-CG 4.48Å; M3174-S3580 PolarHBondContact N-O 2.88Å; M3174-Y3581 WeakPolarHBondContact O-CA 3.49Å; M3174-Y3581 VanDerWaalsContact O-CD2 3.26Å; M3174-Y3581 WeakPolarHBondContact O-CD2 3.4Å; M3174-K3582 PolarHBondContact O-N 3.16Å; M3174-K3582 VanDerWaalsContact O-N 3.16Å
3175	S	91	Very high	90.3	Very high	15 Å²	15	53 Å²	53	11%	0.105	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	150.9	169.1	74.4	0	0	0	0	111.4	Q3177 F3178 Y3179	S3175-Q3177 PolarHBondContact O-N 3.37Å; S3175-F3178 PolarHBondContact O-N 3.34Å; S3175-F3178 WeakPolarHBondContact OG-CB 3.42Å; S3175-F3178 PolarHBondContact OG-N 3.28Å; S3175-F3178 VanDerWaalsContact OG-N 3.15Å; S3175-Y3179 PolarHBondContact O-N 3.33Å
3176	K	88.3	Confident	90	Very high	99.3333 Å²	99.3333	54 Å²	54	43%	0.432	27%	0.267	S	S	.	.	H	α-helix	trans	-58.3	-34	174.3	-173.3	-178.8	172.1	-169.9	0	112.2	Y3179 R3180 Y3581 K3582 E3584	K3176-Y3179 PolarHBondContact O-N 3.01Å; K3176-R3180 WeakPolarHBondContact O-CG 3.4Å; K3176-R3180 PolarHBondContact O-N 3.07Å; K3176-R3180 VanDerWaalsContact O-N 3.11Å; K3176-Y3581 WeakPolarHBondContact CB-OH 3.39Å; K3176-Y3581 WeakPolarHBondContact CG-OH 3.45Å; K3176-K3582 PolarHBondContact N-O 2.98Å; K3176-E3584 HydrophobicContact CD-CB 4.03Å; K3176-E3584 IonicContact NZ-OE2 2.75Å; K3176-E3584 PolarHBondContact NZ-OE2 2.92Å
3177	Q	88.9	Confident	89.5	Confident	98.3333 Å²	98.3333	57.1 Å²	57.1	46%	0.46	28%	0.275	S	S	.	.	H	α-helix	trans	-65.4	-48.4	177	-177.1	149.1	-3.4	0	0	111.1	P3121 S3175 Y3179 R3180 I3181	P3121-Q3177 PolarHBondContact O-NE2 3.46Å; S3175-Q3177 PolarHBondContact O-N 3.37Å; Q3177-Y3179 VanDerWaalsContact C-N 3.35Å; Q3177-Y3179 PolarHBondContact O-N 2.89Å; Q3177-R3180 PolarHBondContact O-N 3.06Å; Q3177-I3181 HydrophobicContact CG-CD1 4.09Å; Q3177-I3181 WeakPolarHBondContact O-CG1 3.3Å; Q3177-I3181 PolarHBondContact O-N 3.36Å; Q3177-I3181 VanDerWaalsContact O-N 3.11Å
3178	F	91.4	Very high	88.5	Confident	12.6667 Å²	12.6667	58 Å²	58	6%	0.056	28%	0.282	C	S	.	.	H	α-helix	trans	-58.9	-45.3	175.7	-175	-97.1	0	0	0	111.7	A3086 V3116 S3118 V3128 M3174 S3175 R3180 I3181 M3182	A3086-F3178 HydrophobicContact CB-CE2 3.9Å; A3086-F3178 HydrophobicContact CB-CZ 4.14Å; V3116-F3178 HydrophobicContact CG1-CZ 4.1Å; S3118-F3178 WeakPolarHBondContact OG-CD2 3.48Å; V3128-F3178 HydrophobicContact CB-CE1 4.32Å; V3128-F3178 HydrophobicContact CB-CZ 4.44Å; V3128-F3178 HydrophobicContact CG1-CD1 3.95Å; V3128-F3178 HydrophobicContact CG1-CE1 3.71Å; V3128-F3178 HydrophobicContact CG1-CZ 4.32Å; V3128-F3178 HydrophobicContact CG2-CD1 4.23Å; V3128-F3178 HydrophobicContact CG2-CD2 4.28Å; V3128-F3178 HydrophobicContact CG2-CE1 4.18Å; V3128-F3178 HydrophobicContact CG2-CE2 4.22Å; V3128-F3178 HydrophobicContact CG2-CG 4.27Å; V3128-F3178 HydrophobicContact CG2-CZ 4.16Å; M3174-F3178 HydrophobicContact CG-CD1 4.17Å; M3174-F3178 HydrophobicContact SD-CD1 4.21Å; S3175-F3178 PolarHBondContact O-N 3.34Å; S3175-F3178 WeakPolarHBondContact OG-CB 3.42Å; S3175-F3178 PolarHBondContact OG-N 3.28Å; S3175-F3178 VanDerWaalsContact OG-N 3.15Å; F3178-R3180 VanDerWaalsContact C-N 3.32Å; F3178-R3180 PolarHBondContact O-N 3.13Å; F3178-I3181 WeakPolarHBondContact O-CB 3.49Å; F3178-I3181 PolarHBondContact O-N 3.18Å; F3178-I3181 VanDerWaalsContact O-N 3.16Å; F3178-M3182 HydrophobicContact CD1-CB 4.31Å; F3178-M3182 HydrophobicContact CD1-CG 3.9Å; F3178-M3182 HydrophobicContact CD2-CG 4.2Å; F3178-M3182 HydrophobicContact CE1-CB 4.24Å; F3178-M3182 HydrophobicContact CE1-CE 4.28Å; F3178-M3182 HydrophobicContact CE1-CG 3.7Å; F3178-M3182 HydrophobicContact CE2-CE 3.9Å; F3178-M3182 HydrophobicContact CE2-CG 3.86Å; F3178-M3182 HydrophobicContact CE2-SD 4.16Å; F3178-M3182 HydrophobicContact CG-CG 4.24Å; F3178-M3182 HydrophobicContact CZ-CB 4.44Å; F3178-M3182 HydrophobicContact CZ-CE 3.56Å; F3178-M3182 HydrophobicContact CZ-CG 3.77Å; F3178-M3182 VanDerWaalsContact CZ-CG 3.46Å; F3178-M3182 HydrophobicContact CZ-SD 4.11Å; F3178-M3182 VanDerWaalsContact O-CB 3.24Å; F3178-M3182 WeakPolarHBondContact O-CB 3.49Å; F3178-M3182 WeakPolarHBondContact O-CG 3.38Å; F3178-M3182 PolarHBondContact O-N 3.32Å
3179	Y	90	Very high	87.1	Confident	101.667 Å²	101.667	64.2 Å²	64.2	40%	0.399	31%	0.308	S	S	.	.	H	α-helix	trans	-57.8	-43	176	175.7	-98.2	0	0	0	113.1	M3174 S3175 K3176 Q3177 I3181 M3182 M3183	M3174-Y3179 HydrophobicContact CE-CD2 3.95Å; M3174-Y3179 HydrophobicContact CE-CG 4.45Å; M3174-Y3179 HydrophobicContact SD-CD2 4.09Å; M3174-Y3179 HydrophobicContact SD-CG 4.48Å; S3175-Y3179 PolarHBondContact O-N 3.33Å; K3176-Y3179 PolarHBondContact O-N 3.01Å; Q3177-Y3179 VanDerWaalsContact C-N 3.35Å; Q3177-Y3179 PolarHBondContact O-N 2.89Å; Y3179-I3181 VanDerWaalsContact C-N 3.3Å; Y3179-I3181 PolarHBondContact O-N 3.04Å; Y3179-M3182 PolarHBondContact O-N 3.35Å; Y3179-M3183 HydrophobicContact CD1-CG 4.4Å; Y3179-M3183 HydrophobicContact CD2-CG 4.06Å; Y3179-M3183 HydrophobicContact CE1-CG 3.96Å; Y3179-M3183 HydrophobicContact CE2-CB 4.45Å; Y3179-M3183 HydrophobicContact CE2-CG 3.51Å; Y3179-M3183 VanDerWaalsContact CE2-CG 3.49Å; Y3179-M3183 HydrophobicContact CE2-SD 3.98Å; Y3179-M3183 HydrophobicContact CG-CG 4.45Å; Y3179-M3183 VanDerWaalsContact CZ-CG 3.45Å; Y3179-M3183 VanDerWaalsContact O-CB 3.28Å; Y3179-M3183 WeakPolarHBondContact O-CB 3.39Å; Y3179-M3183 PolarHBondContact O-N 3.46Å; Y3179-M3183 PolarHBondContact OH-SD 3.42Å
3180	R	88.7	Confident	85.3	Confident	155.333 Å²	155.333	68.2 Å²	68.2	59%	0.586	32%	0.322	S	S	*	.	H	α-helix	trans	-67.1	-29.1	178.1	-78	-175.4	105.3	-174	-1.4	113.6	K3176 Q3177 F3178 P3184 E3584	K3176-R3180 WeakPolarHBondContact O-CG 3.4Å; K3176-R3180 PolarHBondContact O-N 3.07Å; K3176-R3180 VanDerWaalsContact O-N 3.11Å; Q3177-R3180 PolarHBondContact O-N 3.06Å; F3178-R3180 VanDerWaalsContact C-N 3.32Å; F3178-R3180 PolarHBondContact O-N 3.13Å; R3180-P3184 WeakPolarHBondContact O-CD 3.35Å; R3180-P3184 WeakPolarHBondContact O-CG 3.37Å; R3180-E3584 IonicContact CZ-OE1 3.16Å; R3180-E3584 IonicContact NH1-OE1 3.21Å; R3180-E3584 PolarHBondContact NH1-OE1 3.08Å; R3180-E3584 IonicContact NH1-OE2 3.46Å; R3180-E3584 IonicContact NH2-OE1 2.69Å
3181	I	88	Confident	83	Confident	46 Å²	46	70.3 Å²	70.3	24%	0.236	34%	0.34	C	S	.	.	H	α-helix	trans	-77.2	-44.3	175.4	-72	169.1	0	0	0	110.4	L3085 A3120 Q3177 F3178 Y3179	L3085-I3181 HydrophobicContact CB-CG2 3.99Å; L3085-I3181 HydrophobicContact CD1-CG2 3.74Å; L3085-I3181 HydrophobicContact CD2-CG2 3.52Å; L3085-I3181 VanDerWaalsContact CD2-CG2 3.44Å; L3085-I3181 HydrophobicContact CG-CG2 3.94Å; A3120-I3181 HydrophobicContact CB-CD1 4.06Å; Q3177-I3181 HydrophobicContact CG-CD1 4.09Å; Q3177-I3181 WeakPolarHBondContact O-CG1 3.3Å; Q3177-I3181 PolarHBondContact O-N 3.36Å; Q3177-I3181 VanDerWaalsContact O-N 3.11Å; F3178-I3181 WeakPolarHBondContact O-CB 3.49Å; F3178-I3181 PolarHBondContact O-N 3.18Å; F3178-I3181 VanDerWaalsContact O-N 3.16Å; Y3179-I3181 VanDerWaalsContact C-N 3.3Å; Y3179-I3181 PolarHBondContact O-N 3.04Å
3182	M	89.7	Confident	80.5	Confident	16.6667 Å²	16.6667	76.7 Å²	76.7	8%	0.082	37%	0.368	C	S	.	.	H	α-helix	trans	-80.2	-28.2	-172.2	-94.7	-17	-22.3	0	0	114.3	M3076 L3085 A3086 F3178 Y3179 F3185 F3186	M3076-M3182 HydrophobicContact CE-CE 3.99Å; M3076-M3182 HydrophobicContact CE-SD 3.39Å; M3076-M3182 WeakPolarHBondContact CE-SD 3.28Å; M3076-M3182 HydrophobicContact CG-CE 4.42Å; M3076-M3182 HydrophobicContact SD-CE 3.41Å; M3076-M3182 WeakPolarHBondContact SD-CE 3.36Å; M3076-M3182 HydrophobicContact SD-SD 4.19Å; L3085-M3182 HydrophobicContact CB-SD 4.47Å; A3086-M3182 HydrophobicContact CB-CE 3.59Å; A3086-M3182 HydrophobicContact CB-SD 4.22Å; F3178-M3182 HydrophobicContact CD1-CB 4.31Å; F3178-M3182 HydrophobicContact CD1-CG 3.9Å; F3178-M3182 HydrophobicContact CD2-CG 4.2Å; F3178-M3182 HydrophobicContact CE1-CB 4.24Å; F3178-M3182 HydrophobicContact CE1-CE 4.28Å; F3178-M3182 HydrophobicContact CE1-CG 3.7Å; F3178-M3182 HydrophobicContact CE2-CE 3.9Å; F3178-M3182 HydrophobicContact CE2-CG 3.86Å; F3178-M3182 HydrophobicContact CE2-SD 4.16Å; F3178-M3182 HydrophobicContact CG-CG 4.24Å; F3178-M3182 HydrophobicContact CZ-CB 4.44Å; F3178-M3182 HydrophobicContact CZ-CE 3.56Å; F3178-M3182 HydrophobicContact CZ-CG 3.77Å; F3178-M3182 VanDerWaalsContact CZ-CG 3.46Å; F3178-M3182 HydrophobicContact CZ-SD 4.11Å; F3178-M3182 VanDerWaalsContact O-CB 3.24Å; F3178-M3182 WeakPolarHBondContact O-CB 3.49Å; F3178-M3182 WeakPolarHBondContact O-CG 3.38Å; F3178-M3182 PolarHBondContact O-N 3.32Å; Y3179-M3182 PolarHBondContact O-N 3.35Å; M3182-F3185 HydrophobicContact CE-CB 4.17Å; M3182-F3185 HydrophobicContact CE-CD1 4.12Å; M3182-F3185 HydrophobicContact CE-CG 4.16Å; M3182-F3185 WeakPolarHBondContact O-CB 3.34Å; M3182-F3185 PolarHBondContact O-N 3.02Å; M3182-F3185 HydrophobicContact SD-CB 4.46Å; M3182-F3186 HydrophobicContact CE-CD2 4.23Å; M3182-F3186 HydrophobicContact CE-CE2 3.51Å; M3182-F3186 VanDerWaalsContact CE-CE2 3.49Å; M3182-F3186 HydrophobicContact CE-CZ 4.01Å; M3182-F3186 HydrophobicContact CG-CD2 4.13Å; M3182-F3186 HydrophobicContact CG-CE2 3.91Å; M3182-F3186 VanDerWaalsContact O-CD2 3.32Å; M3182-F3186 WeakPolarHBondContact O-CD2 3.38Å; M3182-F3186 PolarHBondContact O-N 3.2Å; M3182-F3186 HydrophobicContact SD-CD2 3.94Å; M3182-F3186 HydrophobicContact SD-CE2 3.49Å; M3182-F3186 WeakPolarHBondContact SD-CE2 3.39Å; M3182-F3186 HydrophobicContact SD-CZ 4.4Å
3183	M	87.1	Confident	77.9	Confident	58.3333 Å²	58.3333	79.9 Å²	79.9	29%	0.287	39%	0.386	S	S	.	.	H	α-helix	trans	-62.3	-50.1	179.5	-113.8	-41.7	-71.2	0	0	113	Y3179 F3185 F3186 F3187 K3190	Y3179-M3183 HydrophobicContact CD1-CG 4.4Å; Y3179-M3183 HydrophobicContact CD2-CG 4.06Å; Y3179-M3183 HydrophobicContact CE1-CG 3.96Å; Y3179-M3183 HydrophobicContact CE2-CB 4.45Å; Y3179-M3183 HydrophobicContact CE2-CG 3.51Å; Y3179-M3183 VanDerWaalsContact CE2-CG 3.49Å; Y3179-M3183 HydrophobicContact CE2-SD 3.98Å; Y3179-M3183 HydrophobicContact CG-CG 4.45Å; Y3179-M3183 VanDerWaalsContact CZ-CG 3.45Å; Y3179-M3183 VanDerWaalsContact O-CB 3.28Å; Y3179-M3183 WeakPolarHBondContact O-CB 3.39Å; Y3179-M3183 PolarHBondContact O-N 3.46Å; Y3179-M3183 PolarHBondContact OH-SD 3.42Å; M3183-F3185 VanDerWaalsContact C-N 3.29Å; M3183-F3185 PolarHBondContact O-N 3.16Å; M3183-F3186 PolarHBondContact O-N 3.09Å; M3183-F3187 HydrophobicContact CE-CB 4.32Å; M3183-F3187 HydrophobicContact CE-CD2 3.56Å; M3183-F3187 HydrophobicContact CE-CE2 4.07Å; M3183-F3187 HydrophobicContact CE-CG 4.22Å; M3183-F3187 CarbonylContact O-C 3.6Å; M3183-F3187 WeakPolarHBondContact O-CA 3.32Å; M3183-F3187 WeakPolarHBondContact O-CB 3.36Å; M3183-F3187 PolarHBondContact O-N 3Å; M3183-F3187 HydrophobicContact SD-CD2 3.77Å; M3183-F3187 HydrophobicContact SD-CE2 4.16Å; M3183-K3190 HydrophobicContact CE-CD 3.86Å
3184	P	85.7	Confident	75.1	Confident	60.6667 Å²	60.6667	82.5 Å²	82.5	39%	0.394	41%	0.406	S	S	.	.	H	α-helix	trans	-65.2	-26.3	176.8	-23	35.2	0	0	0	114.2	R3180 F3186 F3187 P3188	R3180-P3184 WeakPolarHBondContact O-CD 3.35Å; R3180-P3184 WeakPolarHBondContact O-CG 3.37Å; P3184-F3186 PolarHBondContact O-N 2.85Å; P3184-F3187 CarbonylContact O-C 3.49Å; P3184-F3187 PolarHBondContact O-N 3.22Å; P3184-P3188 VanDerWaalsContact O-CA 3.29Å; P3184-P3188 WeakPolarHBondContact O-CA 3.39Å; P3184-P3188 WeakPolarHBondContact O-CD 3.34Å; P3184-P3188 VanDerWaalsContact O-N 3.11Å
3185	F	87.8	Confident	72.4	Confident	8 Å²	8	85.3 Å²	85.3	4%	0.035	43%	0.426	C	S	.	.	H	α-helix	trans	-64.3	-43.5	178.9	-175.4	-79.7	0	0	0	112.1	T2768 S2770 Y2773 W3074 M3076 T3077 L3085 M3182 M3183	T2768-F3185 WeakPolarHBondContact O-CE2 3.48Å; T2768-F3185 WeakPolarHBondContact O-CZ 3.17Å; S2770-F3185 WeakPolarHBondContact CB-O 3.35Å; S2770-F3185 PolarHBondContact OG-O 2.94Å; Y2773-F3185 HydrophobicContact CD1-CE1 4.33Å; Y2773-F3185 HydrophobicContact CD2-CE1 4.37Å; Y2773-F3185 AromaticContact CG-CE1 3.84Å; Y2773-F3185 HydrophobicContact CG-CE1 4.14Å; Y2773-F3185 HydrophobicContact CG-CZ 4.49Å; W3074-F3185 HydrophobicContact CH2-CE1 4.35Å; W3074-F3185 AromaticContact CZ2-CE1 3.93Å; W3074-F3185 HydrophobicContact CZ2-CE1 3.93Å; W3074-F3185 HydrophobicContact CZ2-CZ 4.17Å; M3076-F3185 HydrophobicContact CB-CD2 4.5Å; M3076-F3185 HydrophobicContact CB-CE1 4.34Å; M3076-F3185 HydrophobicContact CB-CE2 3.97Å; M3076-F3185 HydrophobicContact CB-CZ 3.95Å; M3076-F3185 HydrophobicContact CE-CD1 3.24Å; M3076-F3185 HydrophobicContact CE-CD2 4.28Å; M3076-F3185 HydrophobicContact CE-CE1 3.28Å; M3076-F3185 HydrophobicContact CE-CE2 4.28Å; M3076-F3185 HydrophobicContact CE-CG 3.8Å; M3076-F3185 HydrophobicContact CE-CZ 3.83Å; M3076-F3185 HydrophobicContact CG-CE1 3.94Å; M3076-F3185 HydrophobicContact CG-CE2 4.41Å; M3076-F3185 HydrophobicContact CG-CZ 3.8Å; T3077-F3185 WeakPolarHBondContact O-CE2 3.38Å; L3085-F3185 HydrophobicContact CD1-CD2 4.25Å; M3182-F3185 HydrophobicContact CE-CB 4.17Å; M3182-F3185 HydrophobicContact CE-CD1 4.12Å; M3182-F3185 HydrophobicContact CE-CG 4.16Å; M3182-F3185 WeakPolarHBondContact O-CB 3.34Å; M3182-F3185 PolarHBondContact O-N 3.02Å; M3182-F3185 HydrophobicContact SD-CB 4.46Å; M3183-F3185 VanDerWaalsContact C-N 3.29Å; M3183-F3185 PolarHBondContact O-N 3.16Å
3186	F	87.1	Confident	69.6	Low	63 Å²	63	89.9 Å²	89.9	28%	0.276	45%	0.454	S	S	.	.	H	α-helix	trans	-90.1	-27.9	178.3	-66.1	-67	0	0	0	113.6	Y2773 W3074 M3076 M3182 M3183 P3184	Y2773-F3186 AromaticContact CE1-CD1 3.88Å; Y2773-F3186 HydrophobicContact CE1-CD1 3.88Å; Y2773-F3186 HydrophobicContact CE1-CE1 4.33Å; Y2773-F3186 HydrophobicContact CE2-CE1 4.29Å; Y2773-F3186 AromaticContact CZ-CD1 3.78Å; Y2773-F3186 AromaticContact CZ-CE1 3.93Å; W3074-F3186 AromaticContact CH2-CE1 3.97Å; W3074-F3186 HydrophobicContact CH2-CE1 3.97Å; W3074-F3186 HydrophobicContact CH2-CZ 4.16Å; W3074-F3186 HydrophobicContact CZ3-CE1 4.42Å; M3076-F3186 HydrophobicContact CE-CD2 4.48Å; M3076-F3186 HydrophobicContact CE-CE1 4.17Å; M3076-F3186 HydrophobicContact CE-CE2 3.72Å; M3076-F3186 HydrophobicContact CE-CZ 3.57Å; M3076-F3186 VanDerWaalsContact CE-CZ 3.45Å; M3076-F3186 HydrophobicContact SD-CZ 4.26Å; M3182-F3186 HydrophobicContact CE-CD2 4.23Å; M3182-F3186 HydrophobicContact CE-CE2 3.51Å; M3182-F3186 VanDerWaalsContact CE-CE2 3.49Å; M3182-F3186 HydrophobicContact CE-CZ 4.01Å; M3182-F3186 HydrophobicContact CG-CD2 4.13Å; M3182-F3186 HydrophobicContact CG-CE2 3.91Å; M3182-F3186 VanDerWaalsContact O-CD2 3.32Å; M3182-F3186 WeakPolarHBondContact O-CD2 3.38Å; M3182-F3186 PolarHBondContact O-N 3.2Å; M3182-F3186 HydrophobicContact SD-CD2 3.94Å; M3182-F3186 HydrophobicContact SD-CE2 3.49Å; M3182-F3186 WeakPolarHBondContact SD-CE2 3.39Å; M3182-F3186 HydrophobicContact SD-CZ 4.4Å; M3183-F3186 PolarHBondContact O-N 3.09Å; P3184-F3186 PolarHBondContact O-N 2.85Å
3187	F	83.3	Confident	66.9	Low	113.333 Å²	113.333	92.2 Å²	92.2	50%	0.497	47%	0.471	S	S	.	.	S	Bend	trans	-135.7	69.1	-174	-53.4	-79.9	0	0	0	110.3	M3183 P3184 E3189 K3190	M3183-F3187 HydrophobicContact CE-CB 4.32Å; M3183-F3187 HydrophobicContact CE-CD2 3.56Å; M3183-F3187 HydrophobicContact CE-CE2 4.07Å; M3183-F3187 HydrophobicContact CE-CG 4.22Å; M3183-F3187 CarbonylContact O-C 3.6Å; M3183-F3187 WeakPolarHBondContact O-CA 3.32Å; M3183-F3187 WeakPolarHBondContact O-CB 3.36Å; M3183-F3187 PolarHBondContact O-N 3Å; M3183-F3187 HydrophobicContact SD-CD2 3.77Å; M3183-F3187 HydrophobicContact SD-CE2 4.16Å; P3184-F3187 CarbonylContact O-C 3.49Å; P3184-F3187 PolarHBondContact O-N 3.22Å; F3187-E3189 PolarHBondContact O-N 3.18Å; F3187-K3190 HydrophobicContact CB-CB 4.44Å; F3187-K3190 HydrophobicContact CB-CD 3.87Å; F3187-K3190 HydrophobicContact CB-CG 4.11Å; F3187-K3190 HydrophobicContact CG-CD 4.32Å; F3187-K3190 PolarHBondContact O-N 2.92Å
3188	P	70.7	Confident	64.1	Low	66 Å²	66	94.5 Å²	94.5	43%	0.429	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-58.8	98.5	179.2	22.8	-32.8	0	0	0	110.8	H2774 P3184 K3190 S3191	H2774-P3188 VanDerWaalsContact NE2-CD 3.31Å; H2774-P3188 WeakPolarHBondContact NE2-CD 3.48Å; H2774-P3188 VanDerWaalsContact NE2-CG 3.26Å; H2774-P3188 WeakPolarHBondContact NE2-CG 3.24Å; P3184-P3188 VanDerWaalsContact O-CA 3.29Å; P3184-P3188 WeakPolarHBondContact O-CA 3.39Å; P3184-P3188 WeakPolarHBondContact O-CD 3.34Å; P3184-P3188 VanDerWaalsContact O-N 3.11Å; P3188-K3190 PolarHBondContact O-N 3.25Å; P3188-S3191 WeakPolarHBondContact O-CB 3.38Å; P3188-S3191 PolarHBondContact O-N 2.9Å; P3188-S3191 VanDerWaalsContact O-N 3.17Å; P3188-S3191 PolarHBondContact O-OG 2.78Å
3189	E	60.5	Low	61.1	Low	145.333 Å²	145.333	100.2 Å²	100.2	68%	0.679	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-62.6	109	172.7	-66.6	-177.3	173.3	0	0	110.2	F3187 S3191	F3187-E3189 PolarHBondContact O-N 3.18Å; E3189-S3191 PolarHBondContact O-N 2.84Å
3190	K	51.9	Low	58.5	Low	119.667 Å²	119.667	102.5 Å²	102.5	52%	0.52	54%	0.54	S	S	.	.	P	Polyproline II helix	trans	-74	106.7	176.1	-66.1	-177.1	175.8	-174.5	0	110.4	M3183 F3187 P3188 E3192 K3268 N3512 M3513	M3183-K3190 HydrophobicContact CE-CD 3.86Å; F3187-K3190 HydrophobicContact CB-CB 4.44Å; F3187-K3190 HydrophobicContact CB-CD 3.87Å; F3187-K3190 HydrophobicContact CB-CG 4.11Å; F3187-K3190 HydrophobicContact CG-CD 4.32Å; F3187-K3190 PolarHBondContact O-N 2.92Å; P3188-K3190 PolarHBondContact O-N 3.25Å; K3190-E3192 PolarHBondContact O-N 3.18Å; K3190-K3268 PolarHBondContact NZ-O 3.24Å; K3190-N3512 PolarHBondContact NZ-OD1 2.74Å; K3190-N3512 VanDerWaalsContact NZ-OD1 3.16Å; K3190-M3513 PolarHBondContact NZ-SD 2.99Å
3191	S	44	Very low	55.6	Low	81 Å²	81	101.2 Å²	101.2	57%	0.566	55%	0.549	S	S	*	.	S	Bend	trans	-67.9	88.4	173.3	20.6	0	0	0	0	110.5	P3188 E3189 D3193	P3188-S3191 WeakPolarHBondContact O-CB 3.38Å; P3188-S3191 PolarHBondContact O-N 2.9Å; P3188-S3191 VanDerWaalsContact O-N 3.17Å; P3188-S3191 PolarHBondContact O-OG 2.78Å; E3189-S3191 PolarHBondContact O-N 2.84Å; S3191-D3193 PolarHBondContact O-N 3Å
3192	E	40.1	Very low	52.9	Low	162 Å²	162	103.7 Å²	103.7	76%	0.757	58%	0.577	S	S	*	*	G	3₁₀ helix	trans	-76.4	92.3	171.4	-65.9	-173.6	163.4	0	0	108.6	K3190 T3194 T3195	K3190-E3192 PolarHBondContact O-N 3.18Å; E3192-T3194 PolarHBondContact O-N 3.1Å; E3192-T3194 PolarHBondContact O-OG1 3.2Å; E3192-T3195 PolarHBondContact O-N 3.01Å
3193	D	37.1	Very low	50.2	Low	136.667 Å²	136.667	108.6 Å²	108.6	73%	0.731	61%	0.608	S	S	*	*			trans	-62.7	59.8	-176.5	-62	-44.3	0	0	0	112	S3191 T3195	S3191-D3193 PolarHBondContact O-N 3Å; D3193-T3195 PolarHBondContact O-N 3.13Å
3194	T	36.2	Very low	47.5	Very low	117 Å²	117	111.7 Å²	111.7	72%	0.718	63%	0.632	S	S	*	*			trans	-89.5	40.9	-172.1	-49.5	0	0	0	0	110.9	E3192 T3196	E3192-T3194 PolarHBondContact O-N 3.1Å; E3192-T3194 PolarHBondContact O-OG1 3.2Å; T3194-T3196 HydrophobicContact CG2-CG2 3.68Å; T3194-T3196 PolarHBondContact O-N 3.34Å; T3194-T3196 PolarHBondContact O-OG1 2.98Å
3195	T	33.3	Very low	44.9	Very low	115.333 Å²	115.333	115 Å²	115	71%	0.708	65%	0.651	S	S	*	*			trans	-100.8	60.6	-178.4	-43.8	0	0	0	0	111.6	E3192 D3193 N3197	E3192-T3195 PolarHBondContact O-N 3.01Å; D3193-T3195 PolarHBondContact O-N 3.13Å; T3195-N3197 PolarHBondContact O-N 2.87Å
3196	T	31.2	Very low	42.1	Very low	111.333 Å²	111.333	123.3 Å²	123.3	68%	0.683	69%	0.69	S	S	*	*			trans	-72.4	82.9	171.4	47.9	0	0	0	0	113.6	T3194 N3198	T3194-T3196 HydrophobicContact CG2-CG2 3.68Å; T3194-T3196 PolarHBondContact O-N 3.34Å; T3194-T3196 PolarHBondContact O-OG1 2.98Å; T3196-N3198 PolarHBondContact O-N 3.24Å
3197	N	31.3	Very low	39.3	Very low	148 Å²	148	126.1 Å²	126.1	79%	0.791	71%	0.712	S	S	*	*			trans	-141	109	142.2	-89	-28.4	0	0	0	111.3	T3195	T3195-N3197 PolarHBondContact O-N 2.87Å
3198	N	31.8	Very low	36.6	Very low	146.333 Å²	146.333	125.2 Å²	125.2	78%	0.783	73%	0.725	S	S	*	*			trans	160	88.2	158	-82.7	-23.9	0	0	0	114.1	T3196 I3200	T3196-N3198 PolarHBondContact O-N 3.24Å; N3198-I3200 VanDerWaalsContact C-N 3.33Å; N3198-I3200 PolarHBondContact O-N 3.3Å
3199	T	28.4	Very low	34.5	Very low	132 Å²	132	127.5 Å²	127.5	81%	0.81	74%	0.738	S	S	*	*			trans	-110	93.4	150.8	-55.3	0	0	0	0	113
3200	I	34.6	Very low	32.9	Very low	151.333 Å²	151.333	128.3 Å²	128.3	78%	0.776	75%	0.746	S	S	*	*			trans	-173	110.4	154	-71.7	167	0	0	0	112.4	N3198 A3202	N3198-I3200 VanDerWaalsContact C-N 3.33Å; N3198-I3200 PolarHBondContact O-N 3.3Å; I3200-A3202 PolarHBondContact O-N 3.09Å
3201	T	27.5	Very low	31.9	Very low	127 Å²	127	127.1 Å²	127.1	78%	0.779	76%	0.758	S	S	*	*			trans	-22.3	120.1	152.7	-45.6	0	0	0	0	115.6	T3203	T3201-T3203 HydrophobicContact CG2-CG2 4.5Å
3202	A	31.2	Very low	31.1	Very low	98.5 Å²	98.5	131.1 Å²	131.1	81%	0.814	77%	0.773	S	S	*	*			trans	-141.8	116	160.6	0	0	0	0	0	110.5	I3200	I3200-A3202 PolarHBondContact O-N 3.09Å
3203	T	32.9	Very low	30.9	Very low	120 Å²	120	128.7 Å²	128.7	74%	0.736	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-90.2	152	-179.7	40.2	0	0	0	0	112.1	T3201 V3205	T3201-T3203 HydrophobicContact CG2-CG2 4.5Å; T3203-V3205 PolarHBondContact O-N 2.96Å
3204	P	31.2	Very low	30.6	Very low	122.5 Å²	122.5	129.3 Å²	129.3	80%	0.795	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-74.2	129.9	179.7	30	-34.3	0	0	0	111.8	H3206	P3204-H3206 PolarHBondContact O-N 2.86Å; P3204-H3206 VanDerWaalsContact O-N 3.09Å
3205	V	29.8	Very low	30.5	Very low	131.5 Å²	131.5	126.8 Å²	126.8	80%	0.797	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-78.6	107.3	179.4	-179.3	0	0	0	0	111.2	T3203	T3203-V3205 PolarHBondContact O-N 2.96Å
3206	H	30	Very low	30.3	Very low	182.5 Å²	182.5	128.6 Å²	128.6	85%	0.845	78%	0.783	S	S	*	*			trans	-109.1	140.3	143.8	-87.4	-82.5	0	0	0	109.6	P3204	P3204-H3206 PolarHBondContact O-N 2.86Å; P3204-H3206 VanDerWaalsContact O-N 3.09Å
3207	T	28.2	Very low	30.2	Very low	121.5 Å²	121.5	128.3 Å²	128.3	75%	0.745	79%	0.785	S	S	*	*			trans	-144.4	118.9	166.8	-61.8	0	0	0	0	112
3208	A	26.7	Very low	30.2	Very low	93 Å²	93	128.6 Å²	128.6	77%	0.769	79%	0.785	S	S	*	*			trans	-136.1	114.9	146.2	0	0	0	0	0	107.5
3209	T	27.3	Very low	30.1	Very low	115 Å²	115	126.8 Å²	126.8	71%	0.706	78%	0.784	S	S	*	*				123	104.1	114.4	-67.2	0	0	0	0	112.8
3210	I	26.8	Very low	30.1	Very low	161.5 Å²	161.5	125.5 Å²	125.5	83%	0.828	78%	0.78	S	S	*	*			trans	54.5	114.6	143.7	-53.8	172.3	0	0	0	120.1
3211	A	29.4	Very low	30	Very low	95 Å²	95	123.9 Å²	123.9	79%	0.785	78%	0.782	S	S	*	*			trans	-74.9	145.6	138.5	0	0	0	0	0	116.1
3212	N	27.5	Very low	30.1	Very low	164.5 Å²	164.5	122 Å²	122	88%	0.88	78%	0.779	S	S	*	*			trans	-122.8	150.4	174.1	-112.8	1	0	0	0	112.1
3213	P	37	Very low	29.8	Very low	112 Å²	112	126.7 Å²	126.7	73%	0.727	78%	0.782	S	S	*	*			trans	-95.1	161.4	174.7	37.3	-33.8	0	0	0	113.8
3214	T	31.2	Very low	29.5	Very low	148.5 Å²	148.5	127.1 Å²	127.1	91%	0.911	78%	0.784	S	S	*	*			trans	-102.4	150.7	162.9	41.8	0	0	0	0	113.8
3215	G	33.1	Very low	29.3	Very low	65 Å²	65	125.9 Å²	125.9	67%	0.67	78%	0.779	S	S	*	*				144.5	153.6	89.4	0	0	0	0	0	112.9
3216	D	30.2	Very low	29.3	Very low	153 Å²	153	128.3 Å²	128.3	82%	0.818	78%	0.781	S	S	*	*				77.6	120.8	106.6	-59.5	-32.8	0	0	0	118.2
3217	C	28	Very low	29.5	Very low	105.5 Å²	105.5	124.8 Å²	124.8	71%	0.713	77%	0.774	S	S	*	*				118.8	148.5	56.6	-95.4	0	0	0	0	117.8
3218	I	30.7	Very low	29.4	Very low	155 Å²	155	128.2 Å²	128.2	80%	0.795	78%	0.779	S	S	*	*				131.6	170.7	66.1	-40.9	165.1	0	0	0	113.9
3219	S	31.2	Very low	29.4	Very low	108.5 Å²	108.5	128.7 Å²	128.7	76%	0.759	78%	0.777	S	S	*	*				-162.7	157.7	50.1	4.3	0	0	0	0	110.8
3220	S	27.1	Very low	29.3	Very low	104 Å²	104	130.2 Å²	130.2	73%	0.727	78%	0.779	S	S	*	*			trans	124.7	135.1	133.4	64.6	0	0	0	0	115.4
3221	S	32.2	Very low	29.7	Very low	118.5 Å²	118.5	127.9 Å²	127.9	83%	0.829	78%	0.775	S	S	*	*				169.9	158.5	92.4	54.9	0	0	0	0	114.4
3222	A	29.5	Very low	29.7	Very low	86.5 Å²	86.5	131.4 Å²	131.4	72%	0.715	78%	0.775	S	S	*	*				128.9	171.5	61.9	0	0	0	0	0	117.4
3223	F	25.2	Very low	29.8	Very low	197.5 Å²	197.5	130.5 Å²	130.5	87%	0.866	77%	0.77	S	S	*	*			trans	-61.7	170.9	-179.7	-58.9	-84.7	0	0	0	116.2
3224	T	27.7	Very low	29.5	Very low	129 Å²	129	129.7 Å²	129.7	79%	0.791	77%	0.767	S	S	*	*			cis	-159.3	170.3	47.4	48.6	0	0	0	0	115.6
3225	S	26.6	Very low	29.5	Very low	97 Å²	97	129.4 Å²	129.4	68%	0.678	76%	0.764	S	S	*	*			trans	167.9	129.3	160.3	64.2	0	0	0	0	118.7
3226	H	29.5	Very low	29.4	Very low	181.5 Å²	181.5	129.3 Å²	129.3	84%	0.84	76%	0.763	S	S	*	*			trans	145.1	163.8	151	-67.6	-58.9	0	0	0	117.2
3227	P	34.8	Very low	29.3	Very low	108 Å²	108	129.9 Å²	129.9	70%	0.701	77%	0.765	S	S	*	*				-132.6	-176.5	-108.5	42.2	-26.3	0	0	0	115.7
3228	F	24.9	Very low	29.4	Very low	193.5 Å²	193.5	129.7 Å²	129.7	85%	0.849	77%	0.765	S	S	*	*			trans	-116.1	144.3	151.2	-100.5	-99.3	0	0	0	116.3
3229	S	27.6	Very low	29.4	Very low	103 Å²	103	128 Å²	128	72%	0.72	77%	0.767	S	S	*	*			trans	-62.6	133.1	158.1	-3.2	0	0	0	0	118
3230	I	25.6	Very low	29.3	Very low	147.5 Å²	147.5	125.8 Å²	125.8	76%	0.756	76%	0.761	S	S	*	*				152.6	134.7	120.6	-65.6	174	0	0	0	111.3
3231	P	34.1	Very low	29.5	Very low	113 Å²	113	127.7 Å²	127.7	73%	0.734	77%	0.769	S	S	*	*				-130.7	153.6	78.7	29.1	-10.1	0	0	0	114.2
3232	Q	29	Very low	29.3	Very low	169 Å²	169	126.9 Å²	126.9	79%	0.79	76%	0.763	S	S	*	*				67.9	102.5	112.7	-75.3	-162.3	-65.2	0	0	119.6
3233	D	29.7	Very low	29.3	Very low	144.5 Å²	144.5	127.1 Å²	127.1	77%	0.773	76%	0.759	S	S	*	*			trans	130	152.5	134	-81.7	-23.7	0	0	0	116.9
3234	S	31.4	Very low	29.5	Very low	96 Å²	96	124.8 Å²	124.8	67%	0.671	76%	0.756	S	S	*	*			cis	-161.6	159.7	-46.6	56.7	0	0	0	0	112.4
3235	V	31.3	Very low	29.4	Very low	141.5 Å²	141.5	122.4 Å²	122.4	86%	0.858	75%	0.749	S	S	*	*			trans	65.5	130.7	163.6	-171.7	0	0	0	0	119.9
3236	G	30.2	Very low	29.4	Very low	63 Å²	63	126.8 Å²	126.8	65%	0.649	76%	0.756	S	S	*	*				124.2	142.9	74.3	0	0	0	0	0	115.9
3237	I	28.1	Very low	29.3	Very low	165.5 Å²	165.5	125.7 Å²	125.7	85%	0.849	75%	0.751	S	S	*	*				72.2	110.7	84.9	-52.2	174	0	0	0	116.7
3238	S	31.5	Very low	28.9	Very low	102.5 Å²	102.5	130.5 Å²	130.5	72%	0.717	76%	0.757	S	S	*	*				-171.6	153.7	57.4	51.1	0	0	0	0	113.7
3239	S	30.5	Very low	28.9	Very low	118.5 Å²	118.5	127.7 Å²	127.7	83%	0.829	75%	0.75	S	S	*	*			trans	28	141.2	152	56.3	0	0	0	0	122.2
3240	G	29.4	Very low	28.9	Very low	61.5 Å²	61.5	129.1 Å²	129.1	63%	0.634	75%	0.749	S	S	*	*			cis	142.9	155.3	-8.2	0	0	0	0	0	115.4
3241	T	29.6	Very low	29.1	Very low	145.5 Å²	145.5	126.1 Å²	126.1	89%	0.893	74%	0.741	S	S	*	*			trans	65.8	148.7	161.7	51.6	0	0	0	0	118.9
3242	S	29.5	Very low	28.7	Very low	100.5 Å²	100.5	127.6 Å²	127.6	70%	0.703	74%	0.743	S	S	*	*			cis	-173.9	160.7	-7	44.5	0	0	0	0	111.3
3243	S	28.7	Very low	28.6	Very low	92 Å²	92	127 Å²	127	64%	0.643	75%	0.745	S	S	*	*				116.4	161.8	56.5	64	0	0	0	0	114.7
3244	N	29	Very low	28.3	Very low	149 Å²	149	124.7 Å²	124.7	80%	0.797	74%	0.74	S	S	*	*				145.7	153.4	87.4	-64.4	-32.2	0	0	0	112.6
3245	A	27.2	Very low	28.2	Very low	78 Å²	78	126.2 Å²	126.2	65%	0.645	75%	0.745	S	S	*	*			cis	142.1	146.8	9.9	0	0	0	0	0	114.2
3246	F	25.8	Very low	27.8	Very low	188.5 Å²	188.5	127 Å²	127	83%	0.827	75%	0.745	S	S	*	*			trans	63.3	129.8	168	-60.5	-73.7	0	0	0	119.3
3247	H	26.5	Very low	27.7	Very low	159 Å²	159	128.5 Å²	128.5	74%	0.736	75%	0.751	S	S	*	*			cis	137.3	143	42.9	-120.4	-96.4	0	0	0	114.5
3248	Y	26.8	Very low	27.7	Very low	209 Å²	209	128.3 Å²	128.3	82%	0.82	75%	0.752	S	S	*	*			trans	-119.1	167.9	132.4	-100.9	-138	0	0	0	113.8
3249	L	26.3	Very low	27.5	Very low	135 Å²	135	130.9 Å²	130.9	71%	0.707	76%	0.757	S	S	*	*				-136.8	-179.5	90.7	-97	164.1	0	0	0	109.5
3250	D	27.1	Very low	27.6	Very low	131.5 Å²	131.5	130 Å²	130	70%	0.703	75%	0.749	S	S	*	*				-175.2	156.9	62.3	-112.7	-37.6	0	0	0	109.1
3251	S	29.2	Very low	27.5	Very low	84.5 Å²	84.5	135 Å²	135	59%	0.591	76%	0.756	S	S	*	*			cis	137.2	123.5	27.8	-96.6	0	0	0	0	112.8
3252	N	25.7	Very low	27.4	Very low	145 Å²	145	134.2 Å²	134.2	78%	0.775	75%	0.746	S	S	*	*				57.5	128.3	103.2	-69.8	-46.9	0	0	0	119.9
3253	L	27	Very low	27.2	Very low	156 Å²	156	137.4 Å²	137.4	82%	0.817	75%	0.754	S	S	*	*				-168	143.9	74.6	-139	66.8	0	0	0	111.6
3254	S	23.8	Very low	27.1	Very low	97 Å²	97	139 Å²	139	68%	0.678	76%	0.759	S	S	*	*				76.3	131.3	85.3	-138.4	0	0	0	0	119.1
3255	T	28.2	Very low	27	Very low	128 Å²	128	139.6 Å²	139.6	79%	0.785	76%	0.761	S	S	*	*				-154	146.7	75.2	32.1	0	0	0	0	112.3
3256	N	23.7	Very low	27	Very low	157 Å²	157	141.1 Å²	141.1	84%	0.84	77%	0.765	S	S	*	*			trans	-33.3	148.9	157.8	-57.7	-39	0	0	0	118
3257	A	28.8	Very low	27.2	Very low	94 Å²	94	136.8 Å²	136.8	78%	0.777	76%	0.758	S	S	*	*				-177.3	147.2	125.9	0	0	0	0	0	113.9
3258	D	27.6	Very low	27.4	Very low	163 Å²	163	137.9 Å²	137.9	87%	0.872	76%	0.761	S	S	*	*			trans	-9.9	152.5	165	-59.3	-53.6	0	0	0	120.4
3259	N	26.4	Very low	27.9	Very low	156.5 Å²	156.5	131.4 Å²	131.4	84%	0.837	75%	0.746	S	S	*	*			trans	-155.9	172.9	165.4	-126.9	-17.9	0	0	0	109.9
3260	P	33.5	Very low	28.4	Very low	100.5 Å²	100.5	133.1 Å²	133.1	65%	0.653	74%	0.743	S	S	*	*				-119.1	157.7	-88.8	39.2	-27.8	0	0	0	116.5
3261	Q	26.4	Very low	28.7	Very low	165.5 Å²	165.5	132 Å²	132	77%	0.773	74%	0.737	S	S	*	*			trans	144	146.8	150.2	-82.5	-169.8	19	0	0	119.4
3262	N	27.3	Very low	29	Very low	129 Å²	129	136.6 Å²	136.6	69%	0.69	74%	0.741	S	S	*	*			trans	62.5	93.8	151.4	-57.9	-24.6	0	0	0	120.4	V3264	N3262-V3264 PolarHBondContact O-N 3.32Å
3263	I	27.4	Very low	29.7	Very low	168 Å²	168	137.5 Å²	137.5	86%	0.862	73%	0.733	S	S	*	*				-121.5	125.4	126.3	-77.5	166.5	0	0	0	109.2	L3265	I3263-L3265 PolarHBondContact O-N 2.86Å
3264	V	25.7	Very low	30.1	Very low	125 Å²	125	137.3 Å²	137.3	76%	0.758	72%	0.723	S	S	*	*			trans	-88	124.3	-179.7	176.3	0	0	0	0	110.8	N3262	N3262-V3264 PolarHBondContact O-N 3.32Å
3265	L	26.7	Very low	30.7	Very low	161.5 Å²	161.5	137.9 Å²	137.9	85%	0.846	72%	0.718	S	S	*	*			trans	-119.8	129.1	160.7	-108.9	116	0	0	0	111.7	I3263	I3263-L3265 PolarHBondContact O-N 2.86Å
3266	P	28.2	Very low	31	Very low	110 Å²	110	136.6 Å²	136.6	71%	0.714	71%	0.706	S	S	*	*			trans	-82.1	135.8	-174	30.2	-33.8	0	0	0	113.7	K3268	P3266-K3268 PolarHBondContact O-N 3.41Å
3267	S	28.1	Very low	31.6	Very low	97.5 Å²	97.5	137.9 Å²	137.9	68%	0.682	70%	0.698	S	S	*	*			trans	-127.1	113.7	178.9	131.3	0	0	0	0	114.5	S3269	S3267-S3269 PolarHBondContact O-N 2.97Å
3268	K	32.1	Very low	31.7	Very low	183 Å²	183	142.1 Å²	142.1	80%	0.796	70%	0.699	S	S	*	*			trans	108.7	57.6	149.4	-78.2	161.5	-176.1	176.1	0	116	K3190 P3266	K3190-K3268 PolarHBondContact NZ-O 3.24Å; P3266-K3268 PolarHBondContact O-N 3.41Å
3269	S	36.7	Very low	31.7	Very low	72 Å²	72	139.8 Å²	139.8	50%	0.503	69%	0.686	S	S	.	*			trans	-86.1	62	-178.8	76.1	0	0	0	0	115.2	S3267 L3271 R3272	S3267-S3269 PolarHBondContact O-N 2.97Å; S3269-L3271 PolarHBondContact O-N 2.86Å; S3269-R3272 WeakPolarHBondContact O-CB 3.27Å; S3269-R3272 PolarHBondContact O-N 3.45Å; S3269-R3272 VanDerWaalsContact O-N 3.08Å
3270	W	37.5	Very low	32	Very low	170.5 Å²	170.5	137.3 Å²	137.3	65%	0.646	68%	0.679	S	S	*	*	H	α-helix	trans	-60	-43.1	-179.6	166.2	63.9	0	0	0	112.8	R3272 R3273 Y3274	W3270-R3272 PolarHBondContact O-N 3.18Å; W3270-R3272 VanDerWaalsContact O-N 3.13Å; W3270-R3273 WeakPolarHBondContact O-CA 3.47Å; W3270-R3273 WeakPolarHBondContact O-CB 3.4Å; W3270-R3273 PolarHBondContact O-N 3.22Å; W3270-Y3274 PolarHBondContact O-N 3.06Å
3271	L	33.2	Very low	31.6	Very low	109.5 Å²	109.5	140.5 Å²	140.5	57%	0.573	69%	0.685	S	S	*	*	H	α-helix	trans	-57.9	-27.6	177.5	-119.3	145.8	0	0	0	113.2	S3269 L3275	S3269-L3271 PolarHBondContact O-N 2.86Å; L3271-L3275 HydrophobicContact CD2-CD1 4Å; L3271-L3275 WeakPolarHBondContact O-CD1 3.44Å; L3271-L3275 WeakPolarHBondContact O-CG 3.43Å; L3271-L3275 PolarHBondContact O-N 2.98Å; L3271-L3275 VanDerWaalsContact O-N 3.15Å
3272	R	35.6	Very low	31.5	Very low	181 Å²	181	142.4 Å²	142.4	68%	0.683	69%	0.685	S	S	*	*	H	α-helix	trans	-74.4	-31.7	173.4	-132.6	-171.2	179	-146.9	0.5	112.9	S3269 W3270 L3275 L3276	S3269-R3272 WeakPolarHBondContact O-CB 3.27Å; S3269-R3272 PolarHBondContact O-N 3.45Å; S3269-R3272 VanDerWaalsContact O-N 3.08Å; W3270-R3272 PolarHBondContact O-N 3.18Å; W3270-R3272 VanDerWaalsContact O-N 3.13Å; R3272-L3275 PolarHBondContact O-N 2.76Å; R3272-L3276 HydrophobicContact CG-CD1 3.85Å; R3272-L3276 HydrophobicContact CG-CG 4.25Å; R3272-L3276 VanDerWaalsContact O-CB 3.31Å; R3272-L3276 WeakPolarHBondContact O-CB 3.48Å; R3272-L3276 WeakPolarHBondContact O-CD1 3.45Å; R3272-L3276 WeakPolarHBondContact O-CG 3.39Å; R3272-L3276 PolarHBondContact O-N 3.24Å
3273	R	39.8	Very low	31.5	Very low	162 Å²	162	141 Å²	141	61%	0.611	69%	0.686	S	S	*	*	H	α-helix	trans	-73	-38.6	174.9	-79	-170.8	-76.9	-173.6	0.6	111.9	E2778 W3270 L3276 R3277	E2778-R3273 IonicContact OE1-NH2 3.51Å; W3270-R3273 WeakPolarHBondContact O-CA 3.47Å; W3270-R3273 WeakPolarHBondContact O-CB 3.4Å; W3270-R3273 PolarHBondContact O-N 3.22Å; R3273-L3276 PolarHBondContact O-N 3.23Å; R3273-R3277 PolarHBondContact O-N 2.94Å; R3273-R3277 VanDerWaalsContact O-N 3.07Å
3274	Y	34.8	Very low	31.4	Very low	152.5 Å²	152.5	140.4 Å²	140.4	60%	0.598	68%	0.676	S	S	*	*	H	α-helix	trans	-63.4	-42	177.1	-169.2	-100.5	0	0	0	112.6	W3270 L3276	W3270-Y3274 PolarHBondContact O-N 3.06Å; Y3274-L3276 VanDerWaalsContact C-N 3.34Å; Y3274-L3276 PolarHBondContact O-N 2.98Å
3275	L	37.1	Very low	31.5	Very low	109.5 Å²	109.5	141.9 Å²	141.9	57%	0.573	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	-20.5	-178.3	-69.5	172.5	0	0	0	114.5	L3271 R3272 R3277 K3278 L3279	L3271-L3275 HydrophobicContact CD2-CD1 4Å; L3271-L3275 WeakPolarHBondContact O-CD1 3.44Å; L3271-L3275 WeakPolarHBondContact O-CG 3.43Å; L3271-L3275 PolarHBondContact O-N 2.98Å; L3271-L3275 VanDerWaalsContact O-N 3.15Å; R3272-L3275 PolarHBondContact O-N 2.76Å; L3275-R3277 VanDerWaalsContact C-N 3.29Å; L3275-R3277 PolarHBondContact O-N 3.01Å; L3275-K3278 PolarHBondContact O-N 3.45Å; L3275-K3278 VanDerWaalsContact O-N 3.07Å; L3275-L3279 PolarHBondContact O-N 3.11Å
3276	L	35	Very low	31.4	Very low	101.5 Å²	101.5	140.6 Å²	140.6	53%	0.531	67%	0.67	S	S	.	*	H	α-helix	trans	-86.9	-16.2	178.9	-85.7	123.4	0	0	0	113.8	R3272 R3273 Y3274 K3278	R3272-L3276 HydrophobicContact CG-CD1 3.85Å; R3272-L3276 HydrophobicContact CG-CG 4.25Å; R3272-L3276 VanDerWaalsContact O-CB 3.31Å; R3272-L3276 WeakPolarHBondContact O-CB 3.48Å; R3272-L3276 WeakPolarHBondContact O-CD1 3.45Å; R3272-L3276 WeakPolarHBondContact O-CG 3.39Å; R3272-L3276 PolarHBondContact O-N 3.24Å; R3273-L3276 PolarHBondContact O-N 3.23Å; Y3274-L3276 VanDerWaalsContact C-N 3.34Å; Y3274-L3276 PolarHBondContact O-N 2.98Å; L3276-K3278 PolarHBondContact O-N 3.24Å
3277	R	36.6	Very low	31.4	Very low	183 Å²	183	140.6 Å²	140.6	69%	0.691	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	-0.3	-177.3	-134.1	-178.6	-121.9	-171.6	2.6	115.2	D2782 R3273 L3275	D2782-R3277 IonicContact OD1-CZ 3.23Å; D2782-R3277 IonicContact OD1-NH1 2.67Å; D2782-R3277 PolarHBondContact OD1-NH1 3.25Å; D2782-R3277 IonicContact OD1-NH2 2.74Å; D2782-R3277 PolarHBondContact OD1-NH2 2.86Å; R3273-R3277 PolarHBondContact O-N 2.94Å; R3273-R3277 VanDerWaalsContact O-N 3.07Å; L3275-R3277 VanDerWaalsContact C-N 3.29Å; L3275-R3277 PolarHBondContact O-N 3.01Å
3278	K	31	Very low	31.4	Very low	183 Å²	183	144.3 Å²	144.3	80%	0.796	68%	0.679	S	S	*	*			trans	-124.4	28.5	179.4	-79.9	-74.4	-175.3	174.1	0	113.3	L3275 L3276	L3275-K3278 PolarHBondContact O-N 3.45Å; L3275-K3278 VanDerWaalsContact O-N 3.07Å; L3276-K3278 PolarHBondContact O-N 3.24Å
3279	L	27	Very low	31.2	Very low	114.5 Å²	114.5	140.6 Å²	140.6	60%	0.599	68%	0.676	S	S	*	*			trans	-104.1	132.4	160.5	-82.6	124.7	0	0	0	109	L3275 H3281	L3275-L3279 PolarHBondContact O-N 3.11Å; L3279-H3281 PolarHBondContact O-N 3.1Å
3280	P	31.3	Very low	30.9	Very low	105 Å²	105	143.4 Å²	143.4	68%	0.682	69%	0.69	S	S	*	*			trans	-74.8	110.7	175.9	29.7	-32.5	0	0	0	110.3	R3282	P3280-R3282 VanDerWaalsContact C-N 3.29Å; P3280-R3282 PolarHBondContact O-N 3.04Å
3281	H	26.7	Very low	30.5	Very low	166.5 Å²	166.5	140.8 Å²	140.8	77%	0.771	70%	0.695	S	S	*	*			trans	-70.2	92.1	167.9	-88.2	-78.9	0	0	0	110.3	L3279 S3283	L3279-H3281 PolarHBondContact O-N 3.1Å; H3281-S3283 PolarHBondContact O-N 2.81Å; H3281-S3283 VanDerWaalsContact O-N 3.14Å
3282	R	24.3	Very low	30.2	Very low	205.5 Å²	205.5	140.5 Å²	140.5	78%	0.775	70%	0.702	S	S	*	*			trans	-70.3	99.4	165.9	178.1	-179.4	176.7	174.2	-0.6	108.8	P3280 K3284 E3286	P3280-R3282 VanDerWaalsContact C-N 3.29Å; P3280-R3282 PolarHBondContact O-N 3.04Å; R3282-K3284 PolarHBondContact O-N 2.98Å; R3282-E3286 IonicContact CZ-OE1 3.18Å; R3282-E3286 IonicContact NE-OE1 3.2Å; R3282-E3286 IonicContact NH2-OE1 2.69Å; R3282-E3286 PolarHBondContact NH2-OE1 3.49Å
3283	S	26.6	Very low	29.7	Very low	101 Å²	101	138.1 Å²	138.1	71%	0.706	71%	0.708	S	S	*	*			trans	-69.8	112	168.8	50.2	0	0	0	0	109.9	H3281 N3285	H3281-S3283 PolarHBondContact O-N 2.81Å; H3281-S3283 VanDerWaalsContact O-N 3.14Å; S3283-N3285 PolarHBondContact O-N 3.28Å
3284	K	25.6	Very low	29.1	Very low	154 Å²	154	135.2 Å²	135.2	67%	0.67	71%	0.712	S	S	*	*			trans	-75.1	106	164.9	-81.6	-170.7	165.4	-163	0	109.4	R3282 E3286	R3282-K3284 PolarHBondContact O-N 2.98Å; K3284-E3286 VanDerWaalsContact C-N 3.29Å; K3284-E3286 HydrophobicContact CB-CG 4.42Å; K3284-E3286 HydrophobicContact CD-CG 4.21Å; K3284-E3286 WeakPolarHBondContact CD-OE1 3.44Å; K3284-E3286 WeakPolarHBondContact CE-OE1 3.39Å; K3284-E3286 IonicContact NZ-OE1 3.75Å; K3284-E3286 PolarHBondContact NZ-OE1 3.13Å; K3284-E3286 PolarHBondContact O-N 3.48Å
3285	N	27.4	Very low	28.7	Very low	156.5 Å²	156.5	133.2 Å²	133.2	84%	0.837	72%	0.72	S	S	*	*			trans	-101.8	106.1	152.6	-75.4	10.9	0	0	0	107.2	S3283	S3283-N3285 PolarHBondContact O-N 3.28Å
3286	E	25.5	Very low	28.3	Very low	135.5 Å²	135.5	133.6 Å²	133.6	63%	0.633	73%	0.733	S	S	*	*			trans	-125.9	101.5	179.4	-74.4	174.3	178.7	0	0	109.3	R3282 K3284	R3282-E3286 IonicContact CZ-OE1 3.18Å; R3282-E3286 IonicContact NE-OE1 3.2Å; R3282-E3286 IonicContact NH2-OE1 2.69Å; R3282-E3286 PolarHBondContact NH2-OE1 3.49Å; K3284-E3286 VanDerWaalsContact C-N 3.29Å; K3284-E3286 HydrophobicContact CB-CG 4.42Å; K3284-E3286 HydrophobicContact CD-CG 4.21Å; K3284-E3286 WeakPolarHBondContact CD-OE1 3.44Å; K3284-E3286 WeakPolarHBondContact CE-OE1 3.39Å; K3284-E3286 IonicContact NZ-OE1 3.75Å; K3284-E3286 PolarHBondContact NZ-OE1 3.13Å; K3284-E3286 PolarHBondContact O-N 3.48Å
3287	S	28.2	Very low	27.8	Very low	110 Å²	110	136.2 Å²	136.2	77%	0.769	75%	0.746	S	S	*	*			trans	-143.3	78	162.8	59.7	0	0	0	0	109.5	S3289	S3287-S3289 PolarHBondContact O-N 3.06Å
3288	E	26.6	Very low	27.5	Very low	174.5 Å²	174.5	132.7 Å²	132.7	82%	0.815	75%	0.747	S	S	*	*			trans	-21.8	100.2	154.1	-111.8	171.9	-176.7	0	0	114.2	V3290 F3751	E3288-V3290 PolarHBondContact O-N 3.03Å; E3288-F3751 WeakPolarHBondContact OE1-CZ 3.49Å
3289	S	29.1	Very low	27.2	Very low	106 Å²	106	132.5 Å²	132.5	74%	0.741	75%	0.749	S	S	*	*				-122.1	112.4	95.1	54	0	0	0	0	111	S3287	S3287-S3289 PolarHBondContact O-N 3.06Å
3290	V	29.1	Very low	27.6	Very low	130 Å²	130	132.1 Å²	132.1	79%	0.788	75%	0.753	S	S	*	*				23.1	122.9	116.5	-178.8	0	0	0	0	114.5	E3288	E3288-V3290 PolarHBondContact O-N 3.03Å
3291	P	30.9	Very low	27.4	Very low	115 Å²	115	134.7 Å²	134.7	75%	0.747	76%	0.761	S	S	*	*				-120.4	131.7	76.5	37.2	-24.3	0	0	0	115
3292	S	26.3	Very low	27.3	Very low	103 Å²	103	133.2 Å²	133.2	72%	0.72	76%	0.758	S	S	*	*			trans	-3.5	152.2	150.6	61.7	0	0	0	0	119
3293	T	25.8	Very low	27.4	Very low	132.5 Å²	132.5	132.5 Å²	132.5	81%	0.813	76%	0.761	S	S	*	*			trans	0.2	106.6	168.5	40.6	0	0	0	0	118.2
3294	S	26.2	Very low	27.4	Very low	99.5 Å²	99.5	133.9 Å²	133.9	70%	0.696	76%	0.759	S	S	*	*			trans	136.6	117.4	139.7	57.8	0	0	0	0	115.7
3295	S	25.5	Very low	27.5	Very low	111 Å²	111	134.5 Å²	134.5	78%	0.776	76%	0.764	S	S	*	*				72.1	139.6	113.9	73.8	0	0	0	0	117.7
3296	S	29.1	Very low	27.4	Very low	118.5 Å²	118.5	134.2 Å²	134.2	83%	0.829	76%	0.758	S	S	*	*				141.4	162.2	92.2	64.6	0	0	0	0	118.1
3297	L	24.4	Very low	27.5	Very low	156.5 Å²	156.5	132.4 Å²	132.4	82%	0.819	76%	0.761	S	S	*	*			trans	-54.5	171.6	169.4	-99.8	72.5	0	0	0	114.1
3298	P	31.2	Very low	27.4	Very low	109.5 Å²	109.5	135.1 Å²	135.1	71%	0.711	76%	0.76	S	S	*	*			cis	-152.8	170.8	18.6	42.3	-22.8	0	0	0	118.8
3299	Q	25.3	Very low	27.4	Very low	178 Å²	178	135.2 Å²	135.2	83%	0.832	76%	0.761	S	S	*	*			trans	-14.8	-171.3	146.9	-68.1	-173.8	-21.1	0	0	115.5
3300	P	35.1	Very low	27.2	Very low	105.5 Å²	105.5	134.3 Å²	134.3	69%	0.685	76%	0.755	S	S	*	*				-124.8	177.8	-79.6	40.7	-25.6	0	0	0	113.6
3301	L	26.8	Very low	27	Very low	161 Å²	161	135 Å²	135	84%	0.843	75%	0.754	S	S	*	*			trans	175.7	158	131.7	-96.9	163.2	0	0	0	113.6
3302	N	24.9	Very low	26.8	Very low	134.5 Å²	134.5	136.1 Å²	136.1	72%	0.719	76%	0.759	S	S	*	*			trans	-57.7	150.2	176.2	-55.4	-34.1	0	0	0	114.5
3303	F	26.8	Very low	26.7	Very low	189.5 Å²	189.5	138 Å²	138	83%	0.831	76%	0.76	S	S	*	*				-155.7	135.8	102.5	-110.6	-86.9	0	0	0	114.6
3304	I	25	Very low	26.7	Very low	130.5 Å²	130.5	138.7 Å²	138.7	67%	0.669	75%	0.754	S	S	*	*			trans	-6	140.8	160	-59.7	167.2	0	0	0	119.1	Q3306	I3304-Q3306 HydrophobicContact CG2-CB 4.2Å
3305	H	29	Very low	26.6	Very low	167.5 Å²	167.5	140.5 Å²	140.5	78%	0.775	76%	0.756	S	S	*	*			trans	160.1	127.4	142.7	-129.4	-105.2	0	0	0	117.1
3306	Q	24.9	Very low	26.6	Very low	149.5 Å²	149.5	142.5 Å²	142.5	70%	0.699	76%	0.756	S	S	*	*			trans	135.5	121.8	162.8	-121	-176.2	4.5	0	0	118.8	I3304	I3304-Q3306 HydrophobicContact CG2-CB 4.2Å
3307	S	27.2	Very low	26.3	Very low	99 Å²	99	141.9 Å²	141.9	69%	0.692	75%	0.752	S	S	*	*			trans	135.8	109.4	146.3	60	0	0	0	0	116.9
3308	H	26.4	Very low	26.4	Very low	166 Å²	166	139.2 Å²	139.2	77%	0.769	75%	0.746	S	S	*	*				79.6	139.6	100.1	-86.9	-85.5	0	0	0	119.8
3309	Q	26.5	Very low	26.1	Very low	176 Å²	176	140.8 Å²	140.8	82%	0.822	75%	0.749	S	S	*	*			trans	68.2	137	168.5	-68	176.5	-64.8	0	0	116.7
3310	S	25.5	Very low	26.1	Very low	88.5 Å²	88.5	139.4 Å²	139.4	62%	0.619	75%	0.746	S	S	*	*			cis	131.3	143.1	13.6	69.5	0	0	0	0	110.8
3311	D	25.2	Very low	25.6	Very low	145 Å²	145	139.6 Å²	139.6	78%	0.775	75%	0.75	S	S	*	*				-65.1	146.8	86.5	-56.7	-61.7	0	0	0	115.1
3312	V	26.2	Very low	25.6	Very low	137.5 Å²	137.5	139.8 Å²	139.8	83%	0.833	75%	0.749	S	S	*	*				131.6	124.7	90	160.2	0	0	0	0	112.6
3313	L	24.7	Very low	25.8	Very low	143.5 Å²	143.5	137.6 Å²	137.6	75%	0.751	74%	0.742	S	S	*	*			trans	-143.9	160.3	165.7	-128.7	81.5	0	0	0	109.5
3314	E	24	Very low	25.8	Very low	146 Å²	146	133.8 Å²	133.8	68%	0.682	73%	0.729	S	S	*	*				123.3	133.8	61.2	-114.3	175	-148.1	0	0	114.3
3315	N	25.3	Very low	25.9	Very low	138 Å²	138	131.9 Å²	131.9	74%	0.738	72%	0.723	S	S	*	*				172.2	127.7	119.5	-98.7	-51	0	0	0	114.5
3316	I	25.4	Very low	25.7	Very low	152.5 Å²	152.5	128.5 Å²	128.5	78%	0.782	71%	0.714	S	S	*	*			trans	118.5	121.1	130.5	-75.3	160.7	0	0	0	114
3317	S	23.5	Very low	25.7	Very low	105 Å²	105	125.7 Å²	125.7	73%	0.734	71%	0.711	S	S	*	*			trans	156.2	109.3	166.9	-75.5	0	0	0	0	117.5
3318	S	24.7	Very low	25.6	Very low	100 Å²	100	125.3 Å²	125.3	70%	0.699	70%	0.704	S	S	*	*			trans	104.1	115.7	144.5	42.7	0	0	0	0	116.1
3319	D	25.7	Very low	25.5	Very low	143.5 Å²	143.5	122.4 Å²	122.4	77%	0.767	70%	0.698	S	S	*	*				-176.8	138.8	99.7	-96.9	-17.1	0	0	0	112.4
3320	L	24.6	Very low	25.4	Very low	148.5 Å²	148.5	116.8 Å²	116.8	78%	0.777	68%	0.682	S	S	*	*				64.5	86.4	99.5	-68.2	172.1	0	0	0	119.2
3321	S	24.9	Very low	25.4	Very low	110 Å²	110	117.3 Å²	117.3	77%	0.769	68%	0.681	S	S	*	*				150.1	130.1	121.2	58.3	0	0	0	0	118.3
3322	M	27.6	Very low	25.3	Very low	165 Å²	165	116.3 Å²	116.3	81%	0.813	68%	0.681	S	S	*	*			trans	5.8	166.3	158.3	-77.7	-73.6	100.5	0	0	114.9
3323	P	29.5	Very low	25.3	Very low	89.5 Å²	89.5	114.6 Å²	114.6	58%	0.581	67%	0.67	S	S	*	*				-128.8	-168.9	115.4	30.6	-7.7	0	0	0	115.4	I3500 S3502	P3323-I3500 WeakPolarHBondContact O-CG2 3.37Å; P3323-S3502 WeakPolarHBondContact CD-OG 3.49Å; P3323-S3502 WeakPolarHBondContact CG-OG 3.33Å
3324	I	26	Very low	25.2	Very low	108.5 Å²	108.5	112.9 Å²	112.9	56%	0.556	67%	0.666	S	S	*	*	P	Polyproline II helix		-125.4	173.3	-111.6	-75	167.2	0	0	0	109.6	I3500 H3501 S3502	I3324-I3500 CarbonylContact O-C 3.58Å; I3324-I3500 WeakPolarHBondContact O-CG2 3.36Å; I3324-H3501 CarbonylContact O-C 3.55Å; I3324-H3501 PolarHBondContact O-N 2.77Å; I3324-S3502 PolarHBondContact O-N 2.78Å
3325	V	26.1	Very low	25.3	Very low	91 Å²	91	115.2 Å²	115.2	55%	0.552	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	11.9	138.9	175.3	176.9	0	0	0	0	115	H3501	V3325-H3501 VanDerWaalsContact CB-O 3.23Å; V3325-H3501 WeakPolarHBondContact CB-O 3.31Å; V3325-H3501 VanDerWaalsContact CG1-O 3.3Å; V3325-H3501 WeakPolarHBondContact CG1-O 3.27Å; V3325-H3501 WeakPolarHBondContact CG2-O 3.17Å
3326	V	25.4	Very low	25.2	Very low	97 Å²	97	114.8 Å²	114.8	59%	0.588	68%	0.677	S	S	*	*				-118.8	133.4	-103.4	152.5	0	0	0	0	110.6	E3498	V3326-E3498 PolarHBondContact N-OE2 2.76Å; V3326-E3498 WeakPolarHBondContact O-CB 3.42Å; V3326-E3498 VanDerWaalsContact O-OE2 3.11Å
3327	S	24.6	Very low	25.2	Very low	89 Å²	89	112.5 Å²	112.5	62%	0.622	67%	0.674	S	S	*	*				151.4	132.1	116.8	-164.5	0	0	0	0	113.1	N2902	N2902-S3327 PolarHBondContact ND2-OG 2.74Å
3328	T	26.2	Very low	25.3	Very low	91.5 Å²	91.5	112.9 Å²	112.9	56%	0.561	68%	0.677	S	S	*	*			trans	-128.7	140.1	-173.6	-27.9	0	0	0	0	113	I3493 T3495	T3328-I3493 HydrophobicContact CG2-CG2 4.25Å; T3328-T3495 WeakPolarHBondContact CB-OG1 3.34Å; T3328-T3495 PolarHBondContact OG1-OG1 3.48Å
3329	V	25	Very low	25.4	Very low	104 Å²	104	116.3 Å²	116.3	63%	0.63	69%	0.686	S	S	*	*			trans	-147.3	129.8	-175.8	175.7	0	0	0	0	110.9	N3491	V3329-N3491 VanDerWaalsContact CA-O 3.23Å; V3329-N3491 WeakPolarHBondContact CA-O 3.46Å; V3329-N3491 HydrophobicContact CB-CB 4.32Å; V3329-N3491 HydrophobicContact CG1-CB 3.2Å; V3329-N3491 WeakPolarHBondContact CG1-O 3.43Å
3330	A	23.8	Very low	25.4	Very low	58.5 Å²	58.5	114.4 Å²	114.4	48%	0.483	69%	0.685	S	S	.	*			trans	-137.7	131.1	176.6	0	0	0	0	0	113.9	N3491 N3492 I3493	A3330-N3491 WeakPolarHBondContact CA-OD1 3.41Å; A3330-N3491 PolarHBondContact N-O 2.84Å; A3330-N3492 VanDerWaalsContact N-N 3.19Å; A3330-N3492 CarbonylContact O-C 3.58Å; A3330-N3492 VanDerWaalsContact O-CA 3.24Å; A3330-N3492 WeakPolarHBondContact O-CA 3.24Å; A3330-N3492 PolarHBondContact O-N 3.43Å; A3330-I3493 HydrophobicContact CB-CB 3.68Å; A3330-I3493 HydrophobicContact CB-CD1 3.77Å; A3330-I3493 HydrophobicContact CB-CG1 3.61Å; A3330-I3493 PolarHBondContact O-N 2.98Å
3331	T	25	Very low	25.6	Very low	99 Å²	99	113.2 Å²	113.2	61%	0.607	69%	0.686	S	S	*	*			trans	-172.1	102.8	-178.1	28.8	0	0	0	0	110.5	V3490 N3491 N3492	T3331-V3490 CarbonylContact O-C 3.56Å; T3331-V3490 PolarHBondContact O-N 2.88Å; T3331-V3490 PolarHBondContact OG1-O 2.99Å; T3331-N3491 VanDerWaalsContact CA-N 3.32Å; T3331-N3491 VanDerWaalsContact CA-OD1 3.24Å; T3331-N3491 WeakPolarHBondContact CA-OD1 3.42Å; T3331-N3491 PolarHBondContact N-OD1 2.79Å; T3331-N3491 PolarHBondContact O-N 2.84Å; T3331-N3491 PolarHBondContact O-OD1 2.91Å; T3331-N3492 PolarHBondContact OG1-N 2.75Å
3332	T	23.7	Very low	25.6	Very low	124.5 Å²	124.5	113.6 Å²	113.6	76%	0.764	69%	0.688	S	S	*	*			trans	-72.6	129.1	-178.5	4.1	0	0	0	0	113.3
3333	V	25.1	Very low	25.4	Very low	102 Å²	102	111.2 Å²	111.2	62%	0.618	69%	0.688	S	S	*	*			trans	-143.2	129.5	148.9	179	0	0	0	0	108.7	F3335 P3489	V3333-F3335 HydrophobicContact CG1-CD2 4.1Å; V3333-F3335 HydrophobicContact CG1-CE2 4.27Å; V3333-P3489 HydrophobicContact CB-CB 3.66Å; V3333-P3489 HydrophobicContact CB-CG 3.83Å; V3333-P3489 HydrophobicContact CG1-CG 4.48Å; V3333-P3489 HydrophobicContact CG2-CB 4.32Å; V3333-P3489 WeakPolarHBondContact O-CG 3.43Å
3334	T	22.7	Very low	25.2	Very low	108 Å²	108	113.4 Å²	113.4	66%	0.663	70%	0.699	S	S	*	*			trans	-96	146.2	166.3	46.4	0	0	0	0	108.9
3335	F	25.7	Very low	25.1	Very low	194.5 Å²	194.5	114 Å²	114	85%	0.853	71%	0.712	S	S	*	*				-162.3	156.4	106.1	-91.1	-71.6	0	0	0	110.7	V3333	V3333-F3335 HydrophobicContact CG1-CD2 4.1Å; V3333-F3335 HydrophobicContact CG1-CE2 4.27Å
3336	T	25	Very low	25	Very low	129.5 Å²	129.5	116.8 Å²	116.8	79%	0.794	72%	0.722	S	S	*	*			trans	-137.1	142.2	163.7	38	0	0	0	0	110.2
3337	S	25.3	Very low	25	Very low	104 Å²	104	117.7 Å²	117.7	73%	0.727	73%	0.73	S	S	*	*				108.4	129.6	71.4	55	0	0	0	0	115.6
3338	S	24.9	Very low	25.1	Very low	113 Å²	113	118.3 Å²	118.3	79%	0.79	73%	0.734	S	S	*	*				166.3	121.1	125.8	59.9	0	0	0	0	114.1
3339	L	27.1	Very low	25.1	Very low	171 Å²	171	120.4 Å²	120.4	90%	0.895	74%	0.742	S	S	*	*			trans	127.3	127.6	150.4	-92.9	128	0	0	0	116
3340	S	24.6	Very low	25.2	Very low	105 Å²	105	122.8 Å²	122.8	73%	0.734	75%	0.751	S	S	*	*			trans	167.7	147.6	166.7	70.3	0	0	0	0	114.1
3341	P	28.8	Very low	25.3	Very low	123.5 Å²	123.5	126.9 Å²	126.9	80%	0.802	76%	0.764	S	S	*	*			trans	-115	149.7	-155.3	35.8	-22.7	0	0	0	114.1
3342	S	24.9	Very low	25.5	Very low	117 Å²	117	127.5 Å²	127.5	82%	0.818	77%	0.768	S	S	*	*			trans	-7.5	121.7	165	-58.4	0	0	0	0	116
3343	S	24.7	Very low	25.7	Very low	115 Å²	115	128.5 Å²	128.5	80%	0.804	77%	0.767	S	S	*	*			trans	-124.8	171.9	159.7	53.4	0	0	0	0	112.6
3344	V	24.1	Very low	25.8	Very low	136 Å²	136	132.3 Å²	132.3	82%	0.824	78%	0.778	S	S	*	*			trans	-174.7	125.3	179.4	178.3	0	0	0	0	111.2
3345	C	24.6	Very low	26.1	Very low	120 Å²	120	130.6 Å²	130.6	81%	0.811	78%	0.775	S	S	*	*				-143.2	160.1	84.8	-109.9	0	0	0	0	112.4
3346	I	23.5	Very low	26.2	Very low	150.5 Å²	150.5	124.4 Å²	124.4	77%	0.772	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-100.9	148.7	-170.4	-53.6	163.7	0	0	0	109.6	S3348	I3346-S3348 PolarHBondContact O-N 2.78Å
3347	P	26	Very low	26.5	Very low	116 Å²	116	123.4 Å²	123.4	75%	0.753	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-106.3	127.3	141.1	31.1	-26.1	0	0	0	113.7
3348	S	25.8	Very low	26.7	Very low	101.5 Å²	101.5	121.7 Å²	121.7	71%	0.71	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-18.5	138.6	161.2	53	0	0	0	0	116.7	I3346	I3346-S3348 PolarHBondContact O-N 2.78Å
3349	N	27.3	Very low	26.9	Very low	136 Å²	136	119.2 Å²	119.2	73%	0.727	73%	0.728	S	S	*	*	P	Polyproline II helix		-118.9	142.7	120.1	-76.2	-59	0	0	0	113.5	L3351	N3349-L3351 PolarHBondContact O-N 3.29Å
3350	N	26.9	Very low	26.9	Very low	154 Å²	154	120.1 Å²	120.1	82%	0.824	72%	0.72	S	S	*	*			trans	-17.7	101.2	159.2	-70.4	-14.2	0	0	0	115.7
3351	L	25.8	Very low	27	Very low	145 Å²	145	122 Å²	122	76%	0.759	72%	0.722	S	S	*	*			trans	-92.4	127.6	152.4	-121.1	82	0	0	0	109.2	N3349 A3356	N3349-L3351 PolarHBondContact O-N 3.29Å; L3351-A3356 HydrophobicContact CD2-CB 3.69Å; L3351-A3356 HydrophobicContact CG-CB 4.14Å
3352	T	29.5	Very low	26.9	Very low	112.5 Å²	112.5	126.1 Å²	126.1	69%	0.69	72%	0.723	S	S	*	*			trans	-100.7	147.4	168.3	0.6	0	0	0	0	109.7	E3354 A3355 A3356	T3352-E3354 PolarHBondContact O-N 2.79Å; T3352-A3355 WeakPolarHBondContact O-CA 3.47Å; T3352-A3355 WeakPolarHBondContact O-CB 3.49Å; T3352-A3355 PolarHBondContact O-N 2.78Å; T3352-A3355 WeakPolarHBondContact OG1-CB 3.29Å; T3352-A3356 PolarHBondContact O-N 2.76Å
3353	I	27.3	Very low	26.9	Very low	144 Å²	144	126.3 Å²	126.3	74%	0.738	72%	0.723	S	S	*	*	H	α-helix	trans	-77.9	-127.3	-172.8	-58.3	167.5	0	0	0	110.5	A3355 A3356 I3357	I3353-A3355 VanDerWaalsContact C-N 3.34Å; I3353-A3355 PolarHBondContact O-N 2.79Å; I3353-A3356 PolarHBondContact O-N 2.77Å; I3353-I3357 HydrophobicContact CG2-CD1 3.6Å; I3353-I3357 HydrophobicContact CG2-CG1 4.3Å; I3353-I3357 WeakPolarHBondContact O-CB 3.06Å; I3353-I3357 VanDerWaalsContact O-CG1 3.31Å; I3353-I3357 WeakPolarHBondContact O-CG1 3.45Å; I3353-I3357 PolarHBondContact O-N 2.81Å
3354	E	28	Very low	27	Very low	181.5 Å²	181.5	125.9 Å²	125.9	85%	0.848	72%	0.72	S	S	*	*	H	α-helix	trans	-126.2	-109.2	152.2	-74	-145.7	139.6	0	0	112	T3352 S3358	T3352-E3354 PolarHBondContact O-N 2.79Å; E3354-S3358 WeakPolarHBondContact O-CB 3.28Å; E3354-S3358 PolarHBondContact O-N 2.96Å; E3354-S3358 VanDerWaalsContact O-N 3.09Å
3355	A	28	Very low	27.2	Very low	73.5 Å²	73.5	125.4 Å²	125.4	61%	0.607	72%	0.717	S	S	*	*	H	α-helix	trans	-91.7	-113.4	-171.6	0	0	0	0	0	113.8	T3352 I3353	T3352-A3355 WeakPolarHBondContact O-CA 3.47Å; T3352-A3355 WeakPolarHBondContact O-CB 3.49Å; T3352-A3355 PolarHBondContact O-N 2.78Å; T3352-A3355 WeakPolarHBondContact OG1-CB 3.29Å; I3353-A3355 VanDerWaalsContact C-N 3.34Å; I3353-A3355 PolarHBondContact O-N 2.79Å
3356	A	28.1	Very low	27.3	Very low	63.5 Å²	63.5	126.2 Å²	126.2	53%	0.525	71%	0.713	S	S	.	*	H	α-helix	trans	-3.5	40.4	159	0	0	0	0	0	116.8	L3351 T3352 I3353	L3351-A3356 HydrophobicContact CD2-CB 3.69Å; L3351-A3356 HydrophobicContact CG-CB 4.14Å; T3352-A3356 PolarHBondContact O-N 2.76Å; I3353-A3356 PolarHBondContact O-N 2.77Å
3357	I	31.1	Very low	27.5	Very low	108.5 Å²	108.5	126.1 Å²	126.1	56%	0.556	71%	0.714	S	S	*	*	H	α-helix	trans	4.1	38.3	164.2	-63.4	166	0	0	0	115.7	Y2720 I3353 G3359	Y2720-I3357 HydrophobicContact CE1-CD1 3.86Å; Y2720-I3357 HydrophobicContact CE1-CG1 4.01Å; Y2720-I3357 HydrophobicContact CE1-CG2 4.17Å; I3353-I3357 HydrophobicContact CG2-CD1 3.6Å; I3353-I3357 HydrophobicContact CG2-CG1 4.3Å; I3353-I3357 WeakPolarHBondContact O-CB 3.06Å; I3353-I3357 VanDerWaalsContact O-CG1 3.31Å; I3353-I3357 WeakPolarHBondContact O-CG1 3.45Å; I3353-I3357 PolarHBondContact O-N 2.81Å; I3357-G3359 PolarHBondContact O-N 3.29Å
3358	S	29.4	Very low	27.6	Very low	69.5 Å²	69.5	127.5 Å²	127.5	49%	0.486	72%	0.716	S	S	.	*	S	Bend	trans	-16.8	69.5	165.9	-168.8	0	0	0	0	118.4	E3354 R3360	E3354-S3358 WeakPolarHBondContact O-CB 3.28Å; E3354-S3358 PolarHBondContact O-N 2.96Å; E3354-S3358 VanDerWaalsContact O-N 3.09Å; S3358-R3360 WeakPolarHBondContact O-CG 3.23Å; S3358-R3360 PolarHBondContact O-N 3.19Å; S3358-R3360 WeakPolarHBondContact OG-CD 3.4Å; S3358-R3360 PolarHBondContact OG-NH1 3.27Å
3359	G	28.5	Very low	27.6	Very low	59 Å²	59	133.4 Å²	133.4	61%	0.608	72%	0.722	S	S	*	*				83.1	71.5	98	0	0	0	0	0	114.4	I3357 N3361	I3357-G3359 PolarHBondContact O-N 3.29Å; G3359-N3361 PolarHBondContact O-N 2.81Å
3360	R	29	Very low	27.6	Very low	191 Å²	191	133.7 Å²	133.7	72%	0.721	72%	0.724	S	S	*	*			trans	-130.9	128.1	-172.6	-94.8	178.5	-178.3	161.4	-2.7	110.9	S3358 Y3362	S3358-R3360 WeakPolarHBondContact O-CG 3.23Å; S3358-R3360 PolarHBondContact O-N 3.19Å; S3358-R3360 WeakPolarHBondContact OG-CD 3.4Å; S3358-R3360 PolarHBondContact OG-NH1 3.27Å; R3360-Y3362 VanDerWaalsContact C-N 3.3Å; R3360-Y3362 HydrophobicContact CB-CD2 4.13Å; R3360-Y3362 PolarHBondContact O-N 2.86Å
3361	N	26.2	Very low	27.6	Very low	145.5 Å²	145.5	130.6 Å²	130.6	78%	0.778	72%	0.72	S	S	*	*				-112.3	136.5	-101.9	-104.9	2.5	0	0	0	112.5	G3359	G3359-N3361 PolarHBondContact O-N 2.81Å
3362	Y	26.1	Very low	27.8	Very low	209 Å²	209	132.2 Å²	132.2	82%	0.82	73%	0.728	S	S	*	*			trans	165	79	173.2	-71.2	-65.1	0	0	0	113.8	R3360	R3360-Y3362 VanDerWaalsContact C-N 3.3Å; R3360-Y3362 HydrophobicContact CB-CD2 4.13Å; R3360-Y3362 PolarHBondContact O-N 2.86Å
3363	C	25.9	Very low	27.6	Very low	120 Å²	120	133 Å²	133	81%	0.811	73%	0.728	S	S	*	*				-144.6	117.7	84.2	-88.6	0	0	0	0	109.7	V3365	C3363-V3365 PolarHBondContact O-N 2.8Å
3364	S	25.7	Very low	27.6	Very low	108 Å²	108	132.1 Å²	132.1	76%	0.755	73%	0.725	S	S	*	*				-132.5	128.8	-108.4	-177.1	0	0	0	0	108.8
3365	V	28	Very low	27.6	Very low	124.5 Å²	124.5	130.7 Å²	130.7	76%	0.755	72%	0.723	S	S	*	*			trans	-175.2	92.8	156.1	175.8	0	0	0	0	111.5	C3363	C3363-V3365 PolarHBondContact O-N 2.8Å
3366	N	27.5	Very low	27.6	Very low	137.5 Å²	137.5	131.1 Å²	131.1	74%	0.735	73%	0.726	S	S	*	*			trans	124.3	118.3	143	-81.4	22	0	0	0	115.2
3367	D	28.1	Very low	27.5	Very low	149 Å²	149	135.2 Å²	135.2	80%	0.797	75%	0.745	S	S	*	*				142.3	152.5	83.5	-63.2	-48.1	0	0	0	111.3
3368	D	28.4	Very low	27.5	Very low	145.5 Å²	145.5	133.7 Å²	133.7	78%	0.778	76%	0.757	S	S	*	*				126.6	121.9	89.8	-102.6	-9	0	0	0	113.8
3369	W	25.5	Very low	27.4	Very low	225 Å²	225	136.4 Å²	136.4	85%	0.852	78%	0.775	S	S	*	*				-148.1	106.3	74.4	-142	63.3	0	0	0	113.6
3370	N	26.8	Very low	27.4	Very low	142.5 Å²	142.5	137 Å²	137	76%	0.762	78%	0.781	S	S	*	*			trans	133.9	97.4	158.3	-105	-23.2	0	0	0	121.9
3371	A	26.7	Very low	27.5	Very low	88.5 Å²	88.5	134 Å²	134	73%	0.731	78%	0.784	S	S	*	*			trans	-59.6	145.4	151.8	0	0	0	0	0	119.6
3372	L	29.9	Very low	27.5	Very low	177.5 Å²	177.5	135.1 Å²	135.1	93%	0.929	79%	0.785	S	S	*	*			trans	129.8	126.8	157.1	-92.2	166.2	0	0	0	115.3
3373	N	25.1	Very low	27.6	Very low	131 Å²	131	131.4 Å²	131.4	70%	0.701	78%	0.778	S	S	*	*			trans	-95.4	162	174.9	-170.7	19	0	0	0	113.2
3374	N	27	Very low	27.6	Very low	124.5 Å²	124.5	130.8 Å²	130.8	67%	0.666	77%	0.771	S	S	*	*			trans	85.9	136.5	167.7	-55.9	-44.9	0	0	0	120.2
3375	N	28.7	Very low	27.6	Very low	151.5 Å²	151.5	132 Å²	132	81%	0.81	77%	0.773	S	S	*	*			trans	81.7	84.1	148.9	-63	-6.9	0	0	0	121.9
3376	A	26.7	Very low	27.5	Very low	81.5 Å²	81.5	130.1 Å²	130.1	67%	0.674	77%	0.771	S	S	*	*				72.2	130.9	107	0	0	0	0	0	123.1
3377	T	27.8	Very low	27.5	Very low	149.5 Å²	149.5	128.7 Å²	128.7	92%	0.917	77%	0.772	S	S	*	*			trans	66.5	131.1	146.7	54	0	0	0	0	120.9
3378	G	29.3	Very low	27.4	Very low	78 Å²	78	127.2 Å²	127.2	80%	0.804	77%	0.773	S	S	*	*			trans	159.1	75.1	166.5	0	0	0	0	0	116.1
3379	S	27.9	Very low	27.7	Very low	126 Å²	126	126 Å²	126	88%	0.881	77%	0.773	S	S	*	*			trans	-43	143.2	173.1	50.9	0	0	0	0	116.3
3380	G	28.7	Very low	27.7	Very low	71 Å²	71	120.3 Å²	120.3	73%	0.732	77%	0.768	S	S	*	*				141.6	104.5	128.4	0	0	0	0	0	116.2
3381	T	31.5	Very low	27.6	Very low	127.5 Å²	127.5	120.9 Å²	120.9	78%	0.782	77%	0.77	S	S	*	*				122.1	127.5	70.4	37.5	0	0	0	0	115.2
3382	E	26.5	Very low	27.5	Very low	169.5 Å²	169.5	122.6 Å²	122.6	79%	0.792	77%	0.771	S	S	*	*				93.8	140	108.3	-114.4	-177.7	-157.5	0	0	120
3383	I	28.3	Very low	27.3	Very low	131.5 Å²	131.5	119 Å²	119	67%	0.674	76%	0.761	S	S	*	*			trans	86.3	81.4	143.3	-58.4	178	0	0	0	120.8
3384	T	25.8	Very low	27.3	Very low	107.5 Å²	107.5	118 Å²	118	66%	0.66	76%	0.764	S	S	*	*				49.1	149.3	116.7	33.7	0	0	0	0	126.5	M3474	T3384-M3474 HydrophobicContact CG2-CE 3.44Å; T3384-M3474 VanDerWaalsContact CG2-CE 3.44Å
3385	V	25.6	Very low	27.2	Very low	133 Å²	133	117.3 Å²	117.3	81%	0.806	77%	0.769	S	S	*	*			trans	103	93.2	136.8	155.5	0	0	0	0	121.6
3386	A	25.2	Very low	27.2	Very low	85 Å²	85	116.3 Å²	116.3	70%	0.702	77%	0.768	S	S	*	*				81	158.5	120.8	0	0	0	0	0	125.1
3387	S	28.1	Very low	27.1	Very low	107.5 Å²	107.5	118.3 Å²	118.3	75%	0.752	77%	0.772	S	S	*	*			trans	80.5	104.3	160.4	35.7	0	0	0	0	119.3
3388	S	25.1	Very low	27.2	Very low	117 Å²	117	117.7 Å²	117.7	82%	0.818	77%	0.769	S	S	*	*				71.7	141.4	81.1	-55.4	0	0	0	0	118.3
3389	P	34.8	Very low	27.2	Very low	120 Å²	120	119.2 Å²	119.2	78%	0.779	77%	0.767	S	S	*	*				-127.5	170.8	-92.3	41.4	-27.9	0	0	0	115.7
3390	S	25.4	Very low	27.2	Very low	107 Å²	107	122.5 Å²	122.5	75%	0.748	77%	0.765	S	S	*	*			trans	137.1	139.4	151.5	66.7	0	0	0	0	116.7
3391	L	25	Very low	27	Very low	153.5 Å²	153.5	126.4 Å²	126.4	80%	0.804	77%	0.768	S	S	*	*				126.1	156.7	66.4	-99.4	166.7	0	0	0	117.3
3392	T	25.8	Very low	26.7	Very low	125.5 Å²	125.5	126.5 Å²	126.5	77%	0.77	76%	0.764	S	S	*	*			trans	76.6	136.1	157.4	52.4	0	0	0	0	121.3
3393	S	25.8	Very low	26.7	Very low	102 Å²	102	126 Å²	126	71%	0.713	76%	0.761	S	S	*	*				130	128.5	60.8	54	0	0	0	0	118.2
3394	S	24.3	Very low	26.6	Very low	109 Å²	109	127.9 Å²	127.9	76%	0.762	77%	0.769	S	S	*	*			trans	32.8	141.9	142.3	66.4	0	0	0	0	121.9
3395	S	25	Very low	26.7	Very low	110 Å²	110	131.1 Å²	131.1	77%	0.769	78%	0.779	S	S	*	*			trans	141.5	97.3	144.6	73.5	0	0	0	0	118.8
3396	V	27.9	Very low	26.9	Very low	131 Å²	131	130.7 Å²	130.7	79%	0.794	77%	0.772	S	S	*	*			trans	143.7	86.5	158.4	-175.1	0	0	0	0	115.8
3397	T	25.9	Very low	26.8	Very low	123.5 Å²	123.5	135.7 Å²	135.7	76%	0.758	78%	0.783	S	S	*	*			trans	117.9	67.3	154.8	23.8	0	0	0	0	119.3
3398	T	29.1	Very low	26.8	Very low	137.5 Å²	137.5	139.7 Å²	139.7	84%	0.844	78%	0.782	S	S	*	*			trans	-127.3	-107.7	159.6	28.9	0	0	0	0	113.7	K3400	T3398-K3400 PolarHBondContact O-N 2.97Å
3399	S	30.1	Very low	27	Very low	109.5 Å²	109.5	139.5 Å²	139.5	77%	0.766	78%	0.78	S	S	*	*			trans	-65.6	64.6	-166.2	-112.3	0	0	0	0	117
3400	K	26.7	Very low	26.7	Very low	194 Å²	194	142.6 Å²	142.6	84%	0.843	78%	0.782	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	64.2	172.8	-70.7	-179.1	174.7	179.5	0	113.5	T3398	T3398-K3400 PolarHBondContact O-N 2.97Å
3401	L	25.7	Very low	26.9	Very low	153 Å²	153	143.4 Å²	143.4	80%	0.801	78%	0.777	S	S	*	*			trans	-153.4	119.1	157.1	-141	139.1	0	0	0	112.1
3402	L	25.4	Very low	27.1	Very low	131 Å²	131	139.5 Å²	139.5	69%	0.686	76%	0.761	S	S	*	*			trans	59.8	142.6	163.8	-91.9	50.4	0	0	0	123.3
3403	Q	25.6	Very low	27.3	Very low	158 Å²	158	141.2 Å²	141.2	74%	0.738	76%	0.764	S	S	*	*			trans	61.2	85.3	140.9	-69.5	161.3	-23.1	0	0	120.7
3404	M	27.1	Very low	27.4	Very low	171 Å²	171	141.6 Å²	141.6	84%	0.842	76%	0.762	S	S	*	*				-174	124.9	108.6	-93.7	174.2	-68.7	0	0	107.5
3405	M	27.8	Very low	27.5	Very low	175 Å²	175	142.9 Å²	142.9	86%	0.862	76%	0.76	S	S	*	*				57	123.3	82.5	-64	-171.1	-173.6	0	0	112.9
3406	N	29	Very low	27.6	Very low	124 Å²	124	147.7 Å²	147.7	66%	0.663	76%	0.763	S	S	*	*			cis	-155	120	0.6	-157.8	-8.4	0	0	0	111.9
3407	M	24.2	Very low	27.5	Very low	190 Å²	190	148.5 Å²	148.5	94%	0.936	76%	0.762	S	S	*	*			trans	-90.2	100.1	169.4	-83.8	-93.5	-77.7	0	0	108.6
3408	R	28.1	Very low	27.5	Very low	193 Å²	193	149.9 Å²	149.9	73%	0.728	75%	0.753	S	S	*	*			trans	-132	82.5	-176.2	-154.1	171.2	-163.5	177	6.1	114.5
3409	S	28.1	Very low	27.3	Very low	112 Å²	112	146.5 Å²	146.5	78%	0.783	74%	0.735	S	S	*	*			trans	-53.2	135.4	152.3	52.3	0	0	0	0	110.8
3410	K	29.3	Very low	27.2	Very low	185 Å²	185	148.5 Å²	148.5	80%	0.804	73%	0.732	S	S	*	*			trans	-114.7	120.4	159.6	-77.9	-175.4	175.6	179.3	0	108.7
3411	L	28.5	Very low	27.3	Very low	123 Å²	123	144.8 Å²	144.8	64%	0.644	72%	0.722	S	S	*	*			trans	-97.5	156.1	147.8	-98.1	77.9	0	0	0	107.7
3412	P	30.2	Very low	27.4	Very low	72 Å²	72	144.8 Å²	144.8	47%	0.468	72%	0.718	S	S	.	*			trans	-79.9	167.7	175.5	34.9	-36.4	0	0	0	111.9	A2729	A2729-P3412 HydrophobicContact CB-CG 4.15Å
3413	I	29.8	Very low	27.7	Very low	162 Å²	162	146.5 Å²	146.5	83%	0.831	73%	0.727	S	S	*	*			trans	165.3	160.6	136.5	-85.2	159.1	0	0	0	109.3
3414	T	27.4	Very low	27.8	Very low	110 Å²	110	141.9 Å²	141.9	68%	0.675	72%	0.722	S	S	*	*			trans	-74	174	-162.2	47	0	0	0	0	116.8
3415	D	26.2	Very low	27.9	Very low	137 Å²	137	143.6 Å²	143.6	73%	0.733	72%	0.724	S	S	*	*			trans	115.5	133.7	138.5	-73.4	-57.4	0	0	0	121.5
3416	Y	27.2	Very low	28.1	Very low	211 Å²	211	139.8 Å²	139.8	83%	0.827	71%	0.713	S	S	*	*			trans	71.9	93.6	159.1	-90.7	-104.1	0	0	0	122.6
3417	L	25.8	Very low	28.3	Very low	147 Å²	147	140.6 Å²	140.6	77%	0.77	72%	0.717	S	S	*	*			trans	-4.1	134.9	132.5	-60.9	164.6	0	0	0	118.2
3418	R	25.7	Very low	28.4	Very low	153 Å²	153	137.4 Å²	137.4	58%	0.577	70%	0.703	S	S	*	*				168.6	139.3	99.3	179.8	164.8	-69.7	-150.1	-2.5	113.9	L2955 L2956	L2955-R3418 HydrophobicContact CD2-CG 4.13Å; L2956-R3418 HydrophobicContact CD1-CB 4.18Å; L2956-R3418 HydrophobicContact CD1-CG 4.13Å; L2956-R3418 WeakPolarHBondContact CD1-O 3.33Å; L2956-R3418 HydrophobicContact CG-CB 4.5Å
3419	S	26.2	Very low	28.6	Very low	65 Å²	65	137.7 Å²	137.7	46%	0.455	71%	0.71	S	S	.	*			trans	34.2	132.4	160.4	70.4	0	0	0	0	120.6	L2956	L2956-S3419 WeakPolarHBondContact CD1-OG 3.5Å
3420	Q	28.2	Very low	28.6	Very low	153 Å²	153	139.9 Å²	139.9	72%	0.715	71%	0.708	S	S	*	*				-162.5	145.3	68.5	-86.5	-91	-47.9	0	0	112.2
3421	N	27.4	Very low	28.6	Very low	116 Å²	116	136.4 Å²	136.4	62%	0.62	70%	0.702	S	S	*	*			trans	50.1	133.3	137.1	-73.2	47.9	0	0	0	121.4
3422	E	28.8	Very low	28.5	Very low	152 Å²	152	136.1 Å²	136.1	71%	0.71	70%	0.701	S	S	*	*			cis	-150.5	177.4	3.8	-55.2	-160.7	144	0	0	113.2
3423	L	30.1	Very low	28.4	Very low	168 Å²	168	138.6 Å²	138.6	88%	0.88	71%	0.707	S	S	*	*			trans	67.7	122.1	158.8	-60.9	148.5	0	0	0	118.4
3424	G	28.8	Very low	28.5	Very low	61 Å²	61	140 Å²	140	63%	0.629	70%	0.703	S	S	*	*			cis	166.4	123.1	-14.7	0	0	0	0	0	116.2
3425	F	28.5	Very low	28.4	Very low	206 Å²	206	141.9 Å²	141.9	90%	0.904	71%	0.709	S	S	*	*			trans	62.8	165.7	155.5	-63.4	-88.6	0	0	0	120.1
3426	P	33.1	Very low	28.6	Very low	96 Å²	96	142.1 Å²	142.1	62%	0.623	72%	0.715	S	S	*	*			cis	-129.6	165.9	-48.3	37.1	-21.3	0	0	0	112.9
3427	N	33.4	Very low	28.5	Very low	140 Å²	140	141.1 Å²	141.1	75%	0.749	72%	0.715	S	S	*	*				-175.1	158.9	83.1	-93.7	-41.9	0	0	0	114.9
3428	L	26.4	Very low	28.5	Very low	124 Å²	124	139.2 Å²	139.2	65%	0.649	71%	0.714	S	S	*	*			trans	-36.9	158.8	172.1	-63.1	109.5	0	0	0	117.8
3429	F	30.6	Very low	28.5	Very low	198 Å²	198	136.6 Å²	136.6	87%	0.868	72%	0.719	S	S	*	*			cis	-145.4	168.2	42	-87.3	-89.9	0	0	0	117.3
3430	H	28.1	Very low	28.5	Very low	159 Å²	159	138.5 Å²	138.5	74%	0.736	73%	0.732	S	S	*	*			trans	-81.8	179.4	173.8	-102.6	-74.9	0	0	0	112.5
3431	T	31.1	Very low	28.3	Very low	112 Å²	112	135.9 Å²	135.9	69%	0.687	73%	0.731	S	S	*	*			cis	-160.7	149.1	17.1	-5.6	0	0	0	0	111.2
3432	N	26.3	Very low	28.3	Very low	116 Å²	116	136 Å²	136	62%	0.62	74%	0.74	S	S	*	*				37.4	151.9	127.9	-67.5	47.9	0	0	0	122.9
3433	E	27.3	Very low	28.2	Very low	124 Å²	124	133.6 Å²	133.6	58%	0.579	74%	0.74	S	S	*	*			cis	179.4	176	-8.4	-174.4	177.7	-177.6	0	0	110.3
3434	Y	32	Very low	28	Very low	192 Å²	192	132.9 Å²	132.9	75%	0.753	74%	0.737	S	S	*	*			trans	92.1	138.1	164.1	-68.6	-73.6	0	0	0	122.8
3435	D	24.8	Very low	28.1	Very low	149 Å²	149	138.4 Å²	138.4	80%	0.797	75%	0.751	S	S	*	*			trans	-77.9	163	177.8	-63	-90.9	0	0	0	114.9
3436	V	31.5	Very low	28.1	Very low	142 Å²	142	133.8 Å²	133.8	86%	0.861	74%	0.744	S	S	*	*				-177.9	151	107.9	148.7	0	0	0	0	112.2
3437	K	24	Very low	28.2	Very low	191 Å²	191	134.7 Å²	134.7	83%	0.83	75%	0.75	S	S	*	*			trans	-61.3	145.2	179.2	-53.3	161.7	-176.7	171.7	0	112.9
3438	S	25.8	Very low	27.8	Very low	107 Å²	107	135 Å²	135	75%	0.748	75%	0.752	S	S	*	*				156.7	150.3	104.3	55.6	0	0	0	0	116
3439	S	26.8	Very low	28.1	Very low	97 Å²	97	136 Å²	136	68%	0.678	75%	0.753	S	S	*	*			trans	47.6	106.7	148.7	54	0	0	0	0	122.4
3440	S	24.9	Very low	28.1	Very low	105 Å²	105	134.7 Å²	134.7	73%	0.734	75%	0.747	S	S	*	*				70.4	130	123.7	64.5	0	0	0	0	123.7
3441	S	25.1	Very low	28	Very low	99 Å²	99	131.7 Å²	131.7	69%	0.692	74%	0.744	S	S	*	*			trans	68.4	122.2	139	57.8	0	0	0	0	121.9
3442	S	26.1	Very low	28.1	Very low	117 Å²	117	134.1 Å²	134.1	82%	0.818	75%	0.753	S	S	*	*			trans	60	139.7	151.8	57.6	0	0	0	0	118.1
3443	S	28.2	Very low	28	Very low	102 Å²	102	136.3 Å²	136.3	71%	0.713	76%	0.759	S	S	*	*			cis	-159.2	156.6	27.9	55.5	0	0	0	0	113.7
3444	L	25.5	Very low	28.1	Very low	154 Å²	154	136.5 Å²	136.5	81%	0.806	77%	0.773	S	S	*	*			trans	19.9	122.3	142.5	-63.6	163.6	0	0	0	119.4
3445	L	30.1	Very low	27.7	Very low	177 Å²	177	136.1 Å²	136.1	93%	0.927	78%	0.775	S	S	*	*				-164.2	158.2	121.5	-104.9	161.8	0	0	0	112.4
3446	S	28	Very low	27.9	Very low	109 Å²	109	133.4 Å²	133.4	76%	0.762	77%	0.774	S	S	*	*			trans	-73.7	164.6	-156.4	-67	0	0	0	0	117.7
3447	P	35.2	Very low	27.8	Very low	115 Å²	115	133.2 Å²	133.2	75%	0.747	77%	0.767	S	S	*	*			trans	-98.1	171.2	-170.2	39.7	-37.1	0	0	0	114.3
3448	N	26.7	Very low	27.8	Very low	145 Å²	145	130.2 Å²	130.2	78%	0.775	77%	0.766	S	S	*	*			trans	-163.2	160.1	142.7	-123.7	-40.5	0	0	0	116.4
3449	H	32.3	Very low	28.1	Very low	146 Å²	146	130.8 Å²	130.8	68%	0.676	77%	0.765	S	S	*	*			trans	75.8	121.7	156	-78.7	-39.1	0	0	0	124.6
3450	K	29.4	Very low	27.9	Very low	170 Å²	170	132.1 Å²	132.1	74%	0.739	77%	0.77	S	S	*	*				96.8	95.1	126.3	-78.3	176.8	-177.8	-177.2	0	120.8
3451	S	26	Very low	28.1	Very low	97 Å²	97	137.3 Å²	137.3	68%	0.678	78%	0.775	S	S	*	*				53.8	127.9	117.8	64.1	0	0	0	0	120.9
3452	N	33.1	Very low	28.1	Very low	163 Å²	163	137.3 Å²	137.3	87%	0.872	77%	0.774	S	S	*	*			trans	-149	104.5	130.8	-98.3	-23.5	0	0	0	109.9
3453	E	25.1	Very low	27.9	Very low	161 Å²	161	138.4 Å²	138.4	75%	0.752	77%	0.771	S	S	*	*			trans	-84.8	145.6	157.3	-62.4	179.5	129.3	0	0	108.3
3454	C	30.2	Very low	27.9	Very low	128 Å²	128	144.4 Å²	144.4	87%	0.865	78%	0.78	S	S	*	*			trans	-126.8	87	165	-86.5	0	0	0	0	110.4
3455	F	23.8	Very low	27.9	Very low	184 Å²	184	142.7 Å²	142.7	81%	0.807	77%	0.771	S	S	*	*			trans	-65.9	138.6	161.4	-94	-96.4	0	0	0	110.6
3456	A	29.2	Very low	27.7	Very low	93 Å²	93	140 Å²	140	77%	0.769	76%	0.758	S	S	*	*			trans	-141.9	66.8	172.5	0	0	0	0	0	112.2
3457	I	27.8	Very low	27.6	Very low	138 Å²	138	140.6 Å²	140.6	71%	0.708	76%	0.757	S	S	*	*			trans	46.6	114.3	143.7	-52.8	165.3	0	0	0	118.2	V3459	I3457-V3459 HydrophobicContact CG2-CG2 3.91Å
3458	P	25.6	Very low	27.2	Very low	127 Å²	127	140.6 Å²	140.6	83%	0.825	76%	0.755	S	S	*	*			trans	-82.4	140.8	162.6	34.2	-32	0	0	0	111.9
3459	V	30.9	Very low	27.3	Very low	119 Å²	119	138.9 Å²	138.9	72%	0.721	75%	0.75	S	S	*	*			trans	-136.4	118.8	167.8	-174.2	0	0	0	0	110.5	I3457 Y3461	I3457-V3459 HydrophobicContact CG2-CG2 3.91Å; V3459-Y3461 HydrophobicContact CG1-CD2 4.45Å
3460	T	23.6	Very low	27	Very low	126 Å²	126	137.9 Å²	137.9	77%	0.773	75%	0.749	S	S	*	*			trans	-109.7	126.9	173.2	50.6	0	0	0	0	110.3
3461	Y	28	Very low	26.9	Very low	214 Å²	214	135.4 Å²	135.4	84%	0.839	74%	0.744	S	S	*	*			trans	-147.8	119.1	162.7	-98	-71.3	0	0	0	114.2	V3459	V3459-Y3461 HydrophobicContact CG1-CD2 4.45Å
3462	S	24.7	Very low	26.9	Very low	98 Å²	98	140.2 Å²	140.2	69%	0.685	75%	0.753	S	S	*	*			trans	40.1	126.9	144.4	57.4	0	0	0	0	122.8
3463	N	23.5	Very low	26.6	Very low	140 Å²	140	138.6 Å²	138.6	75%	0.749	74%	0.744	S	S	*	*			trans	-11.7	145.5	143.8	-51.6	-8.7	0	0	0	117.5
3464	Y	28.3	Very low	26.6	Very low	229 Å²	229	137.5 Å²	137.5	90%	0.898	74%	0.74	S	S	*	*				-160.9	170.7	102.2	-117.4	-85.9	0	0	0	113.1
3465	N	25.5	Very low	26.4	Very low	117 Å²	117	136.8 Å²	136.8	63%	0.626	73%	0.732	S	S	*	*			trans	-79.5	163	-160.1	-94.2	43.5	0	0	0	118.6
3466	D	25.1	Very low	26.4	Very low	121 Å²	121	135 Å²	135	65%	0.647	73%	0.727	S	S	*	*			trans	66.2	125	136.4	-66.8	-30.4	0	0	0	123.9
3467	T	25.9	Very low	26.3	Very low	122 Å²	122	136.6 Å²	136.6	75%	0.748	72%	0.719	S	S	*	*			trans	70.5	153.3	137.6	62.9	0	0	0	0	118.9
3468	T	27.1	Very low	26.3	Very low	114 Å²	114	137.8 Å²	137.8	70%	0.699	72%	0.721	S	S	*	*			cis	-158.2	174.6	5.8	-6.8	0	0	0	0	112.2
3469	T	28.5	Very low	26.6	Very low	109 Å²	109	136.5 Å²	136.5	67%	0.669	71%	0.713	S	S	*	*			trans	60.4	105.5	148.5	51.9	0	0	0	0	121.5
3470	D	25.8	Very low	26.6	Very low	125 Å²	125	137.4 Å²	137.4	67%	0.668	72%	0.719	S	S	*	*				67.8	120.2	112.3	-64.4	-46.3	0	0	0	123.9
3471	N	27.8	Very low	26.8	Very low	118 Å²	118	136.8 Å²	136.8	63%	0.631	72%	0.72	S	S	*	*				50.1	119.3	125.2	-47	-40.4	0	0	0	120.4
3472	F	25.7	Very low	26.6	Very low	198 Å²	198	134 Å²	134	87%	0.868	72%	0.718	S	S	*	*				-157.7	-177.4	87.9	-123.6	-95.4	0	0	0	113
3473	I	26.1	Very low	26.7	Very low	130 Å²	130	138.9 Å²	138.9	67%	0.667	72%	0.723	S	S	*	*			trans	-137	166.2	-152.4	-85	170.5	0	0	0	111.6
3474	M	24.8	Very low	26.8	Very low	137 Å²	137	140 Å²	140	68%	0.675	73%	0.728	S	S	*	*			trans	80.2	147.2	164.7	-84	160.1	53.8	0	0	118.6	T3384	T3384-M3474 HydrophobicContact CG2-CE 3.44Å; T3384-M3474 VanDerWaalsContact CG2-CE 3.44Å
3475	V	25.9	Very low	26.7	Very low	114 Å²	114	137 Å²	137	69%	0.691	72%	0.722	S	S	*	*			cis	-170.3	-169.1	-26.5	97	0	0	0	0	109.4
3476	M	25	Very low	26.7	Very low	146 Å²	146	139.4 Å²	139.4	72%	0.719	73%	0.73	S	S	*	*			trans	89.4	133.6	173.4	-52.3	-57.7	-82.9	0	0	114.1
3477	Q	26.9	Very low	26.7	Very low	126 Å²	126	139.1 Å²	139.1	59%	0.589	73%	0.727	S	S	*	*			cis	-164	137.1	-7.8	-176.6	72.2	-30.5	0	0	110.9
3478	Q	27.9	Very low	26.7	Very low	163 Å²	163	137.2 Å²	137.2	76%	0.762	71%	0.712	S	S	*	*			trans	65.7	155.2	161.3	-77.3	166.4	9	0	0	119.9
3479	P	30.7	Very low	26.6	Very low	100 Å²	100	134.8 Å²	134.8	65%	0.649	70%	0.699	S	S	*	*				-140.2	137	-51.9	35.3	-16.8	0	0	0	116
3480	T	32.8	Very low	26.6	Very low	139 Å²	139	132.4 Å²	132.4	85%	0.853	68%	0.684	S	S	*	*			trans	61.9	134	145.1	58.9	0	0	0	0	121.1
3481	S	26.8	Very low	26.6	Very low	112 Å²	112	130.5 Å²	130.5	78%	0.783	67%	0.673	S	S	*	*			cis	-157.8	114.5	-13.8	-165.2	0	0	0	0	110.9
3482	I	24.9	Very low	26.8	Very low	156 Å²	156	127.6 Å²	127.6	80%	0.8	66%	0.658	S	S	*	*	S	Bend	trans	-92.7	175.8	161.2	-76.9	172.8	0	0	0	108.6
3483	Y	26	Very low	27	Very low	200 Å²	200	121.5 Å²	121.5	78%	0.784	63%	0.633	S	S	*	*			trans	-30.4	138.6	175	-89.9	-128.8	0	0	0	116.2
3484	L	25.8	Very low	26.9	Very low	165 Å²	165	121 Å²	121	86%	0.864	64%	0.641	S	S	*	*			trans	-156.9	92.1	139.6	-115.6	169.2	0	0	0	112.9
3485	Q	26.9	Very low	27.1	Very low	166 Å²	166	118.6 Å²	118.6	78%	0.776	63%	0.634	S	S	*	*			trans	0	125.9	143.8	-173.4	177.8	29.3	0	0	119.2
3486	Q	24.6	Very low	27.2	Very low	167 Å²	167	119.7 Å²	119.7	78%	0.78	63%	0.626	S	S	*	*			trans	-170.9	135.3	131.3	-107.2	171.8	16.3	0	0	114.2
3487	L	24.1	Very low	27.3	Very low	114 Å²	114	117.2 Å²	117.2	60%	0.597	62%	0.622	S	S	*	*			trans	65.3	104.2	155.6	-58.6	167.1	0	0	0	120.9	W2837	W2837-L3487 HydrophobicContact CZ2-CB 4.36Å; W2837-L3487 PolarHBondContact NE1-O 3.43Å
3488	L	25.9	Very low	27.4	Very low	83 Å²	83	117.3 Å²	117.3	44%	0.435	62%	0.623	S	S	.	*			trans	138.5	150.7	131.7	-81.2	146.5	0	0	0	115.5
3489	P	25.4	Very low	27.5	Very low	63 Å²	63	114.5 Å²	114.5	41%	0.409	62%	0.621	S	S	.	*			trans	-79.1	145.3	172.9	2.2	13.6	0	0	0	112.8	V3333	V3333-P3489 HydrophobicContact CB-CB 3.66Å; V3333-P3489 HydrophobicContact CB-CG 3.83Å; V3333-P3489 HydrophobicContact CG1-CG 4.48Å; V3333-P3489 HydrophobicContact CG2-CB 4.32Å; V3333-P3489 WeakPolarHBondContact O-CG 3.43Å
3490	V	28	Very low	27.3	Very low	59 Å²	59	115 Å²	115	36%	0.358	62%	0.617	S	S	.	*			trans	-169.4	110	155.6	178.8	0	0	0	0	115.5	T3331 N3492	T3331-V3490 CarbonylContact O-C 3.56Å; T3331-V3490 PolarHBondContact O-N 2.88Å; T3331-V3490 PolarHBondContact OG1-O 2.99Å; V3490-N3492 PolarHBondContact O-N 2.98Å; V3490-N3492 VanDerWaalsContact O-N 3.13Å; V3490-N3492 PolarHBondContact O-ND2 2.74Å
3491	N	27.1	Very low	27.1	Very low	84 Å²	84	114.8 Å²	114.8	45%	0.449	61%	0.606	S	S	.	*			trans	40.2	30.3	133	-10.5	-94	0	0	0	126.4	V3329 A3330 T3331	V3329-N3491 VanDerWaalsContact CA-O 3.23Å; V3329-N3491 WeakPolarHBondContact CA-O 3.46Å; V3329-N3491 HydrophobicContact CB-CB 4.32Å; V3329-N3491 HydrophobicContact CG1-CB 3.2Å; V3329-N3491 WeakPolarHBondContact CG1-O 3.43Å; A3330-N3491 WeakPolarHBondContact CA-OD1 3.41Å; A3330-N3491 PolarHBondContact N-O 2.84Å; T3331-N3491 VanDerWaalsContact CA-N 3.32Å; T3331-N3491 VanDerWaalsContact CA-OD1 3.24Å; T3331-N3491 WeakPolarHBondContact CA-OD1 3.42Å; T3331-N3491 PolarHBondContact N-OD1 2.79Å; T3331-N3491 PolarHBondContact O-N 2.84Å; T3331-N3491 PolarHBondContact O-OD1 2.91Å
3492	N	31.1	Very low	27.3	Very low	57 Å²	57	111.2 Å²	111.2	31%	0.305	58%	0.581	S	S	.	*			trans	-119.9	91.8	-173.5	-73.8	-110.6	0	0	0	119.4	K2905 A3330 T3331 V3490	K2905-N3492 PolarHBondContact NZ-OD1 3.45Å; A3330-N3492 VanDerWaalsContact N-N 3.19Å; A3330-N3492 CarbonylContact O-C 3.58Å; A3330-N3492 VanDerWaalsContact O-CA 3.24Å; A3330-N3492 WeakPolarHBondContact O-CA 3.24Å; A3330-N3492 PolarHBondContact O-N 3.43Å; T3331-N3492 PolarHBondContact OG1-N 2.75Å; V3490-N3492 PolarHBondContact O-N 2.98Å; V3490-N3492 VanDerWaalsContact O-N 3.13Å; V3490-N3492 PolarHBondContact O-ND2 2.74Å
3493	I	30	Very low	27.5	Very low	70 Å²	70	109.2 Å²	109.2	36%	0.359	58%	0.576	S	S	.	*			trans	-88.1	162.2	177.1	-140.5	167.4	0	0	0	111.6	T3328 A3330 T3495	T3328-I3493 HydrophobicContact CG2-CG2 4.25Å; A3330-I3493 HydrophobicContact CB-CB 3.68Å; A3330-I3493 HydrophobicContact CB-CD1 3.77Å; A3330-I3493 HydrophobicContact CB-CG1 3.61Å; A3330-I3493 PolarHBondContact O-N 2.98Å; I3493-T3495 HydrophobicContact CG2-CG2 4.14Å
3494	C	25	Very low	27.7	Very low	121 Å²	121	105.4 Å²	105.4	82%	0.818	58%	0.579	S	S	*	*			trans	-103.6	86.6	174.3	-165.7	0	0	0	0	112.4
3495	T	29.2	Very low	27.7	Very low	86 Å²	86	103.9 Å²	103.9	53%	0.528	57%	0.572	S	S	.	*			trans	-104.8	129.8	167.9	33.2	0	0	0	0	110.2	T3328 I3493	T3328-T3495 WeakPolarHBondContact CB-OG1 3.34Å; T3328-T3495 PolarHBondContact OG1-OG1 3.48Å; I3493-T3495 HydrophobicContact CG2-CG2 4.14Å
3496	Y	26.5	Very low	27.9	Very low	136 Å²	136	103.3 Å²	103.3	53%	0.533	57%	0.574	S	S	.	*			trans	-92.1	139.8	174.1	-135.7	-75.7	0	0	0	109.1	K2792 I2909	K2792-Y3496 VanDerWaalsContact CE-CE1 3.42Å; I2909-Y3496 HydrophobicContact CG2-CE2 4.41Å
3497	C	28.1	Very low	28.1	Very low	94 Å²	94	100.2 Å²	100.2	64%	0.635	56%	0.559	S	S	*	*			trans	81.6	89.8	178.7	-53.3	0	0	0	0	117.2
3498	E	28.4	Very low	28.2	Very low	129 Å²	129	102 Å²	102	60%	0.603	57%	0.569	S	S	*	*			trans	-150.3	148.2	132.8	-135.6	-161.8	-125.8	0	0	113.4	V3326	V3326-E3498 PolarHBondContact N-OE2 2.76Å; V3326-E3498 WeakPolarHBondContact O-CB 3.42Å; V3326-E3498 VanDerWaalsContact O-OE2 3.11Å
3499	S	29.2	Very low	28.2	Very low	103 Å²	103	105.8 Å²	105.8	72%	0.72	58%	0.584	S	S	*	*			trans	174.4	129.1	172.5	-76.1	0	0	0	0	104.8
3500	I	27.2	Very low	28.2	Very low	111 Å²	111	107.3 Å²	107.3	57%	0.569	60%	0.596	S	S	*	*			cis	-149.1	136.7	18.9	-51.2	168.2	0	0	0	107.6	P3323 I3324	P3323-I3500 WeakPolarHBondContact O-CG2 3.37Å; I3324-I3500 CarbonylContact O-C 3.58Å; I3324-I3500 WeakPolarHBondContact O-CG2 3.36Å
3501	H	29.2	Very low	28.1	Very low	134 Å²	134	111.7 Å²	111.7	62%	0.62	62%	0.616	S	S	*	*			trans	-164.6	99.3	154.3	-111.2	-54.6	0	0	0	115.9	I3324 V3325 I3549	I3324-H3501 CarbonylContact O-C 3.55Å; I3324-H3501 PolarHBondContact O-N 2.77Å; V3325-H3501 VanDerWaalsContact CB-O 3.23Å; V3325-H3501 WeakPolarHBondContact CB-O 3.31Å; V3325-H3501 VanDerWaalsContact CG1-O 3.3Å; V3325-H3501 WeakPolarHBondContact CG1-O 3.27Å; V3325-H3501 WeakPolarHBondContact CG2-O 3.17Å; H3501-I3549 WeakPolarHBondContact CE1-CD1 3.33Å
3502	S	30.8	Very low	28.1	Very low	37 Å²	37	112 Å²	112	26%	0.259	62%	0.618	S	S	.	*			trans	-100.6	123	-172	55.9	0	0	0	0	116.9	P3323 I3324	P3323-S3502 WeakPolarHBondContact CD-OG 3.49Å; P3323-S3502 WeakPolarHBondContact CG-OG 3.33Å; I3324-S3502 PolarHBondContact O-N 2.78Å
3503	T	28.7	Very low	27.8	Very low	115 Å²	115	115.4 Å²	115.4	71%	0.706	63%	0.634	S	S	*	*			trans	29.3	102.5	138	61.1	0	0	0	0	119.4
3504	S	29.9	Very low	27.7	Very low	120 Å²	120	117 Å²	117	84%	0.839	65%	0.652	S	S	*	*				-143.8	139.9	128.1	66.6	0	0	0	0	109
3505	N	26.7	Very low	27.7	Very low	133 Å²	133	116.7 Å²	116.7	71%	0.711	64%	0.641	S	S	*	*			trans	-84	141	-169.6	-58.9	-25.6	0	0	0	111.7
3506	N	31.4	Very low	27.7	Very low	154 Å²	154	120 Å²	120	82%	0.824	65%	0.645	S	S	*	*			trans	-175.3	156.6	130.5	-92.9	-32.7	0	0	0	112.2
3507	H	27.4	Very low	27.7	Very low	102 Å²	102	118.6 Å²	118.6	47%	0.472	65%	0.647	S	S	.	*			trans	-53.2	138.7	176.8	-92.1	-73.7	0	0	0	114.2
3508	L	27.6	Very low	27.8	Very low	151 Å²	151	119.8 Å²	119.8	79%	0.791	65%	0.653	S	S	*	*				-175.7	174.5	115.3	-99.5	163	0	0	0	113.4
3509	H	25.9	Very low	27.9	Very low	163 Å²	163	121 Å²	121	76%	0.755	66%	0.662	S	S	*	*			trans	-70.4	149.4	-167.2	-83	-99.3	0	0	0	117.1
3510	S	24.4	Very low	27.9	Very low	95 Å²	95	121.2 Å²	121.2	66%	0.664	66%	0.664	S	S	*	*			trans	69.7	169.2	139.1	76.7	0	0	0	0	121.7
3511	L	26.9	Very low	27.9	Very low	150 Å²	150	126.3 Å²	126.3	79%	0.785	68%	0.677	S	S	*	*			trans	73.9	107.1	-179.9	-48.8	179.4	0	0	0	115.2
3512	N	26	Very low	27.9	Very low	91 Å²	91	123.1 Å²	123.1	49%	0.487	68%	0.681	S	S	.	*				80.8	72.4	50.1	-169.3	-13.2	0	0	0	115.1	K3190	K3190-N3512 PolarHBondContact NZ-OD1 2.74Å; K3190-N3512 VanDerWaalsContact NZ-OD1 3.16Å
3513	M	25.8	Very low	27.8	Very low	128 Å²	128	126.9 Å²	126.9	63%	0.631	71%	0.707	S	S	*	*			trans	-151.5	159.3	151.4	-76	-54.6	152	0	0	107.5	K3190 N3517	K3190-M3513 PolarHBondContact NZ-SD 2.99Å; M3513-N3517 WeakPolarHBondContact CE-ND2 3.26Å; M3513-N3517 PolarHBondContact SD-ND2 3.14Å; M3513-N3517 VanDerWaalsContact SD-ND2 3.36Å
3514	S	27.1	Very low	27.9	Very low	105 Å²	105	129.8 Å²	129.8	73%	0.734	72%	0.717	S	S	*	*			cis	-145.5	140.7	11.8	60.7	0	0	0	0	113.9
3515	L	25.7	Very low	27.8	Very low	113 Å²	113	129.6 Å²	129.6	59%	0.592	71%	0.713	S	S	*	*	S	Bend	trans	-152.4	126.1	147.1	-110.1	164.8	0	0	0	106.5
3516	Y	29.5	Very low	28	Very low	155 Å²	155	131.5 Å²	131.5	61%	0.608	72%	0.72	S	S	*	*			trans	41.6	82.5	179.2	-74.2	-78.7	0	0	0	118.4	L3612	Y3516-L3612 HydrophobicContact CD1-CD2 3.43Å; Y3516-L3612 VanDerWaalsContact CD1-CD2 3.43Å; Y3516-L3612 HydrophobicContact CE1-CB 3.84Å; Y3516-L3612 HydrophobicContact CE1-CD2 3.4Å; Y3516-L3612 HydrophobicContact CE1-CG 4.2Å; Y3516-L3612 HydrophobicContact CG-CD2 4.16Å
3517	N	25.4	Very low	27.9	Very low	108 Å²	108	130.4 Å²	130.4	58%	0.578	71%	0.714	S	S	*	*			trans	-97.4	118	158.3	-95.2	-2.5	0	0	0	110.8	M3513 I3519	M3513-N3517 WeakPolarHBondContact CE-ND2 3.26Å; M3513-N3517 PolarHBondContact SD-ND2 3.14Å; M3513-N3517 VanDerWaalsContact SD-ND2 3.36Å; N3517-I3519 PolarHBondContact O-N 2.96Å
3518	P	29.6	Very low	28.1	Very low	119 Å²	119	134.7 Å²	134.7	77%	0.773	73%	0.734	S	S	*	*			trans	-79.4	104.5	169.8	30.9	-31.4	0	0	0	110.3	S3520	P3518-S3520 PolarHBondContact O-N 2.99Å
3519	I	30.7	Very low	28.2	Very low	154 Å²	154	134.7 Å²	134.7	79%	0.79	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-65.7	134.4	179	-62.6	179.6	0	0	0	110.5	N3517	N3517-I3519 PolarHBondContact O-N 2.96Å
3520	S	29.1	Very low	28.4	Very low	108 Å²	108	132.6 Å²	132.6	76%	0.755	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-73.2	138.7	-171.1	-172.9	0	0	0	0	113.3	P3518	P3518-S3520 PolarHBondContact O-N 2.99Å
3521	Y	27.2	Very low	28.8	Very low	218 Å²	218	132.7 Å²	132.7	86%	0.855	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-92.2	126.5	169.5	-80.4	-93.6	0	0	0	111.7
3522	G	29.5	Very low	28.9	Very low	67 Å²	67	131.5 Å²	131.5	69%	0.691	73%	0.732	S	S	*	*			trans	-173.4	82.3	172.1	0	0	0	0	0	108.9
3523	S	29.2	Very low	29.1	Very low	115 Å²	115	133.9 Å²	133.9	80%	0.804	75%	0.745	S	S	*	*				73.6	102	85.3	-62.7	0	0	0	0	114
3524	L	30.1	Very low	29.5	Very low	176 Å²	176	135.6 Å²	135.6	92%	0.921	75%	0.751	S	S	*	*			trans	-175.8	132.5	135.9	-100.2	168.2	0	0	0	109.3
3525	P	28.3	Very low	29.6	Very low	117 Å²	117	137.5 Å²	137.5	76%	0.76	75%	0.751	S	S	*	*			trans	-114.1	142.5	175.7	37.5	-28.1	0	0	0	113.5
3526	M	32.2	Very low	29.8	Very low	172 Å²	172	136 Å²	136	85%	0.847	76%	0.755	S	S	*	*			trans	-168.1	157.9	138	-119.7	-56.7	-172.7	0	0	111.7
3527	D	28	Very low	29.9	Very low	132 Å²	132	134.5 Å²	134.5	71%	0.706	76%	0.762	S	S	*	*			trans	-84.2	140.9	177.2	-48.5	-72.3	0	0	0	111.7
3528	Q	32.1	Very low	30.2	Very low	191 Å²	191	136.7 Å²	136.7	89%	0.893	77%	0.769	S	S	*	*				-174.9	156.2	109.6	-99.5	174.6	60.8	0	0	114.4
3529	I	28.9	Very low	30.3	Very low	152 Å²	152	138.7 Å²	138.7	78%	0.779	77%	0.768	S	S	*	*			trans	-69.2	155.2	-163.2	-39.7	176	0	0	0	113.6
3530	T	30.5	Very low	30.3	Very low	119 Å²	119	136.7 Å²	136.7	73%	0.73	77%	0.767	S	S	*	*			trans	112.5	129.4	139.5	-19.8	0	0	0	0	120
3531	S	32.4	Very low	30.5	Very low	97 Å²	97	141 Å²	141	68%	0.678	77%	0.772	S	S	*	*			trans	64.3	98.7	149.2	49.8	0	0	0	0	122.7
3532	V	30.8	Very low	30.6	Very low	124 Å²	124	140.2 Å²	140.2	75%	0.752	78%	0.776	S	S	*	*				56.2	116.3	110.3	175.4	0	0	0	0	119.4
3533	N	29.1	Very low	30.8	Very low	142 Å²	142	143.1 Å²	143.1	76%	0.759	78%	0.776	S	S	*	*			trans	45	144.9	140.3	-51.6	-10.1	0	0	0	119.8
3534	Q	34.3	Very low	31	Very low	164 Å²	164	144.5 Å²	144.5	77%	0.766	77%	0.772	S	S	*	*			cis	-167.2	134.9	38.1	-151.2	162.5	10.4	0	0	112.9
3535	I	29.4	Very low	31.4	Very low	144 Å²	144	142 Å²	142	74%	0.738	76%	0.76	S	S	*	*			trans	49	114.4	138.2	-60.9	178.9	0	0	0	121.2
3536	A	30.2	Very low	31.8	Very low	82 Å²	82	143.8 Å²	143.8	68%	0.678	76%	0.763	S	S	*	*			trans	61.5	158.9	134.8	0	0	0	0	0	121.1
3537	T	31	Very low	32	Very low	123 Å²	123	141.7 Å²	141.7	76%	0.755	76%	0.76	S	S	*	*			cis	-160.4	150.1	-19.5	18.7	0	0	0	0	108.3
3538	H	31.9	Very low	32.7	Very low	155 Å²	155	143 Å²	143	72%	0.718	77%	0.768	S	S	*	*				-176.4	127	126.6	-108.7	-129	0	0	0	114.9
3539	H	31.9	Very low	33.7	Very low	161 Å²	161	138.9 Å²	138.9	75%	0.745	75%	0.75	S	S	*	*			trans	34.3	136.9	152.2	-53.7	-35.8	0	0	0	125.2
3540	S	29.4	Very low	34.7	Very low	111 Å²	111	137.4 Å²	137.4	78%	0.776	75%	0.751	S	S	*	*				115.7	76.5	125.3	-152	0	0	0	0	118.6
3541	K	33.5	Very low	36.1	Very low	200 Å²	200	138 Å²	138	87%	0.87	75%	0.748	S	S	*	*				-170.8	106.7	124.3	-102.3	160.1	-175.5	175.3	0	109.2	N3543	K3541-N3543 PolarHBondContact O-N 3.44Å
3542	H	30.7	Very low	38.2	Very low	200 Å²	200	137 Å²	137	93%	0.926	74%	0.736	S	S	*	*			trans	-68.6	120.6	175.5	-100.5	-88.6	0	0	0	110
3543	N	33.6	Very low	40.4	Very low	129 Å²	129	135.3 Å²	135.3	69%	0.69	73%	0.727	S	S	*	*			trans	-131.1	125	165.9	-172.1	11.2	0	0	0	107.3	K3541 N3545	K3541-N3543 PolarHBondContact O-N 3.44Å; N3543-N3545 PolarHBondContact O-N 2.66Å
3544	I	33.2	Very low	42.8	Very low	143 Å²	143	132 Å²	132	73%	0.733	71%	0.712	S	S	*	*			trans	-86.9	100.2	-169.5	-59	174.6	0	0	0	108.6
3545	N	37.8	Very low	44.8	Very low	124 Å²	124	127.2 Å²	127.2	66%	0.663	69%	0.692	S	S	*	*			trans	-122.7	138.4	170.3	-75.2	-47.4	0	0	0	108.9	N3543	N3543-N3545 PolarHBondContact O-N 2.66Å
3546	N	37	Very low	47.1	Very low	154 Å²	154	122.2 Å²	122.2	82%	0.824	67%	0.668	S	S	*	*			trans	-57.4	138.5	-175.6	-77	-15.6	0	0	0	112.9	N3548	N3546-N3548 PolarHBondContact O-N 3.33Å
3547	T	37.3	Very low	49.3	Very low	128 Å²	128	124.4 Å²	124.4	79%	0.785	67%	0.666	S	S	*	*			trans	-75.7	111.1	-172.9	45.2	0	0	0	0	112.2	I3549	T3547-I3549 PolarHBondContact O-N 2.66Å; T3547-I3549 VanDerWaalsContact O-N 3.08Å
3548	N	42.8	Very low	51.5	Low	161 Å²	161	123 Å²	123	86%	0.861	65%	0.651	S	S	*	*			trans	-66.1	103.6	160.2	-71.1	-64.4	0	0	0	108.9	N3546	N3546-N3548 PolarHBondContact O-N 3.33Å
3549	I	51.9	Low	53.4	Low	103 Å²	103	118.9 Å²	118.9	53%	0.528	63%	0.632	S	S	.	*			trans	-65.8	127.7	162.1	-61.8	177.4	0	0	0	106.9	H3501 T3547 L3551	H3501-I3549 WeakPolarHBondContact CE1-CD1 3.33Å; T3547-I3549 PolarHBondContact O-N 2.66Å; T3547-I3549 VanDerWaalsContact O-N 3.08Å; I3549-L3551 PolarHBondContact O-N 3.34Å
3550	P	49.7	Very low	55.7	Low	122 Å²	122	118.5 Å²	118.5	79%	0.792	62%	0.624	S	S	*	*			trans	-68.9	96	174.8	28.3	-33	0	0	0	108.9	N3552	P3550-N3552 PolarHBondContact O-N 3.03Å
3551	L	59.3	Low	58	Low	130 Å²	130	114 Å²	114	68%	0.681	59%	0.593	S	S	*	*			trans	-51.6	130.5	172.2	-68.5	171.3	0	0	0	109.3	I3549 V3556	I3549-L3551 PolarHBondContact O-N 3.34Å; L3551-V3556 HydrophobicContact CB-CG2 3.47Å; L3551-V3556 VanDerWaalsContact CB-CG2 3.47Å; L3551-V3556 HydrophobicContact CD1-CG2 4.03Å; L3551-V3556 HydrophobicContact CG-CG2 4.4Å
3552	N	78.1	Confident	59.9	Low	76 Å²	76	112.5 Å²	112.5	41%	0.406	58%	0.582	S	S	.	*			trans	-51.8	124.9	175.2	171.3	10	0	0	0	109.3	P3550 V3554 D3555 V3556	P3550-N3552 PolarHBondContact O-N 3.03Å; N3552-V3554 PolarHBondContact O-N 3.13Å; N3552-V3554 PolarHBondContact OD1-N 3.49Å; N3552-V3554 VanDerWaalsContact OD1-N 3.12Å; N3552-D3555 HydrophobicContact CB-CB 4.41Å; N3552-D3555 VanDerWaalsContact CB-OD2 3.27Å; N3552-D3555 WeakPolarHBondContact CB-OD2 3.39Å; N3552-D3555 PolarHBondContact ND2-OD2 3.05Å; N3552-D3555 PolarHBondContact O-N 2.92Å; N3552-V3556 PolarHBondContact O-N 3.04Å; N3552-V3556 VanDerWaalsContact O-N 3.09Å
3553	P	77.1	Confident	62.3	Low	89 Å²	89	107.7 Å²	107.7	58%	0.578	56%	0.56	S	S	*	*	H	α-helix	trans	-57.4	-27.8	-176.8	22	-33.8	0	0	0	112.6	M3557	P3553-M3557 WeakPolarHBondContact O-CB 3.44Å; P3553-M3557 WeakPolarHBondContact O-CG 3.42Å; P3553-M3557 PolarHBondContact O-N 3.39Å
3554	V	78	Confident	64.8	Low	74 Å²	74	103.9 Å²	103.9	45%	0.448	54%	0.54	S	S	.	.	H	α-helix	trans	-65.6	-44.2	175	-179	0	0	0	0	111.8	N3552 M3557 Q3558	N3552-V3554 PolarHBondContact O-N 3.13Å; N3552-V3554 PolarHBondContact OD1-N 3.49Å; N3552-V3554 VanDerWaalsContact OD1-N 3.12Å; V3554-M3557 PolarHBondContact O-N 3.45Å; V3554-Q3558 WeakPolarHBondContact O-CG 3.3Å; V3554-Q3558 PolarHBondContact O-N 3.46Å
3555	D	76.5	Confident	67.4	Low	62 Å²	62	98.6 Å²	98.6	33%	0.332	51%	0.511	S	S	.	.	H	α-helix	trans	-69.3	-37.7	178	-65.7	-66.8	0	0	0	111.1	R2791 N3552 M3557 Q3558 E3559	R2791-D3555 IonicContact CZ-OD1 3.64Å; R2791-D3555 IonicContact NH1-OD1 3.54Å; R2791-D3555 IonicContact NH2-OD1 2.74Å; R2791-D3555 PolarHBondContact NH2-OD1 3.45Å; N3552-D3555 HydrophobicContact CB-CB 4.41Å; N3552-D3555 VanDerWaalsContact CB-OD2 3.27Å; N3552-D3555 WeakPolarHBondContact CB-OD2 3.39Å; N3552-D3555 PolarHBondContact ND2-OD2 3.05Å; N3552-D3555 PolarHBondContact O-N 2.92Å; D3555-M3557 VanDerWaalsContact C-N 3.32Å; D3555-M3557 PolarHBondContact O-N 3.16Å; D3555-Q3558 PolarHBondContact O-N 3.5Å; D3555-E3559 PolarHBondContact O-N 3.42Å
3556	V	79	Confident	70	Confident	40 Å²	40	94.2 Å²	94.2	24%	0.242	49%	0.489	C	S	.	.	H	α-helix	trans	-62.9	-38	171.9	179.5	0	0	0	0	111.7	L3551 N3552 R3560	L3551-V3556 HydrophobicContact CB-CG2 3.47Å; L3551-V3556 VanDerWaalsContact CB-CG2 3.47Å; L3551-V3556 HydrophobicContact CD1-CG2 4.03Å; L3551-V3556 HydrophobicContact CG-CG2 4.4Å; N3552-V3556 PolarHBondContact O-N 3.04Å; N3552-V3556 VanDerWaalsContact O-N 3.09Å; V3556-R3560 WeakPolarHBondContact O-CB 3.23Å; V3556-R3560 WeakPolarHBondContact O-CD 3.28Å; V3556-R3560 WeakPolarHBondContact O-CG 3.27Å; V3556-R3560 PolarHBondContact O-N 3.34Å; V3556-R3560 VanDerWaalsContact O-N 3.16Å
3557	M	76.4	Confident	72.7	Confident	128 Å²	128	86.9 Å²	86.9	63%	0.631	45%	0.45	S	S	*	.	H	α-helix	trans	-69.8	-40.9	174.7	-76	171	64.5	0	0	111.9	P3553 V3554 D3555 R3560 A3561	P3553-M3557 WeakPolarHBondContact O-CB 3.44Å; P3553-M3557 WeakPolarHBondContact O-CG 3.42Å; P3553-M3557 PolarHBondContact O-N 3.39Å; V3554-M3557 PolarHBondContact O-N 3.45Å; D3555-M3557 VanDerWaalsContact C-N 3.32Å; D3555-M3557 PolarHBondContact O-N 3.16Å; M3557-R3560 PolarHBondContact O-N 3.27Å; M3557-A3561 WeakPolarHBondContact O-CB 3.26Å; M3557-A3561 PolarHBondContact O-N 3.34Å
3558	Q	75.5	Confident	75.4	Confident	93 Å²	93	83.6 Å²	83.6	44%	0.435	43%	0.427	S	S	.	.	H	α-helix	trans	-64.4	-43.7	176.9	-75.2	178.2	20	0	0	112	V3554 D3555 A3561 R3562	V3554-Q3558 WeakPolarHBondContact O-CG 3.3Å; V3554-Q3558 PolarHBondContact O-N 3.46Å; D3555-Q3558 PolarHBondContact O-N 3.5Å; Q3558-A3561 WeakPolarHBondContact O-CB 3.36Å; Q3558-A3561 PolarHBondContact O-N 2.99Å; Q3558-A3561 VanDerWaalsContact O-N 3.16Å; Q3558-R3562 PolarHBondContact O-N 2.9Å
3559	E	73.8	Confident	77.9	Confident	69 Å²	69	78.5 Å²	78.5	32%	0.322	40%	0.396	S	S	.	.	H	α-helix	trans	-67.2	-39	177.5	179.6	55.1	-163.1	0	0	111.9	D3555 A3561 R3562 Q3563	D3555-E3559 PolarHBondContact O-N 3.42Å; E3559-A3561 VanDerWaalsContact C-N 3.31Å; E3559-A3561 PolarHBondContact O-N 3.43Å; E3559-R3562 PolarHBondContact O-N 3.35Å; E3559-R3562 IonicContact OE1-CZ 2.71Å; E3559-R3562 IonicContact OE1-NE 3.1Å; E3559-R3562 IonicContact OE1-NH2 2.68Å; E3559-R3562 PolarHBondContact OE1-NH2 3.1Å; E3559-R3562 IonicContact OE2-CZ 3.72Å; E3559-R3562 IonicContact OE2-NE 3.77Å; E3559-R3562 PolarHBondContact OE2-NE 3.3Å; E3559-R3562 IonicContact OE2-NH2 3.98Å; E3559-R3562 PolarHBondContact OE2-NH2 2.99Å; E3559-Q3563 WeakPolarHBondContact O-CG 3.35Å; E3559-Q3563 PolarHBondContact O-N 3.45Å; E3559-Q3563 WeakPolarHBondContact OE1-CG 3.16Å; E3559-Q3563 PolarHBondContact OE1-NE2 2.82Å
3560	R	78.3	Confident	80	Confident	153 Å²	153	73.6 Å²	73.6	58%	0.577	37%	0.371	S	S	*	.	H	α-helix	trans	-62.1	-37.4	170.7	-72.8	172.3	-173.3	-176.7	6.1	112.2	V3556 M3557 N3564	V3556-R3560 WeakPolarHBondContact O-CB 3.23Å; V3556-R3560 WeakPolarHBondContact O-CD 3.28Å; V3556-R3560 WeakPolarHBondContact O-CG 3.27Å; V3556-R3560 PolarHBondContact O-N 3.34Å; V3556-R3560 VanDerWaalsContact O-N 3.16Å; M3557-R3560 PolarHBondContact O-N 3.27Å; R3560-N3564 WeakPolarHBondContact O-CB 3.42Å; R3560-N3564 PolarHBondContact O-N 3Å; R3560-N3564 PolarHBondContact O-ND2 3.38Å
3561	A	78.1	Confident	82.2	Confident	16 Å²	16	69.6 Å²	69.6	13%	0.132	34%	0.341	C	S	.	.	H	α-helix	trans	-67.5	-39	176.5	0	0	0	0	0	112	I3157 M3557 Q3558 E3559	I3157-A3561 HydrophobicContact CG1-CB 3.76Å; M3557-A3561 WeakPolarHBondContact O-CB 3.26Å; M3557-A3561 PolarHBondContact O-N 3.34Å; Q3558-A3561 WeakPolarHBondContact O-CB 3.36Å; Q3558-A3561 PolarHBondContact O-N 2.99Å; Q3558-A3561 VanDerWaalsContact O-N 3.16Å; E3559-A3561 VanDerWaalsContact C-N 3.31Å; E3559-A3561 PolarHBondContact O-N 3.43Å
3562	R	74.6	Confident	83.9	Confident	169 Å²	169	64 Å²	64	64%	0.638	31%	0.311	S	S	*	.	H	α-helix	trans	-66.6	-40.4	177	-168.1	-175.3	72.1	105.1	1	113.1	Q3558 E3559	Q3558-R3562 PolarHBondContact O-N 2.9Å; E3559-R3562 PolarHBondContact O-N 3.35Å; E3559-R3562 IonicContact OE1-CZ 2.71Å; E3559-R3562 IonicContact OE1-NE 3.1Å; E3559-R3562 IonicContact OE1-NH2 2.68Å; E3559-R3562 PolarHBondContact OE1-NH2 3.1Å; E3559-R3562 IonicContact OE2-CZ 3.72Å; E3559-R3562 IonicContact OE2-NE 3.77Å; E3559-R3562 PolarHBondContact OE2-NE 3.3Å; E3559-R3562 IonicContact OE2-NH2 3.98Å; E3559-R3562 PolarHBondContact OE2-NH2 2.99Å
3563	Q	79.7	Confident	84.6	Confident	99 Å²	99	62 Å²	62	46%	0.463	30%	0.303	S	S	.	.	H	α-helix	trans	-72.1	-45.6	-179.3	-70.9	-179.8	10.1	0	0	112.5	E3559 K3565	E3559-Q3563 WeakPolarHBondContact O-CG 3.35Å; E3559-Q3563 PolarHBondContact O-N 3.45Å; E3559-Q3563 WeakPolarHBondContact OE1-CG 3.16Å; E3559-Q3563 PolarHBondContact OE1-NE2 2.82Å; Q3563-K3565 PolarHBondContact O-NZ 3.16Å
3564	N	86.1	Confident	85.3	Confident	49 Å²	49	58.9 Å²	58.9	26%	0.262	29%	0.287	S	S	.	.			trans	-72.7	154.9	179.1	-71.5	-63	0	0	0	112.1	R3560 V3608	R3560-N3564 WeakPolarHBondContact O-CB 3.42Å; R3560-N3564 PolarHBondContact O-N 3Å; R3560-N3564 PolarHBondContact O-ND2 3.38Å; N3564-V3608 HydrophobicContact CB-CG1 4.31Å
3565	K	88.6	Confident	85.9	Confident	32 Å²	32	56.4 Å²	56.4	14%	0.139	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	142.1	173.8	-65.3	172.1	179.2	50.4	0	108.7	S3158 Q3563 F3567 V3608 W3609 W3611	S3158-K3565 WeakPolarHBondContact O-CA 3.43Å; Q3563-K3565 PolarHBondContact O-NZ 3.16Å; K3565-F3567 HydrophobicContact CB-CD2 4.25Å; K3565-F3567 HydrophobicContact CB-CE2 3.67Å; K3565-F3567 HydrophobicContact CB-CZ 3.99Å; K3565-F3567 HydrophobicContact CD-CZ 4.34Å; K3565-V3608 WeakPolarHBondContact O-CA 3.4Å; K3565-W3609 PolarHBondContact N-O 2.91Å; K3565-W3609 PolarHBondContact O-N 3.26Å; K3565-W3611 HydrophobicContact CD-CZ2 4.34Å
3566	V	92.5	Very high	86.6	Confident	32 Å²	32	55.1 Å²	55.1	19%	0.194	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	127.1	168.3	-172.8	0	0	0	0	107.2	I3157 S3158 V3159 K3160 L3568 V3608	I3157-V3566 HydrophobicContact CG2-CG2 3.92Å; S3158-V3566 PolarHBondContact O-N 3.27Å; V3159-V3566 HydrophobicContact CG1-CB 4.38Å; V3159-V3566 HydrophobicContact CG2-CB 4.26Å; V3159-V3566 HydrophobicContact CG2-CG2 4.39Å; K3160-V3566 PolarHBondContact N-O 3.47Å; V3566-L3568 HydrophobicContact CG1-CD2 3.91Å; V3566-V3608 HydrophobicContact CG2-CG2 4.25Å
3567	F	93	Very high	87.2	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	106.4	172.5	-61.8	-94.6	0	0	0	108.3	K3160 M3163 K3565 I3570 N3606 C3607 W3609 W3611	K3160-F3567 HydrophobicContact CB-CD1 3.73Å; K3160-F3567 HydrophobicContact CB-CE1 4.22Å; K3160-F3567 HydrophobicContact CB-CG 4.39Å; K3160-F3567 HydrophobicContact CG-CD1 3.86Å; K3160-F3567 HydrophobicContact CG-CE1 3.83Å; K3160-F3567 WeakPolarHBondContact O-CA 3.39Å; M3163-F3567 HydrophobicContact SD-CE1 4.23Å; K3565-F3567 HydrophobicContact CB-CD2 4.25Å; K3565-F3567 HydrophobicContact CB-CE2 3.67Å; K3565-F3567 HydrophobicContact CB-CZ 3.99Å; K3565-F3567 HydrophobicContact CD-CZ 4.34Å; F3567-I3570 HydrophobicContact CB-CD1 3.78Å; F3567-I3570 HydrophobicContact CB-CG1 3.78Å; F3567-I3570 HydrophobicContact CD1-CD1 3.6Å; F3567-I3570 HydrophobicContact CD1-CG1 3.86Å; F3567-I3570 HydrophobicContact CD2-CD1 4.4Å; F3567-I3570 HydrophobicContact CE1-CD1 4.22Å; F3567-I3570 HydrophobicContact CG-CD1 3.69Å; F3567-I3570 HydrophobicContact CG-CG1 4.09Å; F3567-N3606 CarbonylContact O-C 3.52Å; F3567-N3606 VanDerWaalsContact O-CA 3.29Å; F3567-N3606 WeakPolarHBondContact O-CA 3.17Å; F3567-N3606 PolarHBondContact O-N 2.79Å; F3567-N3606 VanDerWaalsContact O-N 3.07Å; F3567-C3607 PolarHBondContact N-O 2.74Å; F3567-C3607 PolarHBondContact O-N 3.26Å; F3567-W3609 HydrophobicContact CD2-CB 4.3Å; F3567-W3609 HydrophobicContact CE2-CB 4.09Å; F3567-W3611 HydrophobicContact CE1-CE3 4.37Å; F3567-W3611 AromaticContact CE1-CH2 3.89Å; F3567-W3611 HydrophobicContact CE1-CH2 3.89Å; F3567-W3611 AromaticContact CE1-CZ3 3.67Å; F3567-W3611 HydrophobicContact CE1-CZ3 3.67Å; F3567-W3611 HydrophobicContact CZ-CD2 4.5Å; F3567-W3611 AromaticContact CZ-CE3 3.88Å; F3567-W3611 HydrophobicContact CZ-CE3 3.88Å; F3567-W3611 HydrophobicContact CZ-CH2 4.09Å; F3567-W3611 AromaticContact CZ-CZ3 3.65Å; F3567-W3611 HydrophobicContact CZ-CZ3 3.65Å
3568	L	94.1	Very high	87.8	Confident	58 Å²	58	49.4 Å²	49.4	30%	0.304	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	-42.2	178.7	-56.6	-178.4	0	0	0	110.5	L3151 V3159 K3160 V3566 H3605 N3606	L3151-L3568 HydrophobicContact CD1-CD1 3.96Å; V3159-L3568 HydrophobicContact CG1-CD1 4Å; V3159-L3568 HydrophobicContact CG1-CD2 4.41Å; V3159-L3568 HydrophobicContact CG1-CG 4.01Å; K3160-L3568 PolarHBondContact O-N 2.9Å; V3566-L3568 HydrophobicContact CG1-CD2 3.91Å; L3568-H3605 CarbonylContact O-C 3.58Å; L3568-H3605 VanDerWaalsContact O-CA 3.23Å; L3568-H3605 WeakPolarHBondContact O-CA 3.42Å; L3568-N3606 PolarHBondContact O-N 3.47Å
3569	Y	95.3	Very high	88.5	Confident	54 Å²	54	46.4 Å²	46.4	21%	0.212	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	133.8	173.3	-177	-140.1	0	0	0	112.6	E3161 A3162 M3163 K3571 E3603 Y3604 H3605	E3161-Y3569 WeakPolarHBondContact O-CB 3.39Å; E3161-Y3569 PolarHBondContact O-N 3.14Å; A3162-Y3569 WeakPolarHBondContact CA-O 3.29Å; A3162-Y3569 HydrophobicContact CB-CD1 4.36Å; M3163-Y3569 PolarHBondContact N-O 3.02Å; Y3569-K3571 HydrophobicContact CE1-CB 4.22Å; Y3569-K3571 HydrophobicContact CE2-CB 4.27Å; Y3569-E3603 HydrophobicContact CE2-CB 4.41Å; Y3569-E3603 HydrophobicContact CE2-CG 4.09Å; Y3569-Y3604 WeakPolarHBondContact CA-O 3.43Å; Y3569-H3605 AromaticContact CD2-CE1 3.34Å; Y3569-H3605 WeakPolarHBondContact CD2-CE1 3.21Å; Y3569-H3605 AromaticContact CD2-ND1 3.48Å; Y3569-H3605 WeakPolarHBondContact CD2-ND1 3.42Å; Y3569-H3605 AromaticContact CE2-CE1 3.39Å; Y3569-H3605 WeakPolarHBondContact CE2-CE1 3.4Å
3570	I	95.7	Very high	89.3	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	134.2	167	-46.5	176.1	0	0	0	108.4	M3163 F3567 E3603 Y3604 W3609 F3614	M3163-I3570 HydrophobicContact CB-CG1 4.4Å; M3163-I3570 HydrophobicContact CB-CG2 4.21Å; M3163-I3570 HydrophobicContact CG-CG2 4.43Å; M3163-I3570 CarbonylContact O-C 3.57Å; M3163-I3570 WeakPolarHBondContact O-CA 3.35Å; M3163-I3570 HydrophobicContact SD-CG2 4.39Å; F3567-I3570 HydrophobicContact CB-CD1 3.78Å; F3567-I3570 HydrophobicContact CB-CG1 3.78Å; F3567-I3570 HydrophobicContact CD1-CD1 3.6Å; F3567-I3570 HydrophobicContact CD1-CG1 3.86Å; F3567-I3570 HydrophobicContact CD2-CD1 4.4Å; F3567-I3570 HydrophobicContact CE1-CD1 4.22Å; F3567-I3570 HydrophobicContact CG-CD1 3.69Å; F3567-I3570 HydrophobicContact CG-CG1 4.09Å; I3570-E3603 VanDerWaalsContact O-CA 3.31Å; I3570-E3603 WeakPolarHBondContact O-CA 3.46Å; I3570-Y3604 HydrophobicContact CB-CD2 4.17Å; I3570-Y3604 HydrophobicContact CG2-CD2 4.44Å; I3570-Y3604 PolarHBondContact N-O 3.1Å; I3570-Y3604 PolarHBondContact O-N 2.96Å; I3570-W3609 HydrophobicContact CD1-CE3 4.43Å; I3570-W3609 HydrophobicContact CD1-CZ3 4.24Å; I3570-F3614 HydrophobicContact CD1-CD2 3.65Å; I3570-F3614 HydrophobicContact CD1-CE2 3.6Å; I3570-F3614 HydrophobicContact CD1-CZ 4.4Å; I3570-F3614 HydrophobicContact CG2-CE2 3.85Å; I3570-F3614 HydrophobicContact CG2-CZ 4.05Å
3571	K	95.8	Very high	89.8	Confident	39 Å²	39	39.8 Å²	39.8	17%	0.17	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	132.2	176.4	-174.3	-175.2	174.3	-146.1	0	110.8	M3163 E3164 I3165 Y3569 L3602 E3603	M3163-K3571 PolarHBondContact O-N 2.62Å; E3164-K3571 VanDerWaalsContact CA-O 3.32Å; E3164-K3571 WeakPolarHBondContact CA-O 3.41Å; E3164-K3571 VanDerWaalsContact OE1-CD 3.31Å; E3164-K3571 WeakPolarHBondContact OE1-CD 3.27Å; E3164-K3571 WeakPolarHBondContact OE1-CE 3.4Å; E3164-K3571 IonicContact OE1-NZ 3.63Å; E3164-K3571 PolarHBondContact OE1-NZ 3.01Å; I3165-K3571 PolarHBondContact N-O 2.67Å; Y3569-K3571 HydrophobicContact CE1-CB 4.22Å; Y3569-K3571 HydrophobicContact CE2-CB 4.27Å; K3571-L3602 CarbonylContact C-O 3.53Å; K3571-L3602 WeakPolarHBondContact CA-O 3.33Å; K3571-E3603 HydrophobicContact CB-CG 4.27Å; K3571-E3603 HydrophobicContact CG-CG 3.95Å
3572	I	95.4	Very high	90.2	Very high	11 Å²	11	41 Å²	41	6%	0.056	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	97.6	172	-46.9	-174.9	0	0	0	106.5	I3165 F3575 T3601 L3602 F3614 V3618	I3165-I3572 HydrophobicContact CB-CG1 4.18Å; I3165-I3572 HydrophobicContact CB-CG2 4.37Å; I3165-I3572 HydrophobicContact CD1-CD1 4.19Å; I3165-I3572 HydrophobicContact CD1-CG1 4.37Å; I3165-I3572 WeakPolarHBondContact O-CG2 3.33Å; I3572-F3575 HydrophobicContact CG2-CE1 4.44Å; I3572-T3601 CarbonylContact O-C 3.57Å; I3572-T3601 VanDerWaalsContact O-CA 3.24Å; I3572-T3601 WeakPolarHBondContact O-CA 3.47Å; I3572-L3602 HydrophobicContact CB-CB 4.15Å; I3572-L3602 HydrophobicContact CD1-CB 4.45Å; I3572-L3602 HydrophobicContact CD1-CD1 4.39Å; I3572-L3602 HydrophobicContact CG1-CB 4.39Å; I3572-L3602 PolarHBondContact N-O 3.19Å; I3572-L3602 PolarHBondContact O-N 3.36Å; I3572-F3614 HydrophobicContact CD1-CZ 4.18Å; I3572-V3618 HydrophobicContact CD1-CG1 4.38Å; I3572-V3618 HydrophobicContact CD1-CG2 3.97Å
3573	P	94	Very high	90.5	Very high	34 Å²	34	33.3 Å²	33.3	22%	0.221	17%	0.17	C	C	.	.			trans	-54.6	140.9	178.6	-27.5	36.9	0	0	0	112.4	E3164 I3165	E3164-P3573 HydrophobicContact CG-CG 4.34Å; E3164-P3573 WeakPolarHBondContact OE1-CG 3.46Å; I3165-P3573 VanDerWaalsContact O-CD 3.27Å; I3165-P3573 WeakPolarHBondContact O-CD 3.2Å
3574	G	91.4	Very high	90.3	Very high	25 Å²	25	34.4 Å²	34.4	26%	0.258	18%	0.175	S	C	.	.			trans	-66.5	133.5	-176.9	0	0	0	0	0	113.8	I3599 T3601	G3574-I3599 CarbonylContact C-O 3.5Å; G3574-I3599 WeakPolarHBondContact CA-O 3.45Å; G3574-T3601 PolarHBondContact N-OG1 3.45Å; G3574-T3601 VanDerWaalsContact N-OG1 3.12Å
3575	F	90.7	Very high	89.5	Confident	21 Å²	21	39.2 Å²	39.2	9%	0.092	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	151.6	-175.3	67.3	-80.2	0	0	0	113	V3167 I3170 I3572 I3577 I3599	V3167-F3575 HydrophobicContact CB-CD1 4.09Å; V3167-F3575 HydrophobicContact CB-CD2 3.97Å; V3167-F3575 HydrophobicContact CB-CE1 3.88Å; V3167-F3575 HydrophobicContact CB-CE2 3.75Å; V3167-F3575 HydrophobicContact CB-CG 4.14Å; V3167-F3575 HydrophobicContact CB-CZ 3.7Å; V3167-F3575 HydrophobicContact CG1-CD2 4.05Å; V3167-F3575 HydrophobicContact CG1-CE2 3.6Å; V3167-F3575 HydrophobicContact CG1-CZ 3.9Å; V3167-F3575 HydrophobicContact CG2-CE1 4.02Å; V3167-F3575 HydrophobicContact CG2-CE2 4.46Å; V3167-F3575 HydrophobicContact CG2-CZ 3.94Å; V3167-F3575 WeakPolarHBondContact O-CB 3.24Å; I3170-F3575 HydrophobicContact CD1-CE2 4.35Å; I3170-F3575 HydrophobicContact CG1-CE2 4.37Å; I3572-F3575 HydrophobicContact CG2-CE1 4.44Å; F3575-I3577 HydrophobicContact CD2-CG1 3.98Å; F3575-I3577 HydrophobicContact CE2-CD1 3.69Å; F3575-I3577 HydrophobicContact CE2-CG1 3.64Å; F3575-I3577 HydrophobicContact CZ-CD1 4.21Å; F3575-I3599 HydrophobicContact CD1-CB 4.35Å; F3575-I3599 HydrophobicContact CD1-CG2 4.41Å; F3575-I3599 HydrophobicContact CE1-CB 4.31Å; F3575-I3599 HydrophobicContact CE1-CD1 4.01Å; F3575-I3599 HydrophobicContact CE1-CG2 4.16Å; F3575-I3599 HydrophobicContact CE2-CD1 4.19Å; F3575-I3599 HydrophobicContact CZ-CD1 3.71Å; F3575-I3599 PolarHBondContact N-O 2.99Å; F3575-I3599 PolarHBondContact O-N 2.81Å
3576	P	90.6	Very high	88.2	Confident	36 Å²	36	45.7 Å²	45.7	23%	0.234	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	139.6	176.5	33.4	-33.4	0	0	0	112.4	P3169 I3170 F3598	P3169-P3576 HydrophobicContact CB-CG 3.98Å; P3169-P3576 HydrophobicContact CG-CG 3.94Å; I3170-P3576 PolarHBondContact N-O 3.4Å; P3576-F3598 HydrophobicContact CB-CD2 4.44Å
3577	I	90.9	Very high	86.7	Confident	18 Å²	18	53.7 Å²	53.7	9%	0.092	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	128.2	167.9	-55.2	-173.3	0	0	0	109.1	I3170 L3172 F3575 L3579 L3597 I3599	I3170-I3577 HydrophobicContact CD1-CD1 4.01Å; I3170-I3577 HydrophobicContact CD1-CG1 4.18Å; I3170-I3577 HydrophobicContact CG1-CB 4.42Å; I3170-I3577 HydrophobicContact CG1-CD1 4.26Å; I3170-I3577 HydrophobicContact CG1-CG1 3.85Å; I3170-I3577 HydrophobicContact CG1-CG2 4.2Å; I3170-I3577 CarbonylContact O-C 3.59Å; I3170-I3577 WeakPolarHBondContact O-CA 3.28Å; L3172-I3577 HydrophobicContact CB-CG2 4.32Å; F3575-I3577 HydrophobicContact CD2-CG1 3.98Å; F3575-I3577 HydrophobicContact CE2-CD1 3.69Å; F3575-I3577 HydrophobicContact CE2-CG1 3.64Å; F3575-I3577 HydrophobicContact CZ-CD1 4.21Å; I3577-L3579 HydrophobicContact CG2-CD2 3.6Å; I3577-L3579 HydrophobicContact CG2-CG 3.89Å; I3577-L3579 PolarHBondContact O-N 2.82Å; I3577-L3597 PolarHBondContact N-O 3.1Å; I3577-L3597 PolarHBondContact O-N 3.41Å; I3577-I3599 HydrophobicContact CD1-CD1 3.49Å; I3577-I3599 VanDerWaalsContact CD1-CD1 3.49Å; I3577-I3599 HydrophobicContact CD1-CG1 4.41Å; I3577-I3599 HydrophobicContact CG1-CD1 4.17Å
3578	R	90	Very high	85.2	Confident	30 Å²	30	56.7 Å²	56.7	11%	0.113	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	97.9	169.2	-167.7	-178.1	-61.6	114	11.4	110	D3132 I3170 V3171 L3172 R3594 E3596	D3132-R3578 VanDerWaalsContact CG-NH1 3.29Å; D3132-R3578 IonicContact OD1-CZ 3.17Å; D3132-R3578 IonicContact OD1-NH1 2.72Å; D3132-R3578 PolarHBondContact OD1-NH1 3.15Å; D3132-R3578 IonicContact OD1-NH2 2.75Å; D3132-R3578 PolarHBondContact OD1-NH2 3.02Å; D3132-R3578 IonicContact OD2-CZ 3.65Å; D3132-R3578 IonicContact OD2-NH1 2.75Å; D3132-R3578 IonicContact OD2-NH2 2.75Å; D3132-R3578 PolarHBondContact OD2-NH2 2.66Å; I3170-R3578 PolarHBondContact O-N 2.87Å; V3171-R3578 HydrophobicContact CG1-CB 4.36Å; V3171-R3578 HydrophobicContact CG2-CB 4.38Å; L3172-R3578 PolarHBondContact N-O 3.05Å; R3578-R3594 HydrophobicContact CG-CB 4.24Å; R3578-E3596 HydrophobicContact CG-CG 4.32Å; R3578-E3596 IonicContact NE-OE1 3.43Å; R3578-E3596 IonicContact NH2-OE1 2.63Å
3579	L	89.8	Confident	83.7	Confident	29 Å²	29	60.9 Å²	60.9	15%	0.152	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	132.4	-179	-65.3	173.7	0	0	0	112.2	L3172 I3577 R3594 F3595 L3597 L3626	L3172-L3579 HydrophobicContact CB-CD2 4.13Å; L3172-L3579 HydrophobicContact CD2-CD2 3.88Å; L3172-L3579 HydrophobicContact CG-CD2 4.21Å; L3172-L3579 CarbonylContact O-C 3.53Å; L3172-L3579 WeakPolarHBondContact O-CA 3.37Å; I3577-L3579 HydrophobicContact CG2-CD2 3.6Å; I3577-L3579 HydrophobicContact CG2-CG 3.89Å; I3577-L3579 PolarHBondContact O-N 2.82Å; L3579-R3594 CarbonylContact O-C 3.58Å; L3579-R3594 PolarHBondContact O-N 3.1Å; L3579-F3595 HydrophobicContact CB-CB 4.47Å; L3579-F3595 WeakPolarHBondContact CB-O 3.47Å; L3579-F3595 HydrophobicContact CD1-CD1 4.38Å; L3579-F3595 PolarHBondContact N-O 3.49Å; L3579-F3595 PolarHBondContact O-N 3.27Å; L3579-L3597 HydrophobicContact CD1-CB 3.9Å; L3579-L3597 HydrophobicContact CD1-CD2 3.75Å; L3579-L3597 HydrophobicContact CD1-CG 4.47Å; L3579-L3597 HydrophobicContact CG-CB 4.43Å; L3579-L3626 HydrophobicContact CD1-CD1 3.77Å
3580	S	90.5	Very high	82.5	Confident	7 Å²	7	61.3 Å²	61.3	5%	0.049	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	135.9	158.3	-56.6	0	0	0	0	109.6	L3172 Q3173 M3174 V3592 R3594	L3172-S3580 PolarHBondContact O-N 2.88Å; Q3173-S3580 CarbonylContact C-O 3.51Å; Q3173-S3580 WeakPolarHBondContact CA-O 3.3Å; M3174-S3580 PolarHBondContact N-O 2.88Å; S3580-V3592 CarbonylContact C-O 3.54Å; S3580-V3592 VanDerWaalsContact CA-O 3.28Å; S3580-V3592 WeakPolarHBondContact CA-O 3.34Å; S3580-R3594 PolarHBondContact OG-N 2.78Å
3581	Y	89.1	Confident	81.6	Confident	77 Å²	77	63.9 Å²	63.9	30%	0.302	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	135	177.7	177.7	-97.3	0	0	0	110.8	M3174 K3176 V3592	M3174-Y3581 WeakPolarHBondContact O-CA 3.49Å; M3174-Y3581 VanDerWaalsContact O-CD2 3.26Å; M3174-Y3581 WeakPolarHBondContact O-CD2 3.4Å; K3176-Y3581 WeakPolarHBondContact CB-OH 3.39Å; K3176-Y3581 WeakPolarHBondContact CG-OH 3.45Å; Y3581-V3592 PolarHBondContact N-O 2.96Å; Y3581-V3592 PolarHBondContact O-N 2.86Å
3582	K	86	Confident	81	Confident	40 Å²	40	63.9 Å²	63.9	17%	0.174	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	127.8	176.8	-179.5	162.4	178.4	174.8	0	112.6	F3124 Y3125 M3174 K3176	F3124-K3582 HydrophobicContact CB-CD 3.84Å; F3124-K3582 HydrophobicContact CD1-CD 3.93Å; F3124-K3582 VanDerWaalsContact CD1-NZ 3.31Å; F3124-K3582 HydrophobicContact CD2-CD 4.05Å; F3124-K3582 VanDerWaalsContact CD2-NZ 3.28Å; F3124-K3582 HydrophobicContact CG-CD 3.63Å; Y3125-K3582 HydrophobicContact CE2-CB 3.76Å; M3174-K3582 PolarHBondContact O-N 3.16Å; M3174-K3582 VanDerWaalsContact O-N 3.16Å; K3176-K3582 PolarHBondContact N-O 2.98Å
3583	G	82	Confident	80.4	Confident	9 Å²	9	68.5 Å²	68.5	9%	0.093	35%	0.348	C	S	.	.			trans	-78.4	178.7	172.2	0	0	0	0	0	114.3	D3591	G3583-D3591 WeakPolarHBondContact CA-OD1 3.25Å; G3583-D3591 PolarHBondContact N-OD1 3.43Å
3584	E	74.1	Confident	79.9	Confident	121 Å²	121	76.3 Å²	76.3	57%	0.565	37%	0.373	S	S	*	.	S	Bend	trans	-87.4	-7.7	-171	-177.3	176	-145.7	0	0	113.8	K3176 R3180	K3176-E3584 HydrophobicContact CD-CB 4.03Å; K3176-E3584 IonicContact NZ-OE2 2.75Å; K3176-E3584 PolarHBondContact NZ-OE2 2.92Å; R3180-E3584 IonicContact CZ-OE1 3.16Å; R3180-E3584 IonicContact NH1-OE1 3.21Å; R3180-E3584 PolarHBondContact NH1-OE1 3.08Å; R3180-E3584 IonicContact NH1-OE2 3.46Å; R3180-E3584 IonicContact NH2-OE1 2.69Å
3585	K	70.4	Confident	79.6	Confident	150 Å²	150	76.3 Å²	76.3	65%	0.652	37%	0.366	S	S	*	.	S	Bend	trans	-115	142.3	-179.6	-65.8	-170	175.9	-170.6	0	110.2	K3587 N3588	K3585-K3587 PolarHBondContact O-N 2.77Å; K3585-N3588 HydrophobicContact CB-CB 4.49Å
3586	Q	61.2	Low	79.4	Confident	168 Å²	168	80.7 Å²	80.7	79%	0.785	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-13.2	-171.5	-151.9	72.8	-11.5	0	0	116.4
3587	K	61.3	Low	79.2	Confident	201 Å²	201	79.1 Å²	79.1	87%	0.874	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-151.1	71.3	178.9	-63.6	-174.2	-178.6	179.3	0	110.4	K3585	K3585-K3587 PolarHBondContact O-N 2.77Å
3588	N	60.5	Low	79.2	Confident	62 Å²	62	83.7 Å²	83.7	33%	0.332	40%	0.396	S	S	.	.			trans	-100.8	141.9	-173.6	-151.1	20.7	0	0	0	112.6	K3585 T3590 D3591	K3585-N3588 HydrophobicContact CB-CB 4.49Å; N3588-T3590 PolarHBondContact ND2-OG1 3.38Å; N3588-T3590 PolarHBondContact O-N 3.07Å; N3588-D3591 WeakPolarHBondContact CB-OD2 3.49Å; N3588-D3591 PolarHBondContact N-OD2 2.92Å; N3588-D3591 WeakPolarHBondContact O-CB 3.41Å; N3588-D3591 VanDerWaalsContact O-CG 3.27Å; N3588-D3591 PolarHBondContact O-N 2.85Å
3589	I	63.3	Low	79.2	Confident	146 Å²	146	82.4 Å²	82.4	75%	0.749	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-14.9	-179.7	-61.3	172	0	0	0	112.1	K3634	I3589-K3634 PolarHBondContact O-NZ 2.83Å
3590	T	70.2	Confident	79.2	Confident	63 Å²	63	83.3 Å²	83.3	39%	0.387	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-16.1	173	60.2	0	0	0	0	114.4	N3588 V3592	N3588-T3590 PolarHBondContact ND2-OG1 3.38Å; N3588-T3590 PolarHBondContact O-N 3.07Å; T3590-V3592 PolarHBondContact O-N 3.36Å
3591	D	77.3	Confident	79.3	Confident	55 Å²	55	86.2 Å²	86.2	29%	0.294	42%	0.417	S	S	.	.			trans	-75.2	124.8	-169.3	-58.5	-20.1	0	0	0	109.4	G3583 N3588	G3583-D3591 WeakPolarHBondContact CA-OD1 3.25Å; G3583-D3591 PolarHBondContact N-OD1 3.43Å; N3588-D3591 WeakPolarHBondContact CB-OD2 3.49Å; N3588-D3591 PolarHBondContact N-OD2 2.92Å; N3588-D3591 WeakPolarHBondContact O-CB 3.41Å; N3588-D3591 VanDerWaalsContact O-CG 3.27Å; N3588-D3591 PolarHBondContact O-N 2.85Å
3592	V	81.5	Confident	79.6	Confident	38 Å²	38	83.2 Å²	83.2	23%	0.23	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	126.3	-169.8	170.9	0	0	0	0	107.8	S3580 Y3581 T3590 F3595	S3580-V3592 CarbonylContact C-O 3.54Å; S3580-V3592 VanDerWaalsContact CA-O 3.28Å; S3580-V3592 WeakPolarHBondContact CA-O 3.34Å; Y3581-V3592 PolarHBondContact N-O 2.96Å; Y3581-V3592 PolarHBondContact O-N 2.86Å; T3590-V3592 PolarHBondContact O-N 3.36Å; V3592-F3595 HydrophobicContact CG1-CB 3.32Å; V3592-F3595 HydrophobicContact CG1-CD2 4.33Å; V3592-F3595 HydrophobicContact CG1-CG 4.06Å
3593	T	83.8	Confident	80	Confident	108 Å²	108	85.7 Å²	85.7	66%	0.663	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.9	132.1	-179	47.8	0	0	0	0	110.4	F3595	T3593-F3595 PolarHBondContact O-N 2.84Å; T3593-F3595 VanDerWaalsContact O-N 3.09Å
3594	R	83.7	Confident	80.6	Confident	199 Å²	199	85.8 Å²	85.8	75%	0.751	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	48.3	38.1	176.5	-58.7	-178.4	180	171.3	-1.7	113.9	R3578 L3579 S3580 E3596	R3578-R3594 HydrophobicContact CG-CB 4.24Å; L3579-R3594 CarbonylContact O-C 3.58Å; L3579-R3594 PolarHBondContact O-N 3.1Å; S3580-R3594 PolarHBondContact OG-N 2.78Å; R3594-E3596 PolarHBondContact O-N 3Å
3595	F	85.5	Confident	81.6	Confident	24 Å²	24	85.4 Å²	85.4	11%	0.105	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	107.8	174.6	179.6	-80.8	0	0	0	109.5	L3579 V3592 T3593 L3597 E3629 V3630 K3633	L3579-F3595 HydrophobicContact CB-CB 4.47Å; L3579-F3595 WeakPolarHBondContact CB-O 3.47Å; L3579-F3595 HydrophobicContact CD1-CD1 4.38Å; L3579-F3595 PolarHBondContact N-O 3.49Å; L3579-F3595 PolarHBondContact O-N 3.27Å; V3592-F3595 HydrophobicContact CG1-CB 3.32Å; V3592-F3595 HydrophobicContact CG1-CD2 4.33Å; V3592-F3595 HydrophobicContact CG1-CG 4.06Å; T3593-F3595 PolarHBondContact O-N 2.84Å; T3593-F3595 VanDerWaalsContact O-N 3.09Å; F3595-L3597 HydrophobicContact CD1-CB 4.11Å; F3595-L3597 HydrophobicContact CE1-CB 3.93Å; F3595-L3597 HydrophobicContact CE1-CD1 4.31Å; F3595-L3597 PolarHBondContact O-N 2.93Å; F3595-E3629 HydrophobicContact CE1-CB 4.34Å; F3595-E3629 HydrophobicContact CZ-CB 3.82Å; F3595-V3630 HydrophobicContact CE1-CG2 4.31Å; F3595-V3630 HydrophobicContact CE2-CG2 3.77Å; F3595-V3630 HydrophobicContact CZ-CG2 3.64Å; F3595-K3633 HydrophobicContact CD2-CD 4.02Å; F3595-K3633 HydrophobicContact CE2-CB 4.38Å; F3595-K3633 HydrophobicContact CE2-CD 3.54Å; F3595-K3633 HydrophobicContact CE2-CG 4.26Å; F3595-K3633 HydrophobicContact CZ-CD 4.19Å
3596	E	86.5	Confident	82.7	Confident	114 Å²	114	84.1 Å²	84.1	53%	0.533	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	115.1	170.9	-63.5	179.5	161.7	0	0	109.5	R3578 R3594 K3633	R3578-E3596 HydrophobicContact CG-CG 4.32Å; R3578-E3596 IonicContact NE-OE1 3.43Å; R3578-E3596 IonicContact NH2-OE1 2.63Å; R3594-E3596 PolarHBondContact O-N 3Å; E3596-K3633 PolarHBondContact O-NZ 2.87Å
3597	L	86.7	Confident	84.2	Confident	3 Å²	3	77.3 Å²	77.3	2%	0.016	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	120.8	170.3	174.5	63.7	0	0	0	107.7	I3577 L3579 F3595 I3599 Q3625 L3626 E3629	I3577-L3597 PolarHBondContact N-O 3.1Å; I3577-L3597 PolarHBondContact O-N 3.41Å; L3579-L3597 HydrophobicContact CD1-CB 3.9Å; L3579-L3597 HydrophobicContact CD1-CD2 3.75Å; L3579-L3597 HydrophobicContact CD1-CG 4.47Å; L3579-L3597 HydrophobicContact CG-CB 4.43Å; F3595-L3597 HydrophobicContact CD1-CB 4.11Å; F3595-L3597 HydrophobicContact CE1-CB 3.93Å; F3595-L3597 HydrophobicContact CE1-CD1 4.31Å; F3595-L3597 PolarHBondContact O-N 2.93Å; L3597-I3599 HydrophobicContact CD2-CG1 4.43Å; L3597-Q3625 HydrophobicContact CD1-CG 4.19Å; L3597-L3626 HydrophobicContact CD1-CB 4.44Å; L3597-L3626 HydrophobicContact CD2-CB 4.08Å; L3597-L3626 HydrophobicContact CD2-CD1 4.23Å; L3597-L3626 HydrophobicContact CD2-CG 4.37Å; L3597-E3629 HydrophobicContact CD1-CB 4.33Å; L3597-E3629 HydrophobicContact CD1-CG 4.13Å
3598	F	89.2	Confident	85.7	Confident	113 Å²	113	71.9 Å²	71.9	50%	0.496	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	122	164.4	-170.5	-105.9	0	0	0	109.1	P3576	P3576-F3598 HydrophobicContact CB-CD2 4.44Å
3599	I	89.8	Confident	87.1	Confident	4 Å²	4	71.4 Å²	71.4	2%	0.021	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	119.5	166.9	-69.5	177.7	0	0	0	106.6	G3574 F3575 I3577 L3597 I3622	G3574-I3599 CarbonylContact C-O 3.5Å; G3574-I3599 WeakPolarHBondContact CA-O 3.45Å; F3575-I3599 HydrophobicContact CD1-CB 4.35Å; F3575-I3599 HydrophobicContact CD1-CG2 4.41Å; F3575-I3599 HydrophobicContact CE1-CB 4.31Å; F3575-I3599 HydrophobicContact CE1-CD1 4.01Å; F3575-I3599 HydrophobicContact CE1-CG2 4.16Å; F3575-I3599 HydrophobicContact CE2-CD1 4.19Å; F3575-I3599 HydrophobicContact CZ-CD1 3.71Å; F3575-I3599 PolarHBondContact N-O 2.99Å; F3575-I3599 PolarHBondContact O-N 2.81Å; I3577-I3599 HydrophobicContact CD1-CD1 3.49Å; I3577-I3599 VanDerWaalsContact CD1-CD1 3.49Å; I3577-I3599 HydrophobicContact CD1-CG1 4.41Å; I3577-I3599 HydrophobicContact CG1-CD1 4.17Å; L3597-I3599 HydrophobicContact CD2-CG1 4.43Å; I3599-I3622 HydrophobicContact CD1-CD1 3.98Å; I3599-I3622 HydrophobicContact CD1-CG1 4.01Å; I3599-I3622 HydrophobicContact CD1-CG2 4.18Å; I3599-I3622 HydrophobicContact CG1-CG1 4.48Å
3600	P	91.2	Very high	88.4	Confident	48 Å²	48	65.7 Å²	65.7	31%	0.312	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-68.8	158.4	173.2	31.6	-36.5	0	0	0	110.1	L3602 Q3625	P3600-L3602 PolarHBondContact O-N 3.11Å; P3600-Q3625 HydrophobicContact CG-CG 4.41Å
3601	T	93.2	Very high	89	Confident	68 Å²	68	67.8 Å²	67.8	42%	0.417	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-51.9	130.2	171.4	-55.7	0	0	0	0	110.5	I3572 G3574 E3603	I3572-T3601 CarbonylContact O-C 3.57Å; I3572-T3601 VanDerWaalsContact O-CA 3.24Å; I3572-T3601 WeakPolarHBondContact O-CA 3.47Å; G3574-T3601 PolarHBondContact N-OG1 3.45Å; G3574-T3601 VanDerWaalsContact N-OG1 3.12Å; T3601-E3603 HydrophobicContact CG2-CG 4.04Å; T3601-E3603 VanDerWaalsContact CG2-OE1 3.28Å; T3601-E3603 WeakPolarHBondContact CG2-OE1 3.49Å
3602	L	93.7	Very high	89.3	Confident	14 Å²	14	68 Å²	68	7%	0.073	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	114.9	175.5	-55.3	179	0	0	0	108.8	K3571 I3572 P3600 Y3604 V3618 R3621	K3571-L3602 CarbonylContact C-O 3.53Å; K3571-L3602 WeakPolarHBondContact CA-O 3.33Å; I3572-L3602 HydrophobicContact CB-CB 4.15Å; I3572-L3602 HydrophobicContact CD1-CB 4.45Å; I3572-L3602 HydrophobicContact CD1-CD1 4.39Å; I3572-L3602 HydrophobicContact CG1-CB 4.39Å; I3572-L3602 PolarHBondContact N-O 3.19Å; I3572-L3602 PolarHBondContact O-N 3.36Å; P3600-L3602 PolarHBondContact O-N 3.11Å; L3602-Y3604 HydrophobicContact CB-CE2 4.09Å; L3602-V3618 HydrophobicContact CD1-CG1 4.18Å; L3602-R3621 HydrophobicContact CD1-CB 4.22Å; L3602-R3621 HydrophobicContact CD2-CB 3.96Å; L3602-R3621 HydrophobicContact CD2-CG 4.31Å
3603	E	95	Very high	89.8	Confident	91 Å²	91	69.8 Å²	69.8	43%	0.425	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	137.7	176.6	-78.2	157.9	-171.2	0	0	110	Y3569 I3570 K3571 T3601	Y3569-E3603 HydrophobicContact CE2-CB 4.41Å; Y3569-E3603 HydrophobicContact CE2-CG 4.09Å; I3570-E3603 VanDerWaalsContact O-CA 3.31Å; I3570-E3603 WeakPolarHBondContact O-CA 3.46Å; K3571-E3603 HydrophobicContact CB-CG 4.27Å; K3571-E3603 HydrophobicContact CG-CG 3.95Å; T3601-E3603 HydrophobicContact CG2-CG 4.04Å; T3601-E3603 VanDerWaalsContact CG2-OE1 3.28Å; T3601-E3603 WeakPolarHBondContact CG2-OE1 3.49Å
3604	Y	94.5	Very high	90.2	Very high	11 Å²	11	65.2 Å²	65.2	4%	0.043	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	141.9	179.3	-53.7	-78.4	0	0	0	109.4	Y3569 I3570 L3602 W3609 F3614 E3617 V3618 R3621	Y3569-Y3604 WeakPolarHBondContact CA-O 3.43Å; I3570-Y3604 HydrophobicContact CB-CD2 4.17Å; I3570-Y3604 HydrophobicContact CG2-CD2 4.44Å; I3570-Y3604 PolarHBondContact N-O 3.1Å; I3570-Y3604 PolarHBondContact O-N 2.96Å; L3602-Y3604 HydrophobicContact CB-CE2 4.09Å; Y3604-W3609 AromaticContact CD1-CH2 3.61Å; Y3604-W3609 HydrophobicContact CD1-CH2 3.61Å; Y3604-W3609 HydrophobicContact CD1-CZ3 4.17Å; Y3604-W3609 HydrophobicContact CD2-CZ3 4.36Å; Y3604-W3609 AromaticContact CE1-CH2 3.99Å; Y3604-W3609 HydrophobicContact CE1-CH2 3.99Å; Y3604-W3609 AromaticContact CG-CH2 3.92Å; Y3604-W3609 HydrophobicContact CG-CH2 3.92Å; Y3604-W3609 HydrophobicContact CG-CZ3 4.01Å; Y3604-F3614 HydrophobicContact CD2-CE2 4.37Å; Y3604-F3614 HydrophobicContact CE2-CE2 4.22Å; Y3604-E3617 HydrophobicContact CE1-CG 3.93Å; Y3604-V3618 HydrophobicContact CE2-CG2 3.98Å; Y3604-R3621 WeakPolarHBondContact OH-CG 3.42Å
3605	H	94.4	Very high	90.4	Very high	114 Å²	114	59.5 Å²	59.5	53%	0.528	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	145	-178.1	-56	-89.9	0	0	0	111.1	L3568 Y3569 C3607	L3568-H3605 CarbonylContact O-C 3.58Å; L3568-H3605 VanDerWaalsContact O-CA 3.23Å; L3568-H3605 WeakPolarHBondContact O-CA 3.42Å; Y3569-H3605 AromaticContact CD2-CE1 3.34Å; Y3569-H3605 WeakPolarHBondContact CD2-CE1 3.21Å; Y3569-H3605 AromaticContact CD2-ND1 3.48Å; Y3569-H3605 WeakPolarHBondContact CD2-ND1 3.42Å; Y3569-H3605 AromaticContact CE2-CE1 3.39Å; Y3569-H3605 WeakPolarHBondContact CE2-CE1 3.4Å; H3605-C3607 VanDerWaalsContact C-N 3.26Å; H3605-C3607 PolarHBondContact O-N 2.99Å; H3605-C3607 VanDerWaalsContact O-N 3.15Å; H3605-C3607 PolarHBondContact O-SG 2.91Å
3606	N	93.7	Very high	90.5	Very high	122 Å²	122	61.6 Å²	61.6	65%	0.652	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	46.5	44.5	172.6	-61.7	-36.3	0	0	0	114.2	F3567 L3568	F3567-N3606 CarbonylContact O-C 3.52Å; F3567-N3606 VanDerWaalsContact O-CA 3.29Å; F3567-N3606 WeakPolarHBondContact O-CA 3.17Å; F3567-N3606 PolarHBondContact O-N 2.79Å; F3567-N3606 VanDerWaalsContact O-N 3.07Å; L3568-N3606 PolarHBondContact O-N 3.47Å
3607	C	92.5	Very high	90.7	Very high	25 Å²	25	58.5 Å²	58.5	17%	0.169	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	130.3	-177.1	-69.5	0	0	0	0	111	F3567 H3605 W3609	F3567-C3607 PolarHBondContact N-O 2.74Å; F3567-C3607 PolarHBondContact O-N 3.26Å; H3605-C3607 VanDerWaalsContact C-N 3.26Å; H3605-C3607 PolarHBondContact O-N 2.99Å; H3605-C3607 VanDerWaalsContact O-N 3.15Å; H3605-C3607 PolarHBondContact O-SG 2.91Å; C3607-W3609 HydrophobicContact CB-CD2 3.73Å; C3607-W3609 HydrophobicContact CB-CE3 3.7Å; C3607-W3609 HydrophobicContact CB-CG 4.39Å; C3607-W3609 HydrophobicContact CB-CH2 3.98Å; C3607-W3609 HydrophobicContact CB-CZ2 3.99Å; C3607-W3609 HydrophobicContact CB-CZ3 3.83Å; C3607-W3609 VanDerWaalsContact SG-CH2 3.6Å
3608	V	92.8	Very high	90.9	Very high	88 Å²	88	59.3 Å²	59.3	53%	0.533	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	109.7	171.5	-172.9	0	0	0	0	109	N3564 K3565 V3566	N3564-V3608 HydrophobicContact CB-CG1 4.31Å; K3565-V3608 WeakPolarHBondContact O-CA 3.4Å; V3566-V3608 HydrophobicContact CG2-CG2 4.25Å
3609	W	91.2	Very high	90.9	Very high	52 Å²	52	58.8 Å²	58.8	20%	0.197	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	152.7	-168.5	-76.3	-23.7	0	0	0	112.5	K3565 F3567 I3570 Y3604 C3607 D3613 F3614 E3617	K3565-W3609 PolarHBondContact N-O 2.91Å; K3565-W3609 PolarHBondContact O-N 3.26Å; F3567-W3609 HydrophobicContact CD2-CB 4.3Å; F3567-W3609 HydrophobicContact CE2-CB 4.09Å; I3570-W3609 HydrophobicContact CD1-CE3 4.43Å; I3570-W3609 HydrophobicContact CD1-CZ3 4.24Å; Y3604-W3609 AromaticContact CD1-CH2 3.61Å; Y3604-W3609 HydrophobicContact CD1-CH2 3.61Å; Y3604-W3609 HydrophobicContact CD1-CZ3 4.17Å; Y3604-W3609 HydrophobicContact CD2-CZ3 4.36Å; Y3604-W3609 AromaticContact CE1-CH2 3.99Å; Y3604-W3609 HydrophobicContact CE1-CH2 3.99Å; Y3604-W3609 AromaticContact CG-CH2 3.92Å; Y3604-W3609 HydrophobicContact CG-CH2 3.92Å; Y3604-W3609 HydrophobicContact CG-CZ3 4.01Å; C3607-W3609 HydrophobicContact CB-CD2 3.73Å; C3607-W3609 HydrophobicContact CB-CE3 3.7Å; C3607-W3609 HydrophobicContact CB-CG 4.39Å; C3607-W3609 HydrophobicContact CB-CH2 3.98Å; C3607-W3609 HydrophobicContact CB-CZ2 3.99Å; C3607-W3609 HydrophobicContact CB-CZ3 3.83Å; C3607-W3609 VanDerWaalsContact SG-CH2 3.6Å; W3609-D3613 HydrophobicContact CB-CB 4Å; W3609-D3613 HydrophobicContact CG-CB 3.97Å; W3609-F3614 HydrophobicContact CE3-CB 4.03Å; W3609-F3614 HydrophobicContact CE3-CD2 4.09Å; W3609-F3614 AromaticContact CZ3-CD2 3.97Å; W3609-F3614 HydrophobicContact CZ3-CD2 3.97Å; W3609-E3617 HydrophobicContact CH2-CG 4.27Å; W3609-E3617 HydrophobicContact CZ2-CG 4.4Å
3610	T	89.1	Confident	90.9	Very high	26 Å²	26	60.4 Å²	60.4	16%	0.16	31%	0.31	C	S	.	.			trans	-78	165.2	156.7	71	0	0	0	0	110.2	L3612 D3613 F3614	T3610-L3612 PolarHBondContact O-N 2.75Å; T3610-L3612 PolarHBondContact OG1-N 3.32Å; T3610-D3613 WeakPolarHBondContact CB-OD2 3.38Å; T3610-D3613 WeakPolarHBondContact CG2-OD2 3.43Å; T3610-D3613 PolarHBondContact N-OD2 2.87Å; T3610-D3613 PolarHBondContact O-N 2.87Å; T3610-D3613 VanDerWaalsContact OG1-CG 3.3Å; T3610-D3613 PolarHBondContact OG1-N 2.89Å; T3610-D3613 PolarHBondContact OG1-OD2 2.67Å; T3610-F3614 PolarHBondContact O-N 2.86Å
3611	W	83.9	Confident	90.8	Very high	106 Å²	106	63 Å²	63	40%	0.402	31%	0.314	S	S	.	.	H	α-helix	trans	-58.5	-32.5	172.1	-78.1	134.4	0	0	0	112.6	M3163 K3565 F3567 F3614 V3615	M3163-W3611 HydrophobicContact CE-CH2 3.78Å; M3163-W3611 HydrophobicContact CE-CZ3 3.86Å; M3163-W3611 HydrophobicContact SD-CH2 3.99Å; M3163-W3611 HydrophobicContact SD-CZ3 3.94Å; K3565-W3611 HydrophobicContact CD-CZ2 4.34Å; F3567-W3611 HydrophobicContact CE1-CE3 4.37Å; F3567-W3611 AromaticContact CE1-CH2 3.89Å; F3567-W3611 HydrophobicContact CE1-CH2 3.89Å; F3567-W3611 AromaticContact CE1-CZ3 3.67Å; F3567-W3611 HydrophobicContact CE1-CZ3 3.67Å; F3567-W3611 HydrophobicContact CZ-CD2 4.5Å; F3567-W3611 AromaticContact CZ-CE3 3.88Å; F3567-W3611 HydrophobicContact CZ-CE3 3.88Å; F3567-W3611 HydrophobicContact CZ-CH2 4.09Å; F3567-W3611 AromaticContact CZ-CZ3 3.65Å; F3567-W3611 HydrophobicContact CZ-CZ3 3.65Å; W3611-F3614 HydrophobicContact CE3-CD1 4.04Å; W3611-F3614 HydrophobicContact CZ3-CD1 4.15Å; W3611-F3614 HydrophobicContact CZ3-CE1 4.47Å; W3611-V3615 VanDerWaalsContact O-CG2 3.31Å; W3611-V3615 WeakPolarHBondContact O-CG2 3.36Å; W3611-V3615 PolarHBondContact O-N 2.86Å; W3611-V3615 VanDerWaalsContact O-N 3.12Å
3612	L	84.4	Confident	90.5	Very high	60 Å²	60	62.3 Å²	62.3	31%	0.314	31%	0.307	S	S	.	.	H	α-helix	trans	-67.8	-43.4	175.8	179.7	63.6	0	0	0	111.7	Y3516 T3610 F3614 V3615 M3616	Y3516-L3612 HydrophobicContact CD1-CD2 3.43Å; Y3516-L3612 VanDerWaalsContact CD1-CD2 3.43Å; Y3516-L3612 HydrophobicContact CE1-CB 3.84Å; Y3516-L3612 HydrophobicContact CE1-CD2 3.4Å; Y3516-L3612 HydrophobicContact CE1-CG 4.2Å; Y3516-L3612 HydrophobicContact CG-CD2 4.16Å; T3610-L3612 PolarHBondContact O-N 2.75Å; T3610-L3612 PolarHBondContact OG1-N 3.32Å; L3612-F3614 VanDerWaalsContact C-N 3.34Å; L3612-F3614 PolarHBondContact O-N 2.7Å; L3612-V3615 PolarHBondContact O-N 2.96Å; L3612-M3616 HydrophobicContact CD1-CG 3.69Å; L3612-M3616 HydrophobicContact CD1-SD 4.48Å; L3612-M3616 HydrophobicContact CG-CG 4.02Å; L3612-M3616 VanDerWaalsContact O-CB 3.26Å; L3612-M3616 WeakPolarHBondContact O-CB 3.44Å; L3612-M3616 WeakPolarHBondContact O-CG 3.39Å; L3612-M3616 PolarHBondContact O-N 2.74Å
3613	D	91.5	Very high	90.1	Very high	75 Å²	75	68.4 Å²	68.4	40%	0.401	33%	0.329	S	S	.	.	H	α-helix	trans	-60.8	-45.1	-180	-62.4	-60	0	0	0	111.2	W3609 T3610 M3616 E3617	W3609-D3613 HydrophobicContact CB-CB 4Å; W3609-D3613 HydrophobicContact CG-CB 3.97Å; T3610-D3613 WeakPolarHBondContact CB-OD2 3.38Å; T3610-D3613 WeakPolarHBondContact CG2-OD2 3.43Å; T3610-D3613 PolarHBondContact N-OD2 2.87Å; T3610-D3613 PolarHBondContact O-N 2.87Å; T3610-D3613 VanDerWaalsContact OG1-CG 3.3Å; T3610-D3613 PolarHBondContact OG1-N 2.89Å; T3610-D3613 PolarHBondContact OG1-OD2 2.67Å; D3613-M3616 PolarHBondContact O-N 3.1Å; D3613-E3617 PolarHBondContact O-N 3.38Å
3614	F	90.9	Very high	89.8	Confident	13 Å²	13	70 Å²	70	6%	0.057	34%	0.335	C	S	.	.	H	α-helix	trans	-56.8	-53.5	174.1	169.8	-115.7	0	0	0	112	I3165 I3570 I3572 Y3604 W3609 T3610 W3611 L3612 M3616 E3617 V3618	I3165-F3614 HydrophobicContact CD1-CE1 4.03Å; I3165-F3614 HydrophobicContact CD1-CZ 3.78Å; I3570-F3614 HydrophobicContact CD1-CD2 3.65Å; I3570-F3614 HydrophobicContact CD1-CE2 3.6Å; I3570-F3614 HydrophobicContact CD1-CZ 4.4Å; I3570-F3614 HydrophobicContact CG2-CE2 3.85Å; I3570-F3614 HydrophobicContact CG2-CZ 4.05Å; I3572-F3614 HydrophobicContact CD1-CZ 4.18Å; Y3604-F3614 HydrophobicContact CD2-CE2 4.37Å; Y3604-F3614 HydrophobicContact CE2-CE2 4.22Å; W3609-F3614 HydrophobicContact CE3-CB 4.03Å; W3609-F3614 HydrophobicContact CE3-CD2 4.09Å; W3609-F3614 AromaticContact CZ3-CD2 3.97Å; W3609-F3614 HydrophobicContact CZ3-CD2 3.97Å; T3610-F3614 PolarHBondContact O-N 2.86Å; W3611-F3614 HydrophobicContact CE3-CD1 4.04Å; W3611-F3614 HydrophobicContact CZ3-CD1 4.15Å; W3611-F3614 HydrophobicContact CZ3-CE1 4.47Å; L3612-F3614 VanDerWaalsContact C-N 3.34Å; L3612-F3614 PolarHBondContact O-N 2.7Å; F3614-M3616 VanDerWaalsContact C-N 3.27Å; F3614-M3616 PolarHBondContact O-N 2.59Å; F3614-E3617 PolarHBondContact O-N 3.4Å; F3614-V3618 HydrophobicContact CD2-CG2 4.06Å; F3614-V3618 HydrophobicContact CE2-CG2 3.6Å; F3614-V3618 HydrophobicContact CZ-CG2 3.93Å; F3614-V3618 WeakPolarHBondContact O-CG2 3.16Å; F3614-V3618 PolarHBondContact O-N 3.45Å
3615	V	88.8	Confident	89.2	Confident	78 Å²	78	71 Å²	71	47%	0.473	34%	0.34	S	S	.	.	H	α-helix	trans	-60.3	-37.7	178.4	169	0	0	0	0	111.4	W3611 L3612 K3619	W3611-V3615 VanDerWaalsContact O-CG2 3.31Å; W3611-V3615 WeakPolarHBondContact O-CG2 3.36Å; W3611-V3615 PolarHBondContact O-N 2.86Å; W3611-V3615 VanDerWaalsContact O-N 3.12Å; L3612-V3615 PolarHBondContact O-N 2.96Å; V3615-K3619 WeakPolarHBondContact O-CB 3.3Å; V3615-K3619 PolarHBondContact O-N 3.22Å
3616	M	86.9	Confident	88.7	Confident	69 Å²	69	68.6 Å²	68.6	34%	0.34	33%	0.331	S	S	.	.	H	α-helix	trans	-74.2	-32.5	-179.6	-73.6	-68.5	-70.2	0	0	113.3	L3612 D3613 F3614 K3619 T3620	L3612-M3616 HydrophobicContact CD1-CG 3.69Å; L3612-M3616 HydrophobicContact CD1-SD 4.48Å; L3612-M3616 HydrophobicContact CG-CG 4.02Å; L3612-M3616 VanDerWaalsContact O-CB 3.26Å; L3612-M3616 WeakPolarHBondContact O-CB 3.44Å; L3612-M3616 WeakPolarHBondContact O-CG 3.39Å; L3612-M3616 PolarHBondContact O-N 2.74Å; D3613-M3616 PolarHBondContact O-N 3.1Å; F3614-M3616 VanDerWaalsContact C-N 3.27Å; F3614-M3616 PolarHBondContact O-N 2.59Å; M3616-K3619 HydrophobicContact SD-CD 3.68Å; M3616-T3620 VanDerWaalsContact O-CB 3.26Å; M3616-T3620 WeakPolarHBondContact O-CB 3.44Å; M3616-T3620 PolarHBondContact O-N 3.46Å; M3616-T3620 PolarHBondContact O-OG1 3.03Å
3617	E	91.2	Very high	88.1	Confident	48 Å²	48	66.2 Å²	66.2	22%	0.224	32%	0.32	C	S	.	.	H	α-helix	trans	-72.6	-44.5	171.7	179.4	59.2	-177.3	0	0	111.1	Y3604 W3609 D3613 F3614 K3619 T3620 R3621	Y3604-E3617 HydrophobicContact CE1-CG 3.93Å; W3609-E3617 HydrophobicContact CH2-CG 4.27Å; W3609-E3617 HydrophobicContact CZ2-CG 4.4Å; D3613-E3617 PolarHBondContact O-N 3.38Å; F3614-E3617 PolarHBondContact O-N 3.4Å; E3617-K3619 PolarHBondContact O-N 3.22Å; E3617-T3620 CarbonylContact O-C 3.57Å; E3617-T3620 WeakPolarHBondContact O-CA 3.32Å; E3617-T3620 WeakPolarHBondContact O-CB 3.19Å; E3617-T3620 PolarHBondContact O-N 3.15Å; E3617-R3621 WeakPolarHBondContact O-CG 3.34Å; E3617-R3621 PolarHBondContact O-N 2.75Å; E3617-R3621 IonicContact OE1-CZ 2.73Å; E3617-R3621 IonicContact OE1-NE 3.42Å; E3617-R3621 PolarHBondContact OE1-NE 3.19Å; E3617-R3621 IonicContact OE1-NH2 2.92Å; E3617-R3621 PolarHBondContact OE1-NH2 2.94Å
3618	V	90.1	Very high	87.7	Confident	21 Å²	21	72.3 Å²	72.3	13%	0.127	34%	0.34	C	S	.	.	H	α-helix	trans	-56.5	-49.6	173.1	170.5	0	0	0	0	111.1	I3572 L3602 Y3604 F3614 T3620 R3621 I3622	I3572-V3618 HydrophobicContact CD1-CG1 4.38Å; I3572-V3618 HydrophobicContact CD1-CG2 3.97Å; L3602-V3618 HydrophobicContact CD1-CG1 4.18Å; Y3604-V3618 HydrophobicContact CE2-CG2 3.98Å; F3614-V3618 HydrophobicContact CD2-CG2 4.06Å; F3614-V3618 HydrophobicContact CE2-CG2 3.6Å; F3614-V3618 HydrophobicContact CZ-CG2 3.93Å; F3614-V3618 WeakPolarHBondContact O-CG2 3.16Å; F3614-V3618 PolarHBondContact O-N 3.45Å; V3618-T3620 PolarHBondContact O-N 2.88Å; V3618-R3621 PolarHBondContact O-N 3.33Å; V3618-R3621 VanDerWaalsContact O-N 3.16Å; V3618-I3622 HydrophobicContact CG1-CD1 3.75Å; V3618-I3622 HydrophobicContact CG1-CG1 4.44Å; V3618-I3622 WeakPolarHBondContact O-CG1 3.19Å; V3618-I3622 PolarHBondContact O-N 3.38Å
3619	K	89.7	Confident	87.1	Confident	101 Å²	101	69.7 Å²	69.7	44%	0.439	32%	0.322	S	S	.	.	H	α-helix	trans	-56.3	-34.6	172.8	-179.6	179.7	-177.2	176	0	112.5	V3615 M3616 E3617 R3623	V3615-K3619 WeakPolarHBondContact O-CB 3.3Å; V3615-K3619 PolarHBondContact O-N 3.22Å; M3616-K3619 HydrophobicContact SD-CD 3.68Å; E3617-K3619 PolarHBondContact O-N 3.22Å; K3619-R3623 VanDerWaalsContact O-CB 3.22Å; K3619-R3623 WeakPolarHBondContact O-CB 3.26Å; K3619-R3623 PolarHBondContact O-N 3.14Å
3620	T	90.5	Very high	86.4	Confident	38 Å²	38	69.2 Å²	69.2	23%	0.233	32%	0.324	C	S	.	.	H	α-helix	trans	-75.5	-38.8	177.1	-64.7	0	0	0	0	112.3	M3616 E3617 V3618 K3624	M3616-T3620 VanDerWaalsContact O-CB 3.26Å; M3616-T3620 WeakPolarHBondContact O-CB 3.44Å; M3616-T3620 PolarHBondContact O-N 3.46Å; M3616-T3620 PolarHBondContact O-OG1 3.03Å; E3617-T3620 CarbonylContact O-C 3.57Å; E3617-T3620 WeakPolarHBondContact O-CA 3.32Å; E3617-T3620 WeakPolarHBondContact O-CB 3.19Å; E3617-T3620 PolarHBondContact O-N 3.15Å; V3618-T3620 PolarHBondContact O-N 2.88Å; T3620-K3624 HydrophobicContact CG2-CD 4.26Å; T3620-K3624 WeakPolarHBondContact O-CB 3.36Å; T3620-K3624 VanDerWaalsContact O-CG 3.28Å; T3620-K3624 WeakPolarHBondContact O-CG 3.14Å; T3620-K3624 PolarHBondContact O-N 3.07Å
3621	R	88.5	Confident	85.8	Confident	104 Å²	104	71.1 Å²	71.1	39%	0.392	33%	0.333	S	S	.	.	H	α-helix	trans	-64	-50.3	172.5	-65.5	-65.4	173.1	106.5	10	111.5	L3602 Y3604 E3617 V3618 R3623 K3624 Q3625	L3602-R3621 HydrophobicContact CD1-CB 4.22Å; L3602-R3621 HydrophobicContact CD2-CB 3.96Å; L3602-R3621 HydrophobicContact CD2-CG 4.31Å; Y3604-R3621 WeakPolarHBondContact OH-CG 3.42Å; E3617-R3621 WeakPolarHBondContact O-CG 3.34Å; E3617-R3621 PolarHBondContact O-N 2.75Å; E3617-R3621 IonicContact OE1-CZ 2.73Å; E3617-R3621 IonicContact OE1-NE 3.42Å; E3617-R3621 PolarHBondContact OE1-NE 3.19Å; E3617-R3621 IonicContact OE1-NH2 2.92Å; E3617-R3621 PolarHBondContact OE1-NH2 2.94Å; V3618-R3621 PolarHBondContact O-N 3.33Å; V3618-R3621 VanDerWaalsContact O-N 3.16Å; R3621-R3623 VanDerWaalsContact C-N 3.31Å; R3621-R3623 PolarHBondContact O-N 3.41Å; R3621-K3624 PolarHBondContact O-N 3.36Å; R3621-K3624 VanDerWaalsContact O-N 3.14Å; R3621-Q3625 PolarHBondContact O-N 3.2Å
3622	I	86.6	Confident	85.5	Confident	52 Å²	52	70.9 Å²	70.9	27%	0.267	34%	0.335	S	S	.	.	H	α-helix	trans	-58.9	-43.4	177.7	-64.9	170.3	0	0	0	110.4	I3599 V3618 Q3625 L3626	I3599-I3622 HydrophobicContact CD1-CD1 3.98Å; I3599-I3622 HydrophobicContact CD1-CG1 4.01Å; I3599-I3622 HydrophobicContact CD1-CG2 4.18Å; I3599-I3622 HydrophobicContact CG1-CG1 4.48Å; V3618-I3622 HydrophobicContact CG1-CD1 3.75Å; V3618-I3622 HydrophobicContact CG1-CG1 4.44Å; V3618-I3622 WeakPolarHBondContact O-CG1 3.19Å; V3618-I3622 PolarHBondContact O-N 3.38Å; I3622-Q3625 PolarHBondContact O-N 3.33Å; I3622-L3626 WeakPolarHBondContact O-CB 3.34Å; I3622-L3626 PolarHBondContact O-N 2.82Å
3623	R	86.1	Confident	84.8	Confident	142 Å²	142	73.2 Å²	73.2	54%	0.536	34%	0.342	S	S	.	.	H	α-helix	trans	-61.5	-45.5	174.6	-176.2	-173.2	-68.9	155.5	-6.8	112.6	K3619 R3621 Q3625 L3626 V3627	K3619-R3623 VanDerWaalsContact O-CB 3.22Å; K3619-R3623 WeakPolarHBondContact O-CB 3.26Å; K3619-R3623 PolarHBondContact O-N 3.14Å; R3621-R3623 VanDerWaalsContact C-N 3.31Å; R3621-R3623 PolarHBondContact O-N 3.41Å; R3623-Q3625 VanDerWaalsContact C-N 3.33Å; R3623-Q3625 PolarHBondContact O-N 3.23Å; R3623-L3626 PolarHBondContact O-N 3.08Å; R3623-V3627 WeakPolarHBondContact O-CG2 3.39Å; R3623-V3627 PolarHBondContact O-N 2.81Å
3624	K	87.7	Confident	83.5	Confident	125 Å²	125	75.6 Å²	75.6	54%	0.543	35%	0.349	S	S	.	.	H	α-helix	trans	-59.2	-44.3	176.9	-76.8	167.3	178.7	171.7	0	111	T3620 R3621 V3627 R3628	T3620-K3624 HydrophobicContact CG2-CD 4.26Å; T3620-K3624 WeakPolarHBondContact O-CB 3.36Å; T3620-K3624 VanDerWaalsContact O-CG 3.28Å; T3620-K3624 WeakPolarHBondContact O-CG 3.14Å; T3620-K3624 PolarHBondContact O-N 3.07Å; R3621-K3624 PolarHBondContact O-N 3.36Å; R3621-K3624 VanDerWaalsContact O-N 3.14Å; K3624-V3627 PolarHBondContact O-N 2.88Å; K3624-R3628 PolarHBondContact O-N 2.57Å
3625	Q	83	Confident	82	Confident	32 Å²	32	80.1 Å²	80.1	15%	0.15	37%	0.373	C	S	.	.	H	α-helix	trans	-68.5	-43.7	178.7	179.8	61.2	2.5	0	0	112.5	L3597 P3600 R3621 I3622 R3623 V3627 R3628 E3629	L3597-Q3625 HydrophobicContact CD1-CG 4.19Å; P3600-Q3625 HydrophobicContact CG-CG 4.41Å; R3621-Q3625 PolarHBondContact O-N 3.2Å; I3622-Q3625 PolarHBondContact O-N 3.33Å; R3623-Q3625 VanDerWaalsContact C-N 3.33Å; R3623-Q3625 PolarHBondContact O-N 3.23Å; Q3625-V3627 VanDerWaalsContact C-N 3.3Å; Q3625-V3627 PolarHBondContact O-N 2.81Å; Q3625-R3628 WeakPolarHBondContact O-CB 3.46Å; Q3625-R3628 PolarHBondContact O-N 3.25Å; Q3625-R3628 VanDerWaalsContact O-N 3.09Å; Q3625-E3629 HydrophobicContact CG-CG 4.5Å; Q3625-E3629 PolarHBondContact NE2-OE1 3.24Å; Q3625-E3629 PolarHBondContact O-N 3.24Å
3626	L	83	Confident	80.3	Confident	64 Å²	64	81.3 Å²	81.3	34%	0.335	38%	0.381	S	S	.	.	H	α-helix	trans	-56.6	-45.1	173.9	-176.5	157.2	0	0	0	111.1	L3579 L3597 I3622 R3623 E3629 V3630	L3579-L3626 HydrophobicContact CD1-CD1 3.77Å; L3597-L3626 HydrophobicContact CD1-CB 4.44Å; L3597-L3626 HydrophobicContact CD2-CB 4.08Å; L3597-L3626 HydrophobicContact CD2-CD1 4.23Å; L3597-L3626 HydrophobicContact CD2-CG 4.37Å; I3622-L3626 WeakPolarHBondContact O-CB 3.34Å; I3622-L3626 PolarHBondContact O-N 2.82Å; R3623-L3626 PolarHBondContact O-N 3.08Å; L3626-E3629 PolarHBondContact O-N 3.3Å; L3626-V3630 HydrophobicContact CD2-CG2 4.05Å; L3626-V3630 WeakPolarHBondContact O-CB 3.35Å; L3626-V3630 VanDerWaalsContact O-CG2 3.24Å; L3626-V3630 WeakPolarHBondContact O-CG2 3.27Å; L3626-V3630 PolarHBondContact O-N 3.22Å
3627	V	82.3	Confident	78.3	Confident	72 Å²	72	83.5 Å²	83.5	44%	0.436	40%	0.4	S	S	.	.	H	α-helix	trans	-61.6	-44.3	174.7	169.6	0	0	0	0	111.1	R3623 K3624 Q3625 E3629 V3630 I3631	R3623-V3627 WeakPolarHBondContact O-CG2 3.39Å; R3623-V3627 PolarHBondContact O-N 2.81Å; K3624-V3627 PolarHBondContact O-N 2.88Å; Q3625-V3627 VanDerWaalsContact C-N 3.3Å; Q3625-V3627 PolarHBondContact O-N 2.81Å; V3627-E3629 PolarHBondContact O-N 3.49Å; V3627-V3630 PolarHBondContact O-N 2.82Å; V3627-I3631 HydrophobicContact CG1-CD1 3.61Å; V3627-I3631 HydrophobicContact CG1-CG1 4.31Å; V3627-I3631 VanDerWaalsContact O-CB 3.29Å; V3627-I3631 WeakPolarHBondContact O-CB 3.44Å; V3627-I3631 WeakPolarHBondContact O-CG1 3.3Å; V3627-I3631 PolarHBondContact O-N 3.16Å
3628	R	82.8	Confident	76.1	Confident	152 Å²	152	92.9 Å²	92.9	57%	0.574	43%	0.433	S	S	*	.	H	α-helix	trans	-59.7	-46.3	178.1	-164.9	-178.8	-166.6	-176.2	4.9	112.5	K3624 Q3625 I3631 K3632	K3624-R3628 PolarHBondContact O-N 2.57Å; Q3625-R3628 WeakPolarHBondContact O-CB 3.46Å; Q3625-R3628 PolarHBondContact O-N 3.25Å; Q3625-R3628 VanDerWaalsContact O-N 3.09Å; R3628-I3631 PolarHBondContact O-N 2.88Å; R3628-K3632 WeakPolarHBondContact O-CG 3.27Å; R3628-K3632 PolarHBondContact O-N 3.43Å
3629	E	81.1	Confident	73.6	Confident	33 Å²	33	103.6 Å²	103.6	15%	0.154	47%	0.472	C	S	.	.	H	α-helix	trans	-74.5	-34.3	-179.7	-60.5	-48.7	132.7	0	0	112.9	F3595 L3597 Q3625 L3626 V3627 K3632 K3633	F3595-E3629 HydrophobicContact CE1-CB 4.34Å; F3595-E3629 HydrophobicContact CZ-CB 3.82Å; L3597-E3629 HydrophobicContact CD1-CB 4.33Å; L3597-E3629 HydrophobicContact CD1-CG 4.13Å; Q3625-E3629 HydrophobicContact CG-CG 4.5Å; Q3625-E3629 PolarHBondContact NE2-OE1 3.24Å; Q3625-E3629 PolarHBondContact O-N 3.24Å; L3626-E3629 PolarHBondContact O-N 3.3Å; V3627-E3629 PolarHBondContact O-N 3.49Å; E3629-K3632 VanDerWaalsContact CD-NZ 3.32Å; E3629-K3632 PolarHBondContact O-N 3.4Å; E3629-K3632 IonicContact OE1-NZ 3.25Å; E3629-K3632 PolarHBondContact OE1-NZ 2.88Å; E3629-K3632 WeakPolarHBondContact OE2-CD 3.25Å; E3629-K3632 IonicContact OE2-NZ 2.85Å; E3629-K3632 PolarHBondContact OE2-NZ 3.39Å; E3629-K3632 VanDerWaalsContact OE2-NZ 3.16Å; E3629-K3633 WeakPolarHBondContact O-CG 3.22Å; E3629-K3633 PolarHBondContact O-N 3.07Å
3630	V	75.6	Confident	71.1	Confident	42 Å²	42	110.1 Å²	110.1	26%	0.255	49%	0.494	S	S	.	.	H	α-helix	trans	-66.4	-39.8	172.1	169.8	0	0	0	0	111	F3595 L3626 V3627 K3634	F3595-V3630 HydrophobicContact CE1-CG2 4.31Å; F3595-V3630 HydrophobicContact CE2-CG2 3.77Å; F3595-V3630 HydrophobicContact CZ-CG2 3.64Å; L3626-V3630 HydrophobicContact CD2-CG2 4.05Å; L3626-V3630 WeakPolarHBondContact O-CB 3.35Å; L3626-V3630 VanDerWaalsContact O-CG2 3.24Å; L3626-V3630 WeakPolarHBondContact O-CG2 3.27Å; L3626-V3630 PolarHBondContact O-N 3.22Å; V3627-V3630 PolarHBondContact O-N 2.82Å; V3630-K3634 HydrophobicContact CG1-CD 4.4Å; V3630-K3634 WeakPolarHBondContact O-CB 3.13Å; V3630-K3634 PolarHBondContact O-N 3.45Å
3631	I	77.8	Confident	68.8	Low	66 Å²	66	116.2 Å²	116.2	34%	0.338	52%	0.524	S	S	.	.	H	α-helix	trans	-61.5	-50.8	173.4	-75	172.9	0	0	0	110.1	V3627 R3628 K3633 K3634 L3635 I3733	V3627-I3631 HydrophobicContact CG1-CD1 3.61Å; V3627-I3631 HydrophobicContact CG1-CG1 4.31Å; V3627-I3631 VanDerWaalsContact O-CB 3.29Å; V3627-I3631 WeakPolarHBondContact O-CB 3.44Å; V3627-I3631 WeakPolarHBondContact O-CG1 3.3Å; V3627-I3631 PolarHBondContact O-N 3.16Å; R3628-I3631 PolarHBondContact O-N 2.88Å; I3631-K3633 PolarHBondContact O-N 2.87Å; I3631-K3634 PolarHBondContact O-N 2.94Å; I3631-L3635 HydrophobicContact CG2-CD1 3.66Å; I3631-L3635 HydrophobicContact CG2-CG 4.15Å; I3631-L3635 VanDerWaalsContact O-CB 3.32Å; I3631-L3635 WeakPolarHBondContact O-CB 3.3Å; I3631-L3635 PolarHBondContact O-N 2.69Å; I3631-I3733 HydrophobicContact CG2-CD1 4.31Å
3632	K	77.6	Confident	66.3	Low	102 Å²	102	116.7 Å²	116.7	44%	0.443	54%	0.54	S	S	.	.	H	α-helix	trans	-52.8	-52.5	175.3	-77.4	165.4	167.6	-178.1	0	112.2	R3628 E3629 K3634 T3636	R3628-K3632 WeakPolarHBondContact O-CG 3.27Å; R3628-K3632 PolarHBondContact O-N 3.43Å; E3629-K3632 VanDerWaalsContact CD-NZ 3.32Å; E3629-K3632 PolarHBondContact O-N 3.4Å; E3629-K3632 IonicContact OE1-NZ 3.25Å; E3629-K3632 PolarHBondContact OE1-NZ 2.88Å; E3629-K3632 WeakPolarHBondContact OE2-CD 3.25Å; E3629-K3632 IonicContact OE2-NZ 2.85Å; E3629-K3632 PolarHBondContact OE2-NZ 3.39Å; E3629-K3632 VanDerWaalsContact OE2-NZ 3.16Å; K3632-K3634 VanDerWaalsContact C-N 3.3Å; K3632-K3634 PolarHBondContact O-N 3.22Å; K3632-T3636 PolarHBondContact O-N 3.19Å; K3632-T3636 PolarHBondContact O-OG1 3.21Å
3633	K	69.3	Low	63.7	Low	109 Å²	109	121.3 Å²	121.3	47%	0.474	57%	0.565	S	S	.	*	H	α-helix	trans	-72.6	-16.1	-176.8	-62.5	-170.5	-153.7	168.7	0	114.1	F3595 E3596 E3629 I3631	F3595-K3633 HydrophobicContact CD2-CD 4.02Å; F3595-K3633 HydrophobicContact CE2-CB 4.38Å; F3595-K3633 HydrophobicContact CE2-CD 3.54Å; F3595-K3633 HydrophobicContact CE2-CG 4.26Å; F3595-K3633 HydrophobicContact CZ-CD 4.19Å; E3596-K3633 PolarHBondContact O-NZ 2.87Å; E3629-K3633 WeakPolarHBondContact O-CG 3.22Å; E3629-K3633 PolarHBondContact O-N 3.07Å; I3631-K3633 PolarHBondContact O-N 2.87Å
3634	K	65.1	Low	61.5	Low	125 Å²	125	122 Å²	122	54%	0.543	58%	0.578	S	S	.	*	H	α-helix	trans	-100.6	-20.8	173.7	-73.4	-166.7	174.9	-175.4	0	114.6	I3589 V3630 I3631 K3632	I3589-K3634 PolarHBondContact O-NZ 2.83Å; V3630-K3634 HydrophobicContact CG1-CD 4.4Å; V3630-K3634 WeakPolarHBondContact O-CB 3.13Å; V3630-K3634 PolarHBondContact O-N 3.45Å; I3631-K3634 PolarHBondContact O-N 2.94Å; K3632-K3634 VanDerWaalsContact C-N 3.3Å; K3632-K3634 PolarHBondContact O-N 3.22Å
3635	L	59.1	Low	58.8	Low	108 Å²	108	126.5 Å²	126.5	57%	0.565	59%	0.592	S	S	*	*	H	α-helix	trans	-99.1	-5	179.1	-67.9	-170.7	0	0	0	114.8	I3631 P3637 I3733	I3631-L3635 HydrophobicContact CG2-CD1 3.66Å; I3631-L3635 HydrophobicContact CG2-CG 4.15Å; I3631-L3635 VanDerWaalsContact O-CB 3.32Å; I3631-L3635 WeakPolarHBondContact O-CB 3.3Å; I3631-L3635 PolarHBondContact O-N 2.69Å; L3635-P3637 WeakPolarHBondContact O-CD 3.3Å; L3635-I3733 HydrophobicContact CD1-CD1 3.84Å; L3635-I3733 HydrophobicContact CD1-CG1 4.1Å
3636	T	52.7	Low	56.8	Low	103 Å²	103	132.6 Å²	132.6	63%	0.632	62%	0.624	S	S	*	*	S	Bend	trans	-74.2	107.1	164.8	43.8	0	0	0	0	109.9	K3632 R3638	K3632-T3636 PolarHBondContact O-N 3.19Å; K3632-T3636 PolarHBondContact O-OG1 3.21Å; T3636-R3638 PolarHBondContact O-N 3.34Å
3637	P	45.7	Very low	54.5	Low	114 Å²	114	135.4 Å²	135.4	74%	0.74	65%	0.649	S	S	*	*			trans	-64.2	136.6	172.2	28.9	-34.9	0	0	0	108.7	L3635 R3639	L3635-P3637 WeakPolarHBondContact O-CD 3.3Å; P3637-R3639 PolarHBondContact O-N 3.38Å
3638	R	43.4	Very low	52.3	Low	245 Å²	245	135.2 Å²	135.2	93%	0.925	66%	0.661	S	S	*	*			trans	-56.7	107.3	170.5	-76.9	-172.2	174.2	-163.9	-1.3	108.6	T3636 R3640	T3636-R3638 PolarHBondContact O-N 3.34Å; R3638-R3640 PolarHBondContact O-N 3.33Å
3639	R	39	Very low	50.2	Low	247 Å²	247	133.7 Å²	133.7	93%	0.932	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-55	124.6	168.1	-80.1	-177.2	170.2	168.8	-3.7	107.5	P3637	P3637-R3639 PolarHBondContact O-N 3.38Å
3640	R	37	Very low	48.1	Very low	238 Å²	238	139 Å²	139	90%	0.898	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-63.2	145.9	177.6	-70.6	-179.9	173.4	177.6	-3	109.3	R3638	R3638-R3640 PolarHBondContact O-N 3.33Å
3641	L	41.3	Very low	46.3	Very low	166 Å²	166	142.5 Å²	142.5	87%	0.869	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-55.8	136.4	172.5	-71.2	155.3	0	0	0	110	L3643	L3641-L3643 PolarHBondContact O-N 3.31Å
3642	P	35.5	Very low	44.5	Very low	114 Å²	114	143.5 Å²	143.5	74%	0.74	74%	0.738	S	S	*	*			trans	-73.1	112.7	176.5	29.1	-32.7	0	0	0	110.1	L3644	P3642-L3644 PolarHBondContact O-N 3.04Å
3643	L	32.3	Very low	42.7	Very low	149 Å²	149	147.8 Å²	147.8	78%	0.78	76%	0.756	S	S	*	*			trans	-83.9	87.9	174	-172.6	125.5	0	0	0	109.8	L3641 R3645	L3641-L3643 PolarHBondContact O-N 3.31Å; L3643-R3645 HydrophobicContact CD2-CG 4.23Å; L3643-R3645 PolarHBondContact O-N 3.39Å
3644	L	39.5	Very low	41.3	Very low	156 Å²	156	148.2 Å²	148.2	82%	0.817	76%	0.764	S	S	*	*			trans	-77.7	115.6	172.3	-88	165.3	0	0	0	110.5	P3642	P3642-L3644 PolarHBondContact O-N 3.04Å
3645	R	32.1	Very low	40.3	Very low	220 Å²	220	147.8 Å²	147.8	83%	0.83	77%	0.767	S	S	*	*			trans	-87.2	129.1	161.9	-67.2	177.3	178.1	163.8	-3.2	108.9	L3643	L3643-R3645 HydrophobicContact CD2-CG 4.23Å; L3643-R3645 PolarHBondContact O-N 3.39Å
3646	I	41.3	Very low	39.4	Very low	160 Å²	160	148.2 Å²	148.2	82%	0.821	77%	0.771	S	S	*	*			trans	-132.5	137.4	153.2	-60.7	-176.8	0	0	0	106.8
3647	S	34.8	Very low	39	Very low	122 Å²	122	150.2 Å²	150.2	85%	0.853	78%	0.777	S	S	*	*			trans	-92.8	149.3	-175.2	-59.2	0	0	0	0	111.8
3648	G	35.6	Very low	38.9	Very low	68 Å²	68	149 Å²	149	70%	0.701	77%	0.772	S	S	*	*			trans	164.3	100	169.6	0	0	0	0	0	115.5
3649	T	37.9	Very low	38.8	Very low	121 Å²	121	142.5 Å²	142.5	74%	0.742	76%	0.763	S	S	*	*			trans	-0	145.9	137.3	53.1	0	0	0	0	118.6
3650	N	36.9	Very low	38.9	Very low	145 Å²	145	138.1 Å²	138.1	78%	0.775	76%	0.757	S	S	*	*			cis	-169.7	165.5	5.2	-104	-11.7	0	0	0	110.2
3651	S	39.6	Very low	39	Very low	115 Å²	115	131.2 Å²	131.2	80%	0.804	75%	0.751	S	S	*	*			trans	69.5	144.9	157.4	-128.1	0	0	0	0	118
3652	S	39.4	Very low	38.9	Very low	87 Å²	87	127.7 Å²	127.7	61%	0.608	75%	0.745	S	S	*	*			cis	-176.6	147.6	-20.2	44.2	0	0	0	0	111.4
3653	K	40.3	Very low	39.1	Very low	191 Å²	191	127 Å²	127	83%	0.83	74%	0.743	S	S	*	*			trans	68.5	147.9	156.6	-67.9	172.7	174.4	-177.8	0	117.6
3654	N	39.8	Very low	39.5	Very low	118 Å²	118	125.1 Å²	125.1	63%	0.631	74%	0.743	S	S	*	*			cis	-161.7	159.3	-17.6	-118.9	31.4	0	0	0	109.9
3655	D	42.5	Very low	39.5	Very low	116 Å²	116	122.5 Å²	122.5	62%	0.62	74%	0.737	S	S	*	*			trans	57.3	151.2	140.8	-55.2	-13.7	0	0	0	122.1
3656	N	41.8	Very low	39.9	Very low	118 Å²	118	117.8 Å²	117.8	63%	0.631	73%	0.733	S	S	*	*			cis	-168.7	154.3	-21.6	-102.3	-29.5	0	0	0	110.6
3657	N	43	Very low	39.7	Very low	144 Å²	144	117 Å²	117	77%	0.77	73%	0.731	S	S	*	*			trans	65	154.6	147.9	-65.5	-14.5	0	0	0	120.6
3658	S	43.9	Very low	39.8	Very low	90 Å²	90	115.8 Å²	115.8	63%	0.629	72%	0.722	S	S	*	*			cis	-172.5	143.3	-17.2	49	0	0	0	0	113.4
3659	S	41.9	Very low	39.8	Very low	107 Å²	107	122.2 Å²	122.2	75%	0.748	73%	0.731	S	S	*	*			trans	62.8	168	150.7	67.8	0	0	0	0	118.3
3660	I	40.5	Very low	39.6	Very low	156 Å²	156	122.2 Å²	122.2	80%	0.8	73%	0.733	S	S	*	*			cis	-137	158.6	16.1	-60.6	172.3	0	0	0	111.6
3661	A	39.2	Very low	39.3	Very low	92 Å²	92	124.2 Å²	124.2	76%	0.76	74%	0.737	S	S	*	*			trans	-53.6	-177.1	164.3	0	0	0	0	0	115.6
3662	A	39.7	Very low	39	Very low	92 Å²	92	127.3 Å²	127.3	76%	0.76	74%	0.739	S	S	*	*			cis	-161.5	-174.3	-27.4	0	0	0	0	0	105
3663	S	39.4	Very low	38.6	Very low	99 Å²	99	131.3 Å²	131.3	69%	0.692	75%	0.753	S	S	*	*			cis	-179.7	167.2	27.7	46.5	0	0	0	0	108.7
3664	S	39.8	Very low	38	Very low	110 Å²	110	128.2 Å²	128.2	77%	0.769	75%	0.75	S	S	*	*			trans	59.9	151.4	159.3	43.8	0	0	0	0	119.7
3665	S	40.2	Very low	37.7	Very low	101 Å²	101	129.5 Å²	129.5	71%	0.706	76%	0.763	S	S	*	*			cis	-166.9	163.5	-14.4	50.5	0	0	0	0	112.3
3666	T	41.7	Very low	37.3	Very low	122 Å²	122	128.8 Å²	128.8	75%	0.748	77%	0.767	S	S	*	*			trans	68.2	127.9	152.2	42.5	0	0	0	0	123.5
3667	D	35.7	Very low	36.9	Very low	143 Å²	143	130.8 Å²	130.8	77%	0.765	78%	0.777	S	S	*	*			trans	80.5	91.2	140.5	-74.5	-40.4	0	0	0	126.2
3668	S	38.2	Very low	36.5	Very low	97 Å²	97	131.2 Å²	131.2	68%	0.678	78%	0.778	S	S	*	*				93.6	120.1	109.1	81.9	0	0	0	0	122.5
3669	K	34.4	Very low	35.8	Very low	203 Å²	203	133.8 Å²	133.8	88%	0.883	78%	0.784	S	S	*	*			trans	71.4	154.4	152	-85.2	-175.7	175.5	176.5	0	118.5
3670	P	34.8	Very low	35.3	Very low	121 Å²	121	136.5 Å²	136.5	79%	0.786	79%	0.789	S	S	*	*				-123.1	164.5	-116.8	42.3	-32.8	0	0	0	116.8
3671	H	30.5	Very low	34.7	Very low	186 Å²	186	134 Å²	134	86%	0.861	79%	0.786	S	S	*	*			trans	-43.6	131.7	179.5	-80	-89	0	0	0	117.8
3672	E	33.1	Very low	34.6	Very low	180 Å²	180	134.5 Å²	134.5	84%	0.841	78%	0.783	S	S	*	*			trans	-81.8	169.8	140.4	-78.6	-171.2	119.2	0	0	111.7
3673	L	30.4	Very low	34.1	Very low	171 Å²	171	136 Å²	136	90%	0.895	78%	0.783	S	S	*	*			trans	-91.6	105.1	-172.4	-67.8	86	0	0	0	112.7
3674	T	28.6	Very low	33.8	Very low	127 Å²	127	140.6 Å²	140.6	78%	0.779	79%	0.79	S	S	*	*			trans	-135.6	102.9	159.9	-53.7	0	0	0	0	110
3675	T	32.7	Very low	33.4	Very low	145 Å²	145	145.4 Å²	145.4	89%	0.89	79%	0.791	S	S	*	*			trans	-138.9	96.3	158.4	18.4	0	0	0	0	109.3
3676	S	34.9	Very low	33	Very low	101 Å²	101	148.1 Å²	148.1	71%	0.706	80%	0.797	S	S	*	*			trans	-54.7	157.7	168	33.4	0	0	0	0	112.9	I3678	S3676-I3678 PolarHBondContact O-N 3.2Å
3677	N	32.5	Very low	32.7	Very low	160 Å²	160	147 Å²	147	86%	0.856	80%	0.795	S	S	*	*			trans	-54.5	133.4	163.6	-59.4	-50.7	0	0	0	110.5
3678	I	34.5	Very low	32.6	Very low	152 Å²	152	145 Å²	145	78%	0.779	79%	0.791	S	S	*	*			trans	-159.4	124.2	147.7	-103.8	147.8	0	0	0	110.3	S3676	S3676-I3678 PolarHBondContact O-N 3.2Å
3679	L	29.2	Very low	32.3	Very low	145 Å²	145	147.8 Å²	147.8	76%	0.759	80%	0.798	S	S	*	*			trans	15.5	124.5	152.3	-52.4	171.1	0	0	0	119.3
3680	L	31.5	Very low	32.2	Very low	164 Å²	164	143.7 Å²	143.7	86%	0.859	79%	0.79	S	S	*	*				-154.6	99.3	108.1	-145.2	72	0	0	0	113.3
3681	S	28	Very low	32.4	Very low	104 Å²	104	144.2 Å²	144.2	73%	0.727	79%	0.794	S	S	*	*			trans	-83.4	136.5	162.7	52.5	0	0	0	0	110.3
3682	S	36.3	Very low	32.4	Very low	101 Å²	101	139.5 Å²	139.5	71%	0.706	79%	0.787	S	S	*	*			trans	-150.2	82.4	174	-82.6	0	0	0	0	114.4
3683	V	30.4	Very low	32.3	Very low	124 Å²	124	137.4 Å²	137.4	75%	0.752	79%	0.786	S	S	*	*			trans	43	107.3	136.5	-172.6	0	0	0	0	118.9
3684	K	33.4	Very low	32.5	Very low	196 Å²	196	136 Å²	136	85%	0.852	79%	0.785	S	S	*	*			trans	174.8	147.6	135.3	-95.4	151.5	-174.9	175.8	0	109.5
3685	R	30.8	Very low	32.7	Very low	210 Å²	210	134 Å²	134	79%	0.792	79%	0.789	S	S	*	*			cis	-174.7	147.9	-27.6	-123.7	-172.6	-163.3	-173.1	4.9	105.9
3686	L	31.6	Very low	32.7	Very low	158 Å²	158	130.8 Å²	130.8	83%	0.827	79%	0.785	S	S	*	*			trans	67.3	146.5	-178.3	-75.8	67.7	0	0	0	113.8
3687	S	36.2	Very low	32.6	Very low	99 Å²	99	137.9 Å²	137.9	69%	0.692	80%	0.797	S	S	*	*			cis	-155.6	133.9	-4.4	39.9	0	0	0	0	112.4
3688	S	32.2	Very low	32.9	Very low	100 Å²	100	133.9 Å²	133.9	70%	0.699	79%	0.785	S	S	*	*			trans	23.6	143.1	143	56.1	0	0	0	0	122.4
3689	L	31.6	Very low	32.9	Very low	156 Å²	156	133.7 Å²	133.7	82%	0.817	79%	0.786	S	S	*	*			cis	-162.1	165.9	-2	-113.4	166.9	0	0	0	111.7
3690	T	33.6	Very low	33.3	Very low	118 Å²	118	132 Å²	132	72%	0.724	79%	0.786	S	S	*	*			trans	-61.7	166.3	169.6	44.4	0	0	0	0	113.3
3691	P	38	Very low	33.5	Very low	131 Å²	131	129.8 Å²	129.8	85%	0.851	78%	0.78	S	S	*	*			cis	-147.4	-173.9	43.9	42.8	-20.9	0	0	0	118.9
3692	A	31	Very low	33.9	Very low	87 Å²	87	132.3 Å²	132.3	72%	0.719	78%	0.782	S	S	*	*			trans	-109.9	162.7	-174.7	0	0	0	0	0	113.3
3693	V	31.1	Very low	33.9	Very low	136 Å²	136	135.7 Å²	135.7	82%	0.824	79%	0.786	S	S	*	*			trans	10.4	110	151.7	-171.4	0	0	0	0	117.7
3694	T	34.2	Very low	34	Very low	141 Å²	141	134.2 Å²	134.2	87%	0.865	78%	0.781	S	S	*	*				-170.9	154.3	124.7	16.3	0	0	0	0	109.8
3695	G	32.1	Very low	34.5	Very low	85 Å²	85	130 Å²	130	88%	0.876	77%	0.774	S	S	*	*			trans	-80.5	158.7	-167.9	0	0	0	0	0	115.4
3696	G	33.3	Very low	34.8	Very low	78 Å²	78	126.8 Å²	126.8	80%	0.804	77%	0.773	S	S	*	*			trans	175.3	39.7	-178.5	0	0	0	0	0	121.3
3697	R	33.5	Very low	35.3	Very low	251 Å²	251	124.9 Å²	124.9	95%	0.947	77%	0.767	S	S	*	*			trans	53.3	135.6	146.4	-165	175.1	-174.7	146.6	2.6	121.8
3698	A	38.2	Very low	35.6	Very low	75 Å²	75	127.6 Å²	127.6	62%	0.62	77%	0.774	S	S	*	*			trans	84	102.4	157.5	0	0	0	0	0	121
3699	D	33.8	Very low	36	Very low	148 Å²	148	130.4 Å²	130.4	79%	0.791	78%	0.781	S	S	*	*				70.2	125.8	117.2	-53.5	-20	0	0	0	124.3
3700	S	38.7	Very low	36.7	Very low	109 Å²	109	131.3 Å²	131.3	76%	0.762	79%	0.787	S	S	*	*			trans	79.5	142.5	136.1	84	0	0	0	0	118.9
3701	T	36.6	Very low	37.1	Very low	118 Å²	118	133.6 Å²	133.6	72%	0.724	80%	0.795	S	S	*	*			cis	-166.8	152.4	-19	5.6	0	0	0	0	110.3
3702	M	36.3	Very low	37.5	Very low	157 Å²	157	135.2 Å²	135.2	77%	0.773	80%	0.796	S	S	*	*			trans	65.4	160.6	160.7	-54.8	-84.2	96.4	0	0	115.8
3703	H	35.5	Very low	38.4	Very low	172 Å²	172	138.7 Å²	138.7	80%	0.796	80%	0.802	S	S	*	*			cis	-146.8	168	-0.2	-142	46.4	0	0	0	110.1
3704	S	32.2	Very low	39.2	Very low	93 Å²	93	138.1 Å²	138.1	65%	0.65	80%	0.799	S	S	*	*			trans	-105.7	169.7	172.1	-157.6	0	0	0	0	110.4
3705	P	45.1	Very low	39.7	Very low	109 Å²	109	135.3 Å²	135.3	71%	0.708	78%	0.778	S	S	*	*				-154	151.7	85.4	40.5	-21.1	0	0	0	118.7
3706	D	36.4	Very low	40.6	Very low	141 Å²	141	136 Å²	136	75%	0.754	77%	0.768	S	S	*	*				55.6	131.8	126.8	-55.9	-24.1	0	0	0	126.8
3707	V	42	Very low	41.6	Very low	118 Å²	118	136.8 Å²	136.8	72%	0.715	76%	0.757	S	S	*	*			trans	77.6	117.4	132.2	169.9	0	0	0	0	121.8
3708	D	43.3	Very low	42.9	Very low	157 Å²	157	128.6 Å²	128.6	84%	0.84	74%	0.735	S	S	*	*				-169.2	151.8	112.4	-100	-33.1	0	0	0	110.7
3709	D	39.9	Very low	44.1	Very low	158 Å²	158	129.7 Å²	129.7	85%	0.845	73%	0.733	S	S	*	*			trans	-104.2	155.1	-175.9	-69.3	-67.1	0	0	0	113.1
3710	D	47.1	Very low	45.7	Very low	175 Å²	175	125.5 Å²	125.5	94%	0.936	72%	0.72	S	S	*	*			trans	-161.1	134.4	155.7	-113.4	-28.6	0	0	0	111.3
3711	D	41.6	Very low	47.2	Very low	167 Å²	167	123 Å²	123	89%	0.893	71%	0.705	S	S	*	*			trans	-122.3	127.2	-173.3	-137.5	-12.4	0	0	0	109.2
3712	D	46.2	Very low	48.9	Very low	165 Å²	165	124.6 Å²	124.6	88%	0.882	70%	0.704	S	S	*	*			trans	-122.2	128.8	-171.5	-154.3	-2.1	0	0	0	113.7
3713	L	49.3	Very low	50.6	Low	160 Å²	160	123.9 Å²	123.9	84%	0.838	70%	0.699	S	S	*	*			trans	-103.5	118.3	-158.5	179.4	66.4	0	0	0	112.7	D3715	L3713-D3715 PolarHBondContact O-N 3.35Å
3714	V	48.8	Very low	52.5	Low	124 Å²	124	120.1 Å²	120.1	75%	0.752	68%	0.682	S	S	*	*			trans	-75.9	108.2	-178.8	-177.2	0	0	0	0	112.2
3715	D	43.7	Very low	54.7	Low	81 Å²	81	122.2 Å²	122.2	43%	0.433	68%	0.679	S	S	.	*			trans	-64.6	124.9	-178.6	171.6	47.1	0	0	0	113.9	L3713 T3717 T3718	L3713-D3715 PolarHBondContact O-N 3.35Å; D3715-T3717 VanDerWaalsContact CG-OG1 3.29Å; D3715-T3717 PolarHBondContact O-N 3.47Å; D3715-T3717 VanDerWaalsContact O-N 3.11Å; D3715-T3717 PolarHBondContact OD1-OG1 3Å; D3715-T3717 VanDerWaalsContact OD1-OG1 3.05Å; D3715-T3717 WeakPolarHBondContact OD2-CB 3.5Å; D3715-T3717 PolarHBondContact OD2-N 3.25Å; D3715-T3717 PolarHBondContact OD2-OG1 3.48Å; D3715-T3718 PolarHBondContact O-N 2.78Å; D3715-T3718 PolarHBondContact O-OG1 2.99Å
3716	P	51.3	Low	56.1	Low	101 Å²	101	119.5 Å²	119.5	66%	0.656	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	-17.1	-178.1	24.3	-35.8	0	0	0	115.1	T3718 V3719	P3716-T3718 PolarHBondContact O-N 3.29Å; P3716-V3719 PolarHBondContact O-N 3.5Å
3717	T	55.2	Low	57.9	Low	94 Å²	94	119.2 Å²	119.2	58%	0.577	66%	0.66	S	S	*	*	H	α-helix	trans	-61	-28.5	177.7	-36.8	0	0	0	0	112.3	D3715 A3721	D3715-T3717 VanDerWaalsContact CG-OG1 3.29Å; D3715-T3717 PolarHBondContact O-N 3.47Å; D3715-T3717 VanDerWaalsContact O-N 3.11Å; D3715-T3717 PolarHBondContact OD1-OG1 3Å; D3715-T3717 VanDerWaalsContact OD1-OG1 3.05Å; D3715-T3717 WeakPolarHBondContact OD2-CB 3.5Å; D3715-T3717 PolarHBondContact OD2-N 3.25Å; D3715-T3717 PolarHBondContact OD2-OG1 3.48Å; T3717-A3721 PolarHBondContact O-N 3.25Å
3718	T	60.1	Low	59.4	Low	79 Å²	79	119.9 Å²	119.9	49%	0.485	65%	0.65	S	S	.	*	H	α-helix	trans	-68.1	-40	-178.8	59.7	0	0	0	0	113.4	D3715 P3716 A3721 Q3722	D3715-T3718 PolarHBondContact O-N 2.78Å; D3715-T3718 PolarHBondContact O-OG1 2.99Å; P3716-T3718 PolarHBondContact O-N 3.29Å; T3718-A3721 PolarHBondContact O-N 3.12Å; T3718-Q3722 PolarHBondContact O-N 3.17Å; T3718-Q3722 VanDerWaalsContact O-N 3.17Å
3719	V	62.9	Low	61	Low	97 Å²	97	115.9 Å²	115.9	59%	0.588	63%	0.628	S	S	*	*	H	α-helix	trans	-66.6	-43.8	-178.1	-178.4	0	0	0	0	110.7	P3716 A3721 Q3722 E3723	P3716-V3719 PolarHBondContact O-N 3.5Å; V3719-A3721 PolarHBondContact O-N 3.25Å; V3719-Q3722 PolarHBondContact O-N 2.83Å; V3719-Q3722 VanDerWaalsContact O-N 3.17Å; V3719-E3723 PolarHBondContact O-N 3.34Å
3720	A	66.6	Low	62.4	Low	61 Å²	61	112.9 Å²	112.9	50%	0.504	61%	0.612	S	S	.	*	H	α-helix	trans	-60.6	-43	177.7	0	0	0	0	0	112.2	Q3722 E3723 E3724	A3720-Q3722 VanDerWaalsContact C-N 3.3Å; A3720-Q3722 PolarHBondContact O-N 2.7Å; A3720-E3723 PolarHBondContact O-N 3.45Å; A3720-E3724 WeakPolarHBondContact O-CB 3.17Å; A3720-E3724 PolarHBondContact O-N 3.03Å
3721	A	72.1	Confident	63.5	Low	55 Å²	55	111.6 Å²	111.6	46%	0.455	60%	0.6	S	S	.	*	H	α-helix	trans	-64.3	-33.8	176.5	0	0	0	0	0	112.7	T3717 T3718 V3719 K3725	T3717-A3721 PolarHBondContact O-N 3.25Å; T3718-A3721 PolarHBondContact O-N 3.12Å; V3719-A3721 PolarHBondContact O-N 3.25Å; A3721-K3725 WeakPolarHBondContact O-CB 3.47Å; A3721-K3725 PolarHBondContact O-N 3.12Å; A3721-K3725 VanDerWaalsContact O-N 3.09Å
3722	Q	70.3	Confident	65	Low	153 Å²	153	110.4 Å²	110.4	72%	0.715	59%	0.591	S	S	*	*	H	α-helix	trans	-74.4	-33.6	176.9	-171.6	159.5	-50.2	0	0	112.6	T3718 V3719 A3720 A3726	T3718-Q3722 PolarHBondContact O-N 3.17Å; T3718-Q3722 VanDerWaalsContact O-N 3.17Å; V3719-Q3722 PolarHBondContact O-N 2.83Å; V3719-Q3722 VanDerWaalsContact O-N 3.17Å; A3720-Q3722 VanDerWaalsContact C-N 3.3Å; A3720-Q3722 PolarHBondContact O-N 2.7Å; Q3722-A3726 PolarHBondContact O-N 2.98Å; Q3722-A3726 VanDerWaalsContact O-N 3.13Å
3723	E	73.5	Confident	65.9	Low	142 Å²	142	106.9 Å²	106.9	66%	0.664	57%	0.571	S	S	*	*	H	α-helix	trans	-71	-45.3	172	-174.3	163.5	-150.7	0	0	112	V3719 A3720 K3725 A3726 Q3727	V3719-E3723 PolarHBondContact O-N 3.34Å; A3720-E3723 PolarHBondContact O-N 3.45Å; E3723-K3725 VanDerWaalsContact C-N 3.26Å; E3723-K3725 PolarHBondContact O-N 3.12Å; E3723-A3726 CarbonylContact O-C 2.82Å; E3723-A3726 WeakPolarHBondContact O-CB 3.27Å; E3723-A3726 PolarHBondContact O-N 3.3Å; E3723-Q3727 PolarHBondContact O-N 3.27Å
3724	E	73.9	Confident	66.4	Low	93 Å²	93	104.5 Å²	104.5	44%	0.435	56%	0.559	S	S	.	*	H	α-helix	trans	-59.5	-37.5	176.5	-161.2	-156.4	-173.8	0	0	111.6	A3720 Q3727 R3728	A3720-E3724 WeakPolarHBondContact O-CB 3.17Å; A3720-E3724 PolarHBondContact O-N 3.03Å; E3724-Q3727 PolarHBondContact O-N 3.17Å; E3724-R3728 PolarHBondContact O-N 3.39Å; E3724-R3728 IonicContact OE1-CZ 3.53Å; E3724-R3728 VanDerWaalsContact OE1-CZ 3.25Å; E3724-R3728 IonicContact OE1-NH1 2.78Å; E3724-R3728 PolarHBondContact OE1-NH1 2.78Å; E3724-R3728 VanDerWaalsContact OE1-NH1 3.1Å; E3724-R3728 IonicContact OE1-NH2 3.63Å; E3724-R3728 PolarHBondContact OE1-NH2 3.28Å; E3724-R3728 IonicContact OE2-CZ 3.17Å; E3724-R3728 IonicContact OE2-NH1 3.68Å; E3724-R3728 PolarHBondContact OE2-NH1 3.43Å; E3724-R3728 IonicContact OE2-NH2 2.72Å
3725	K	79.4	Confident	66.6	Low	136 Å²	136	100.3 Å²	100.3	59%	0.591	54%	0.541	S	S	*	.	H	α-helix	trans	-64	-46.7	172	-176.8	176	179.8	178	0	112.4	A3721 E3723 Q3727 R3728 D3729	A3721-K3725 WeakPolarHBondContact O-CB 3.47Å; A3721-K3725 PolarHBondContact O-N 3.12Å; A3721-K3725 VanDerWaalsContact O-N 3.09Å; E3723-K3725 VanDerWaalsContact C-N 3.26Å; E3723-K3725 PolarHBondContact O-N 3.12Å; K3725-Q3727 PolarHBondContact O-N 3.05Å; K3725-R3728 PolarHBondContact O-N 2.87Å; K3725-D3729 PolarHBondContact O-N 2.86Å
3726	A	73.9	Confident	66.6	Low	52 Å²	52	108 Å²	108	43%	0.43	56%	0.564	S	S	.	*	H	α-helix	trans	-62.3	-30.8	176.2	0	0	0	0	0	112.4	Q3722 E3723 L3730	Q3722-A3726 PolarHBondContact O-N 2.98Å; Q3722-A3726 VanDerWaalsContact O-N 3.13Å; E3723-A3726 CarbonylContact O-C 2.82Å; E3723-A3726 WeakPolarHBondContact O-CB 3.27Å; E3723-A3726 PolarHBondContact O-N 3.3Å; A3726-L3730 WeakPolarHBondContact O-CB 3.22Å; A3726-L3730 PolarHBondContact O-N 3.34Å
3727	Q	74.7	Confident	66.5	Low	135 Å²	135	112.5 Å²	112.5	63%	0.631	58%	0.576	S	S	*	*	H	α-helix	trans	-71.3	-42.2	175.6	-157.6	170	36.3	0	0	112	E3723 E3724 K3725 L3730 E3731	E3723-Q3727 PolarHBondContact O-N 3.27Å; E3724-Q3727 PolarHBondContact O-N 3.17Å; K3725-Q3727 PolarHBondContact O-N 3.05Å; Q3727-L3730 PolarHBondContact O-N 2.86Å; Q3727-E3731 PolarHBondContact O-N 3.02Å
3728	R	73.8	Confident	65.9	Low	133 Å²	133	110.5 Å²	110.5	50%	0.502	57%	0.569	S	S	.	*	H	α-helix	trans	-63.2	-41.9	171.4	-73.5	-172.1	-180	94.6	8.4	112.8	E3724 K3725 L3730 E3731 M3732	E3724-R3728 PolarHBondContact O-N 3.39Å; E3724-R3728 IonicContact OE1-CZ 3.53Å; E3724-R3728 VanDerWaalsContact OE1-CZ 3.25Å; E3724-R3728 IonicContact OE1-NH1 2.78Å; E3724-R3728 PolarHBondContact OE1-NH1 2.78Å; E3724-R3728 VanDerWaalsContact OE1-NH1 3.1Å; E3724-R3728 IonicContact OE1-NH2 3.63Å; E3724-R3728 PolarHBondContact OE1-NH2 3.28Å; E3724-R3728 IonicContact OE2-CZ 3.17Å; E3724-R3728 IonicContact OE2-NH1 3.68Å; E3724-R3728 PolarHBondContact OE2-NH1 3.43Å; E3724-R3728 IonicContact OE2-NH2 2.72Å; K3725-R3728 PolarHBondContact O-N 2.87Å; R3728-L3730 VanDerWaalsContact C-N 3.29Å; R3728-L3730 PolarHBondContact O-N 3.44Å; R3728-E3731 PolarHBondContact O-N 3.03Å; R3728-M3732 PolarHBondContact O-N 3.1Å
3729	D	75.8	Confident	64.8	Low	72 Å²	72	114.8 Å²	114.8	39%	0.385	58%	0.584	S	S	.	*	H	α-helix	trans	-62.8	-37.4	176.1	-75.1	-24	0	0	0	111.2	K3725 M3732 I3733	K3725-D3729 PolarHBondContact O-N 2.86Å; D3729-M3732 WeakPolarHBondContact OD1-CE 3.27Å; D3729-I3733 WeakPolarHBondContact O-CD1 3.36Å; D3729-I3733 VanDerWaalsContact O-CG1 3.25Å; D3729-I3733 WeakPolarHBondContact O-CG1 3.35Å; D3729-I3733 PolarHBondContact O-N 3.38Å
3730	L	70.5	Confident	63.8	Low	96 Å²	96	117.3 Å²	117.3	50%	0.503	59%	0.592	S	S	.	*	H	α-helix	trans	-66.7	-41.5	173.5	-176	66.1	0	0	0	112.5	A3726 Q3727 R3728 I3733 L3734	A3726-L3730 WeakPolarHBondContact O-CB 3.22Å; A3726-L3730 PolarHBondContact O-N 3.34Å; Q3727-L3730 PolarHBondContact O-N 2.86Å; R3728-L3730 VanDerWaalsContact C-N 3.29Å; R3728-L3730 PolarHBondContact O-N 3.44Å; L3730-I3733 PolarHBondContact O-N 3.49Å; L3730-I3733 VanDerWaalsContact O-N 3.17Å; L3730-L3734 HydrophobicContact CD1-CD1 4.34Å; L3730-L3734 HydrophobicContact CD1-CG 4.44Å; L3730-L3734 HydrophobicContact CG-CD1 4.02Å; L3730-L3734 WeakPolarHBondContact O-CG 3.47Å; L3730-L3734 PolarHBondContact O-N 3.28Å
3731	E	70	Confident	62.3	Low	147 Å²	147	122.5 Å²	122.5	69%	0.687	61%	0.606	S	S	*	*	H	α-helix	trans	-64.4	-39.4	177.7	-168.6	173.9	-150.9	0	0	111.8	Q3727 R3728 I3733 L3734 G3735	Q3727-E3731 PolarHBondContact O-N 3.02Å; R3728-E3731 PolarHBondContact O-N 3.03Å; E3731-I3733 VanDerWaalsContact C-N 3.33Å; E3731-I3733 PolarHBondContact O-N 3.32Å; E3731-L3734 PolarHBondContact O-N 3.22Å; E3731-G3735 PolarHBondContact O-N 3.08Å
3732	M	72.6	Confident	61	Low	142 Å²	142	125.3 Å²	125.3	70%	0.7	62%	0.62	S	S	*	*	H	α-helix	trans	-61.1	-38.6	170.7	-74.1	-161.2	-65.6	0	0	112.8	R3728 D3729	R3728-M3732 PolarHBondContact O-N 3.1Å; D3729-M3732 WeakPolarHBondContact OD1-CE 3.27Å
3733	I	64.8	Low	59.4	Low	92 Å²	92	125.7 Å²	125.7	47%	0.472	63%	0.626	S	S	.	*	H	α-helix	trans	-72.9	-35.5	-178.9	-71.4	165.8	0	0	0	112.2	I3631 L3635 D3729 L3730 E3731	I3631-I3733 HydrophobicContact CG2-CD1 4.31Å; L3635-I3733 HydrophobicContact CD1-CD1 3.84Å; L3635-I3733 HydrophobicContact CD1-CG1 4.1Å; D3729-I3733 WeakPolarHBondContact O-CD1 3.36Å; D3729-I3733 VanDerWaalsContact O-CG1 3.25Å; D3729-I3733 WeakPolarHBondContact O-CG1 3.35Å; D3729-I3733 PolarHBondContact O-N 3.38Å; L3730-I3733 PolarHBondContact O-N 3.49Å; L3730-I3733 VanDerWaalsContact O-N 3.17Å; E3731-I3733 VanDerWaalsContact C-N 3.33Å; E3731-I3733 PolarHBondContact O-N 3.32Å
3734	L	60.8	Low	57.6	Low	109 Å²	109	128.2 Å²	128.2	57%	0.571	64%	0.635	S	S	*	*	H	α-helix	trans	-75.9	-26.4	-179.7	-71.1	171	0	0	0	113.3	L3730 E3731 A3738	L3730-L3734 HydrophobicContact CD1-CD1 4.34Å; L3730-L3734 HydrophobicContact CD1-CG 4.44Å; L3730-L3734 HydrophobicContact CG-CD1 4.02Å; L3730-L3734 WeakPolarHBondContact O-CG 3.47Å; L3730-L3734 PolarHBondContact O-N 3.28Å; E3731-L3734 PolarHBondContact O-N 3.22Å; L3734-A3738 HydrophobicContact CB-CB 3.95Å
3735	G	52	Low	55.9	Low	37 Å²	37	130.5 Å²	130.5	38%	0.381	66%	0.655	S	S	.	*			trans	75.3	163.9	174.7	0	0	0	0	0	114.6	E3731 H3737 A3738	E3731-G3735 PolarHBondContact O-N 3.08Å; G3735-H3737 PolarHBondContact O-N 3.37Å; G3735-A3738 PolarHBondContact O-N 3.07Å; G3735-A3738 VanDerWaalsContact O-N 3.1Å
3736	R	43.5	Very low	53.8	Low	243 Å²	243	127.2 Å²	127.2	92%	0.917	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	0.9	-167.4	-65.7	-175.7	177.5	177.3	-1.3	116.8
3737	H	49.6	Very low	52.2	Low	194 Å²	194	134.4 Å²	134.4	90%	0.898	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.1	0.9	178	-64.2	91.5	0	0	0	113.4	G3735	G3735-H3737 PolarHBondContact O-N 3.37Å
3738	A	43.6	Very low	50	Low	53 Å²	53	139.9 Å²	139.9	44%	0.438	70%	0.697	S	S	.	*			trans	-105.4	39.2	176.5	0	0	0	0	0	112.5	L3734 G3735 I3740	L3734-A3738 HydrophobicContact CB-CB 3.95Å; G3735-A3738 PolarHBondContact O-N 3.07Å; G3735-A3738 VanDerWaalsContact O-N 3.1Å; A3738-I3740 PolarHBondContact O-N 3.29Å; A3738-I3740 VanDerWaalsContact O-N 3.09Å
3739	Q	36	Very low	48.3	Very low	169 Å²	169	143.3 Å²	143.3	79%	0.79	72%	0.715	S	S	*	*			trans	-76.8	97.4	-173.2	-168.3	175.3	36.7	0	0	112.2	Q3741	Q3739-Q3741 PolarHBondContact O-N 3.08Å
3740	I	43.3	Very low	46.3	Very low	150 Å²	150	151.6 Å²	151.6	77%	0.769	74%	0.741	S	S	*	*			trans	-71.4	124.3	165	-59.9	177.4	0	0	0	107.7	A3738	A3738-I3740 PolarHBondContact O-N 3.29Å; A3738-I3740 VanDerWaalsContact O-N 3.09Å
3741	Q	33.5	Very low	44.3	Very low	169 Å²	169	154.7 Å²	154.7	79%	0.79	75%	0.751	S	S	*	*			trans	-66.7	131.5	-178.3	-65.2	-173	11.9	0	0	111.1	Q3739 N3743	Q3739-Q3741 PolarHBondContact O-N 3.08Å; Q3741-N3743 PolarHBondContact O-N 3.06Å; Q3741-N3743 VanDerWaalsContact O-N 3.16Å
3742	P	44.5	Very low	42.7	Very low	115 Å²	115	157 Å²	157	75%	0.747	76%	0.759	S	S	*	*			trans	-69	113.9	175	27.8	-33.2	0	0	0	109.6	K3744	P3742-K3744 PolarHBondContact O-N 3.38Å
3743	N	37.1	Very low	40.8	Very low	160 Å²	160	154.9 Å²	154.9	86%	0.856	76%	0.757	S	S	*	*			trans	-68.8	116.6	-176.6	-156.2	1.4	0	0	0	109.7	Q3741 V3745	Q3741-N3743 PolarHBondContact O-N 3.06Å; Q3741-N3743 VanDerWaalsContact O-N 3.16Å; N3743-V3745 PolarHBondContact O-N 3.09Å
3744	K	36.9	Very low	39.3	Very low	195 Å²	195	160.1 Å²	160.1	85%	0.848	78%	0.777	S	S	*	*			trans	-68.7	114.4	-168.5	-71.9	178.5	179.5	172.9	0	110.9	P3742 G3746	P3742-K3744 PolarHBondContact O-N 3.38Å; K3744-G3746 PolarHBondContact O-N 2.99Å
3745	V	38.4	Very low	38	Very low	141 Å²	141	160.3 Å²	160.3	86%	0.855	79%	0.785	S	S	*	*			trans	-64.5	103	171.2	-179.9	0	0	0	0	109.3	N3743 K3747	N3743-V3745 PolarHBondContact O-N 3.09Å; V3745-K3747 PolarHBondContact O-N 3.1Å
3746	G	35	Very low	37	Very low	68 Å²	68	171.9 Å²	171.9	70%	0.701	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-63	128	176.7	0	0	0	0	0	111.3	K3744 R3748	K3744-G3746 PolarHBondContact O-N 2.99Å; G3746-R3748 PolarHBondContact O-N 3.41Å
3747	K	38.9	Very low	36.7	Very low	202 Å²	202	168.3 Å²	168.3	88%	0.878	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-65.6	126.4	178.1	-67.8	-176.3	178.4	-178.1	0	110.2	V3745 K3749	V3745-K3747 PolarHBondContact O-N 3.1Å; K3747-K3749 PolarHBondContact O-N 3.22Å
3748	R	30.1	Very low	36	Very low	251 Å²	251	166.9 Å²	166.9	95%	0.947	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-47.6	122.2	168.3	-82	176.2	160.7	175.1	-6.8	110.7	G3746	G3746-R3748 PolarHBondContact O-N 3.41Å
3749	K	37.2	Very low	35.6	Very low	205 Å²	205	173.3 Å²	173.3	89%	0.891	84%	0.837	S	S	*	*			trans	-120.3	143.4	151.2	-89.2	-171.6	171.2	-176.2	0	108.3	K3747	K3747-K3749 PolarHBondContact O-N 3.22Å
3750	R	34.8	Very low	35.5	Very low	245 Å²	245	173.5 Å²	173.5	93%	0.925	84%	0.84	S	S	*	*			trans	-69.6	150.1	-174.1	-79.4	175.3	163.6	166.7	-7.4	112.1
3751	F	28.7	Very low	35.1	Very low	161 Å²	161	175 Å²	175	71%	0.706	85%	0.845	S	S	*	*			trans	-4.6	133.3	145.8	-74	-94.9	0	0	0	117.1	E3288	E3288-F3751 WeakPolarHBondContact OE1-CZ 3.49Å
3752	K	35.5	Very low	35.2	Very low	197 Å²	197	175.4 Å²	175.4	86%	0.857	85%	0.848	S	S	*	*				-155	107.3	111.1	-113.9	178.3	-179.4	-175.7	0	113.9
3753	S	33.2	Very low	34.5	Very low	96 Å²	96	179.7 Å²	179.7	67%	0.671	86%	0.855	S	S	*	*			trans	69.4	132.8	132.9	69.3	0	0	0	0	122.9
3754	K	32.6	Very low	34.3	Very low	202 Å²	202	181.2 Å²	181.2	88%	0.878	86%	0.855	S	S	*	*			trans	101	144.3	150.6	-70.9	-171.1	173.9	-172.9	0	118.1
3755	P	33.4	Very low	34.1	Very low	114 Å²	114	180.1 Å²	180.1	74%	0.74	86%	0.856	S	S	*	*			trans	-131.7	164.5	-143.5	40.4	-22.9	0	0	0	115.7
3756	F	31.2	Very low	33.7	Very low	279 Å²	279	183.6 Å²	183.6	100%	1.224	86%	0.856	S	S	*	*			trans	-148.9	0	131.1	-125.8	-76.5	0	0	0	108.7

Retrieved 3,756 of 3,756 residues in 1452.8 ms (Link to these results)

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