A0A077YZ19_TRITR Loading...

Laminin EGF and Laminin B and Laminin N domain co ntaining protein

AlphaFold DB , UniProt , Accession A0A077YZ19, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,964 aa.

						>A0A077YZ19_TRITR|A0A077YZ19
MASLRWALFILVLARNMGISCSQVLNPPYFNLAEAKKITVTSTCGEQNGQPIRELYCSLAGATRYSPYEGYYSYNYEDDLVSLRVPGEDPASLENRKPLLHASEGQPFGGQNCEYCDAANPELRHPAEYMVDGTPRYWQSPPLSRGMDYNQVNITIDLEQEFHVAYVSLQMANSPRPGLWVLERSTDHGKTYLPWQYFAETPAQCEEFFGPDSLQPIMDDDSVICTTEYSQIIPLGNGQIFITLLNNRPGRGNFSHSDKLQRFTRATNVRIRLLRTKTLQGHLMDLNDKKDPTITRRVRFHSFILAVNNKWSLQYFYSIKEIEMGGRCVCHGHAQTCDILDPLRPTRLLCRCEHNTCGDQCEQCCPGFMQKRWRPVREGQIFECEPCNCFGHSTECEYDPEVDANQKSLDIHGQYKGGGVCKNCGHNTTGINCETCKPGFFRPAGRQRESLDACIPCQCDSPFFDGSCDLETGRCHCAKQFQPPDCDACSYGYYNFPGCEECACFLPGSEGAPQGEQCPCKINFNGKHCNTCSDGYHSFPLCAACACSQPGSVDNICNSTTGHCSCKMNYNGTACERCSSGYFNYPKCTFCNCNTAGALPEICNDTTGACKCKPTHAGNSCDRCRDGYFQFPICEACLCSLDGAFSGFCNTQTGQCQCKPNYTGRKCDHCAAGYYGFPRCLGEPDAQTTCECNRYGSLGTTCTDEGHCFCKAGFTGAKCDRCKENFFNYPLCEEGSLCSCKSQVTGRRCQQCKPFHWNLQYHNLQGCEPCNCYVQGTLSSLTDCDHLSGQCQCKLNTLGRDCSQCKPGFYAMNQSNPFGCEPCDCDSGGSYSHICESRTGQCHCKPRVGGRRCNEPIEAHFFPILQHIKYEAEDGFSPDYKAIRYATDEKTFPKFSGKGFVRFNYDSSVHLHEKEGKQQIEVRLPRAPEPVSTLLKTPSGQPYPLVLNPGKWMLKVKTARRFFLAYTLRIDGISPGNYTLLVSYQNFEPNMVPADVKPDDDPLSSGSIIFEHCPYSCFGYSFLPIPESMLIEIESGYRNQSVTGHDSGIEVYDESLPYDDVAPESANAIANLRFCPSVSGCRSIAYSKDDESSAAFDIVDKFDLSVFQNNVSGNTTYLDYLFVIPLKSYSDDLLIPQSVEHLQHSLANCSQHLSEPLLHMKTIDEECKKLIFSLTVDFNAGAMSCDCNLEGSTSFICERYGGQCQCMQNVVGRQCDKCRSGYFGFPECKPCNCSRNFMCDPSTGSCYCPPLTEGNKCDRCKVHAYGFDPLIGCQECHCSVVGTIEQSLNCDETNGQCSCMKNVGGRRCEKCLAGFYGYPHCYECACDLSGSNAEICEQNSATCLCKVFQPLLKILRRATSDYLQENVIGSTCATCAPGTFNLARDNEKGCTECFCFGVTDNCRSSTFKKTSIIDMYGWKVPTWAGKHRQIETDGKVEVVFDETDLIGQNGKLVYLFSPISYLGNRLLSYGGRIEYMVMAMPAQEESAITVSPDLIMRGNNMSIEYWSENQPSSFESYFSIQTTLLPAVSMDSADENDLAEGELAASNVEVCHCPTPYKGTSCEVCSFYGALKLLQECAEGFYRVGSGPLLGSCVPCRCNGHSESCDRITGRCFDCKHNTTGDNCELCDRGFHGVATFGTPFDCQLCPCPHPTMENNFALDCTVSEIGNLLACHCEEGYTGERCERCATGWYGKPYRSGNKCQRCFCNDNNDLSVENACDPESGRCLFCMNNTDGFHCDECSPWFYGDAKEGKNCTACSCDRCGAEKCEAQTGKCKCKRNVEGENCDHCISNAWGFHYCQGCQMCNCAAASVSGQCDLQMGQCPCQSGASGLFCDRCAEGYWNYSVSGCQKCDCESDLAMGTICDTATGQCQCMEGATGVRCENCLPGYMVIPHHGCQVCDECVLGLVEDMQQTARRFDEMELDLQNVTMEQVSSRRLNRLQSATNSLEVTGGQFGFKACNRSFP
					

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(Predicted Aligned Error values between residue pairs)

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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	38.9	Very low	46.6	Very low	202 Å²	202	124.9 Å²	124.9	100%	0.995	63%	0.632	S	S	*	*				0	-57.5	0	-78.3	-161.4	-90.1	0	0	112.3	S3 L4	M1-S3 PolarHBondContact O-N 2.92Å; M1-L4 PolarHBondContact O-N 2.98Å
2	A	36.6	Very low	46.7	Very low	76 Å²	76	121.5 Å²	121.5	63%	0.628	62%	0.622	S	S	*	*	H	α-helix	trans	-52	-40.8	176.6	0	0	0	0	0	113.6	L4 R5 W6	A2-L4 VanDerWaalsContact C-N 3.3Å; A2-L4 PolarHBondContact O-N 3.27Å; A2-R5 PolarHBondContact O-N 3.18Å; A2-W6 PolarHBondContact O-N 2.99Å
3	S	40.3	Very low	46.6	Very low	85 Å²	85	119.8 Å²	119.8	59%	0.594	61%	0.614	S	S	*	*	H	α-helix	trans	-58.2	-29.6	176.1	37.8	0	0	0	0	115.3	M1 A7	M1-S3 PolarHBondContact O-N 2.92Å; S3-A7 WeakPolarHBondContact O-CB 3.14Å; S3-A7 PolarHBondContact O-N 3.46Å
4	L	42.2	Very low	46.2	Very low	120 Å²	120	115.5 Å²	115.5	63%	0.628	61%	0.605	S	S	*	*	H	α-helix	trans	-74.4	-30.6	173.8	-92.9	79.1	0	0	0	112.2	M1 A2 L8	M1-L4 PolarHBondContact O-N 2.98Å; A2-L4 VanDerWaalsContact C-N 3.3Å; A2-L4 PolarHBondContact O-N 3.27Å; L4-L8 WeakPolarHBondContact O-CB 3.14Å; L4-L8 PolarHBondContact O-N 3.1Å
5	R	44.1	Very low	45.9	Very low	209 Å²	209	122.9 Å²	122.9	79%	0.789	62%	0.622	S	S	*	*	H	α-helix	trans	-72.2	-38	176.9	-73.9	-171.8	171.5	-170.8	-3.8	111.7	A2 L8 F9	A2-R5 PolarHBondContact O-N 3.18Å; R5-L8 PolarHBondContact O-N 2.65Å; R5-F9 WeakPolarHBondContact O-CB 3.49Å; R5-F9 PolarHBondContact O-N 2.81Å
6	W	47.6	Very low	45.3	Very low	185 Å²	185	123.5 Å²	123.5	70%	0.701	63%	0.627	S	S	*	*	H	α-helix	trans	-66.5	-41.8	170.6	-90.9	87.4	0	0	0	112.6	A2 L8 F9 I10	A2-W6 PolarHBondContact O-N 2.99Å; W6-L8 VanDerWaalsContact C-N 3.33Å; W6-L8 PolarHBondContact O-N 3.14Å; W6-F9 PolarHBondContact O-N 3.36Å; W6-F9 VanDerWaalsContact O-N 3.16Å; W6-I10 HydrophobicContact CE3-CD1 4.29Å; W6-I10 WeakPolarHBondContact O-CG1 3.2Å; W6-I10 PolarHBondContact O-N 2.82Å
7	A	50.3	Low	44.6	Very low	47 Å²	47	125.4 Å²	125.4	39%	0.388	64%	0.635	S	S	.	*	H	α-helix	trans	-61.1	-40.1	174.2	0	0	0	0	0	112.5	S3 L11	S3-A7 WeakPolarHBondContact O-CB 3.14Å; S3-A7 PolarHBondContact O-N 3.46Å; A7-L11 WeakPolarHBondContact O-CB 3.3Å; A7-L11 VanDerWaalsContact O-CG 3.3Å; A7-L11 WeakPolarHBondContact O-CG 3.49Å; A7-L11 PolarHBondContact O-N 2.82Å
8	L	51.5	Low	43.8	Very low	110 Å²	110	122.4 Å²	122.4	58%	0.576	64%	0.641	S	S	*	*	H	α-helix	trans	-66.1	-37.7	172.7	-95.2	147.5	0	0	0	112.8	L4 R5 W6 L11 V12	L4-L8 WeakPolarHBondContact O-CB 3.14Å; L4-L8 PolarHBondContact O-N 3.1Å; R5-L8 PolarHBondContact O-N 2.65Å; W6-L8 VanDerWaalsContact C-N 3.33Å; W6-L8 PolarHBondContact O-N 3.14Å; L8-L11 PolarHBondContact O-N 3.13Å; L8-V12 WeakPolarHBondContact O-CB 3.23Å; L8-V12 VanDerWaalsContact O-CG2 3.29Å; L8-V12 WeakPolarHBondContact O-CG2 3.42Å; L8-V12 PolarHBondContact O-N 3.18Å
9	F	54.3	Low	43	Very low	134 Å²	134	124.7 Å²	124.7	59%	0.588	65%	0.652	S	S	*	*	H	α-helix	trans	-66.3	-44	175.9	-149	-98.1	0	0	0	111.4	R5 W6 V12 L13	R5-F9 WeakPolarHBondContact O-CB 3.49Å; R5-F9 PolarHBondContact O-N 2.81Å; W6-F9 PolarHBondContact O-N 3.36Å; W6-F9 VanDerWaalsContact O-N 3.16Å; F9-V12 PolarHBondContact O-N 3.35Å; F9-L13 HydrophobicContact CD1-CD1 3.84Å; F9-L13 HydrophobicContact CD1-CG 4.4Å; F9-L13 HydrophobicContact CE1-CD1 4.07Å; F9-L13 WeakPolarHBondContact O-CG 3.15Å; F9-L13 PolarHBondContact O-N 2.95Å
10	I	54.1	Low	42.3	Very low	97 Å²	97	122.8 Å²	122.8	50%	0.497	65%	0.65	S	S	.	*	H	α-helix	trans	-65.6	-37.5	175.2	-67.7	168.3	0	0	0	111.2	W6 V12 L13 A14	W6-I10 HydrophobicContact CE3-CD1 4.29Å; W6-I10 WeakPolarHBondContact O-CG1 3.2Å; W6-I10 PolarHBondContact O-N 2.82Å; I10-V12 VanDerWaalsContact C-N 3.34Å; I10-V12 PolarHBondContact O-N 3.12Å; I10-L13 PolarHBondContact O-N 3.47Å; I10-A14 VanDerWaalsContact O-CB 3.22Å; I10-A14 WeakPolarHBondContact O-CB 2.99Å; I10-A14 PolarHBondContact O-N 2.05Å
11	L	52.3	Low	41.8	Very low	109 Å²	109	122.2 Å²	122.2	57%	0.571	66%	0.655	S	S	*	*	H	α-helix	trans	-69	-28.9	173.8	-78.6	165.7	0	0	0	113.3	A7 L8 R15	A7-L11 WeakPolarHBondContact O-CB 3.3Å; A7-L11 VanDerWaalsContact O-CG 3.3Å; A7-L11 WeakPolarHBondContact O-CG 3.49Å; A7-L11 PolarHBondContact O-N 2.82Å; L8-L11 PolarHBondContact O-N 3.13Å; L11-R15 WeakPolarHBondContact O-CB 3.23Å; L11-R15 WeakPolarHBondContact O-CG 3.35Å; L11-R15 PolarHBondContact O-N 3.43Å; L11-R15 VanDerWaalsContact O-N 3.1Å
12	V	47.9	Very low	41.8	Very low	84 Å²	84	114.1 Å²	114.1	51%	0.509	62%	0.618	S	S	.	*	H	α-helix	trans	-75.5	-35.4	172.4	167.6	0	0	0	0	111.3	L8 F9 I10 N16	L8-V12 WeakPolarHBondContact O-CB 3.23Å; L8-V12 VanDerWaalsContact O-CG2 3.29Å; L8-V12 WeakPolarHBondContact O-CG2 3.42Å; L8-V12 PolarHBondContact O-N 3.18Å; F9-V12 PolarHBondContact O-N 3.35Å; I10-V12 VanDerWaalsContact C-N 3.34Å; I10-V12 PolarHBondContact O-N 3.12Å; V12-N16 PolarHBondContact O-ND2 2.73Å
13	L	45.4	Very low	42.5	Very low	100 Å²	100	117.3 Å²	117.3	52%	0.524	62%	0.62	S	S	.	*	H	α-helix	trans	-71.2	-45.9	172.8	-68.5	169.9	0	0	0	111.9	F9 I10 R15 N16	F9-L13 HydrophobicContact CD1-CD1 3.84Å; F9-L13 HydrophobicContact CD1-CG 4.4Å; F9-L13 HydrophobicContact CE1-CD1 4.07Å; F9-L13 WeakPolarHBondContact O-CG 3.15Å; F9-L13 PolarHBondContact O-N 2.95Å; I10-L13 PolarHBondContact O-N 3.47Å; L13-R15 VanDerWaalsContact C-N 3.29Å; L13-R15 PolarHBondContact O-N 2.94Å; L13-N16 WeakPolarHBondContact O-CA 3.22Å; L13-N16 WeakPolarHBondContact O-CB 3.49Å; L13-N16 PolarHBondContact O-N 2.85Å
14	A	41.3	Very low	43.3	Very low	59 Å²	59	115.2 Å²	115.2	49%	0.488	60%	0.603	S	S	.	*	H	α-helix	trans	-64.7	-30.3	177.8	0	0	0	0	0	112.9	I10 N16 M17	I10-A14 VanDerWaalsContact O-CB 3.22Å; I10-A14 WeakPolarHBondContact O-CB 2.99Å; I10-A14 PolarHBondContact O-N 2.05Å; A14-N16 PolarHBondContact O-N 2.93Å; A14-M17 PolarHBondContact O-N 3.43Å
15	R	41.4	Very low	44.4	Very low	227 Å²	227	110.6 Å²	110.6	86%	0.857	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-10.7	169.8	-91.5	-173.9	162.2	-162.2	-7	114.5	L11 L13	L11-R15 WeakPolarHBondContact O-CB 3.23Å; L11-R15 WeakPolarHBondContact O-CG 3.35Å; L11-R15 PolarHBondContact O-N 3.43Å; L11-R15 VanDerWaalsContact O-N 3.1Å; L13-R15 VanDerWaalsContact C-N 3.29Å; L13-R15 PolarHBondContact O-N 2.94Å
16	N	35.9	Very low	45.6	Very low	132 Å²	132	103.3 Å²	103.3	71%	0.706	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.4	8.3	171.7	-69.2	-74.1	0	0	0	113	V12 L13 A14	V12-N16 PolarHBondContact O-ND2 2.73Å; L13-N16 WeakPolarHBondContact O-CA 3.22Å; L13-N16 WeakPolarHBondContact O-CB 3.49Å; L13-N16 PolarHBondContact O-N 2.85Å; A14-N16 PolarHBondContact O-N 2.93Å
17	M	33.7	Very low	47.1	Very low	155 Å²	155	94.7 Å²	94.7	76%	0.764	52%	0.524	S	S	*	.			trans	-122.6	53.9	178.3	-72.5	-173.7	160.2	0	0	112.1	A14 I19	A14-M17 PolarHBondContact O-N 3.43Å; M17-I19 PolarHBondContact O-N 2.69Å
18	G	29.7	Very low	48.1	Very low	72 Å²	72	96.6 Å²	96.6	74%	0.742	53%	0.532	S	S	*	.			trans	-79.6	93.6	164.5	0	0	0	0	0	110.4	S20	G18-S20 VanDerWaalsContact C-N 3.29Å; G18-S20 PolarHBondContact O-N 2.96Å
19	I	29.9	Very low	49.4	Very low	166 Å²	166	96.7 Å²	96.7	85%	0.851	53%	0.526	S	S	*	.			trans	-72.8	85.8	175.4	-55.5	177.5	0	0	0	108.9	M17	M17-I19 PolarHBondContact O-N 2.69Å
20	S	28.7	Very low	50.8	Low	87 Å²	87	94 Å²	94	61%	0.608	51%	0.514	S	S	*	.			trans	-78.6	117.6	166.7	-172	0	0	0	0	108.9	G18 S22	G18-S20 VanDerWaalsContact C-N 3.29Å; G18-S20 PolarHBondContact O-N 2.96Å; S20-S22 PolarHBondContact O-N 2.98Å; S20-S22 PolarHBondContact O-OG 3.16Å; S20-S22 VanDerWaalsContact O-OG 3.07Å
21	C	32.3	Very low	52.2	Low	110 Å²	110	91.6 Å²	91.6	74%	0.743	50%	0.502	S	S	*	.			trans	-72.6	80.6	179.5	-163.2	0	0	0	0	110.3	Q23	C21-Q23 PolarHBondContact O-N 2.95Å
22	S	38.1	Very low	54	Low	33 Å²	33	86.6 Å²	86.6	23%	0.231	48%	0.476	C	S	.	.			trans	-80.5	83.1	-171.7	-58.6	0	0	0	0	110.3	S20	S20-S22 PolarHBondContact O-N 2.98Å; S20-S22 PolarHBondContact O-OG 3.16Å; S20-S22 VanDerWaalsContact O-OG 3.07Å
23	Q	51.4	Low	55.9	Low	143 Å²	143	82.6 Å²	82.6	67%	0.668	45%	0.452	S	S	*	.			trans	-69.1	131.9	-179.8	-68	-171.7	-28.7	0	0	111.4	C21 L25	C21-Q23 PolarHBondContact O-N 2.95Å; Q23-L25 PolarHBondContact O-N 3.44Å
24	V	56.4	Low	57.8	Low	40 Å²	40	83.7 Å²	83.7	24%	0.242	45%	0.454	C	S	.	.			trans	-81.4	108.3	175.5	-169.3	0	0	0	0	108.6	N26 V376	V24-N26 VanDerWaalsContact CG1-ND2 3.32Å; V24-N26 WeakPolarHBondContact CG1-ND2 3.08Å; V24-N26 PolarHBondContact O-N 2.82Å; V24-N26 PolarHBondContact O-ND2 3.3Å; V24-V376 HydrophobicContact CB-CG1 4.26Å; V24-V376 HydrophobicContact CG1-CB 4.09Å; V24-V376 HydrophobicContact CG1-CG1 3.86Å; V24-V376 HydrophobicContact CG2-CG1 4Å
25	L	65.5	Low	59.8	Low	24 Å²	24	85.3 Å²	85.3	13%	0.126	47%	0.467	C	S	.	.	B	Isolated β-bridge	trans	-74	112.8	-175.4	-54.1	178.5	0	0	0	110.1	Q23 G332 A334 E353	Q23-L25 PolarHBondContact O-N 3.44Å; L25-G332 WeakPolarHBondContact CB-O 3.36Å; L25-G332 PolarHBondContact N-O 3.48Å; L25-G332 CarbonylContact O-C 3.45Å; L25-G332 WeakPolarHBondContact O-CA 3.48Å; L25-G332 VanDerWaalsContact O-O 3.12Å; L25-A334 CarbonylContact C-O 3.58Å; L25-A334 VanDerWaalsContact O-O 3.12Å; L25-E353 HydrophobicContact CD1-CB 3.9Å; L25-E353 HydrophobicContact CD1-CG 4.19Å
26	N	70.6	Confident	61.9	Low	55 Å²	55	76.3 Å²	76.3	29%	0.294	43%	0.434	S	S	.	.			trans	-130.9	138.6	-179.4	-69.9	-94.3	0	0	0	110.7	V24 R327 A334	V24-N26 VanDerWaalsContact CG1-ND2 3.32Å; V24-N26 WeakPolarHBondContact CG1-ND2 3.08Å; V24-N26 PolarHBondContact O-N 2.82Å; V24-N26 PolarHBondContact O-ND2 3.3Å; N26-R327 VanDerWaalsContact CB-NH1 3.33Å; N26-R327 PolarHBondContact OD1-NH1 3.36Å; N26-R327 PolarHBondContact OD1-NH2 2.91Å; N26-A334 CarbonylContact C-O 3.56Å; N26-A334 PolarHBondContact N-O 3.38Å
27	P	77.4	Confident	64.5	Low	4 Å²	4	76.4 Å²	76.4	3%	0.026	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-62.8	153.4	170.2	-22.1	34.2	0	0	0	113.1	R327 C328 C330 A334 Q335	P27-R327 HydrophobicContact CB-CB 4.47Å; P27-R327 WeakPolarHBondContact O-CD 3.41Å; P27-C328 HydrophobicContact CG-CB 4.12Å; P27-C330 HydrophobicContact CG-CB 4.27Å; P27-C330 WeakPolarHBondContact CG-SG 3.43Å; P27-A334 WeakPolarHBondContact CD-O 3.45Å; P27-Q335 WeakPolarHBondContact CA-O 3.07Å
28	P	73.3	Confident	67.4	Low	88 Å²	88	69.6 Å²	69.6	57%	0.571	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-66	162.1	173.8	29.7	-35.9	0	0	0	112	R327	P28-R327 VanDerWaalsContact O-CB 3.32Å; P28-R327 WeakPolarHBondContact O-CB 3.46Å
29	Y	78.6	Confident	70.4	Confident	112 Å²	112	69.5 Å²	69.5	44%	0.439	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-83.5	139.2	172.2	-72.3	-76.2	0	0	0	111.3	A165 G326 R327	Y29-A165 HydrophobicContact CD1-CB 4.33Å; Y29-A165 HydrophobicContact CE1-CB 3.68Å; Y29-G326 WeakPolarHBondContact CA-O 3.34Å; Y29-R327 HydrophobicContact CD1-CB 4.09Å; Y29-R327 HydrophobicContact CD1-CG 4.26Å; Y29-R327 HydrophobicContact CE1-CB 4.23Å; Y29-R327 HydrophobicContact CE1-CG 3.87Å
30	F	82.4	Confident	73.4	Confident	78 Å²	78	63.3 Å²	63.3	34%	0.342	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	172.8	173.9	58.8	-83.7	0	0	0	110.7	L32 F162 G326 L348	F30-L32 HydrophobicContact CD2-CD2 4.04Å; F30-L32 HydrophobicContact CE1-CD2 4.37Å; F30-L32 HydrophobicContact CE2-CD2 3.55Å; F30-L32 HydrophobicContact CZ-CD2 3.73Å; F30-L32 PolarHBondContact O-N 3.2Å; F30-F162 HydrophobicContact CZ-CD1 4.49Å; F30-F162 AromaticContact CZ-CE1 3.85Å; F30-F162 HydrophobicContact CZ-CE1 3.85Å; F30-G326 PolarHBondContact N-O 3.32Å; F30-G326 PolarHBondContact O-N 2.88Å; F30-L348 HydrophobicContact CE2-CD1 4.1Å; F30-L348 HydrophobicContact CZ-CD1 3.66Å
31	N	84.9	Confident	76.5	Confident	46 Å²	46	63.2 Å²	63.2	25%	0.246	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	110.3	176.5	-172.9	5	0	0	0	110.2	A33 E34 E323 M324	N31-A33 VanDerWaalsContact C-N 3.33Å; N31-A33 PolarHBondContact OD1-N 3.42Å; N31-A33 VanDerWaalsContact OD1-N 3.1Å; N31-E34 HydrophobicContact CB-CB 4.25Å; N31-E323 WeakPolarHBondContact OD1-CA 3.3Å; N31-M324 PolarHBondContact OD1-N 3.25Å
32	L	89.4	Confident	79.2	Confident	3 Å²	3	58.8 Å²	58.8	2%	0.016	32%	0.316	C	S	.	.	S	Bend	trans	-77.7	-15.8	179.5	-60.1	-180	0	0	0	113.8	F30 K36 L158 F162 V164 M324	F30-L32 HydrophobicContact CD2-CD2 4.04Å; F30-L32 HydrophobicContact CE1-CD2 4.37Å; F30-L32 HydrophobicContact CE2-CD2 3.55Å; F30-L32 HydrophobicContact CZ-CD2 3.73Å; F30-L32 PolarHBondContact O-N 3.2Å; L32-K36 WeakPolarHBondContact O-CG 3.44Å; L32-L158 HydrophobicContact CB-CD2 4.19Å; L32-L158 WeakPolarHBondContact O-CD2 3.42Å; L32-F162 HydrophobicContact CD1-CB 3.46Å; L32-F162 VanDerWaalsContact CD1-CB 3.46Å; L32-F162 HydrophobicContact CD1-CD1 4.33Å; L32-F162 HydrophobicContact CD1-CD2 4.26Å; L32-F162 HydrophobicContact CD1-CG 3.8Å; L32-F162 HydrophobicContact CD2-CB 4.21Å; L32-F162 HydrophobicContact CD2-CD1 3.46Å; L32-F162 VanDerWaalsContact CD2-CD1 3.46Å; L32-F162 HydrophobicContact CD2-CD2 4.1Å; L32-F162 HydrophobicContact CD2-CE1 3.71Å; L32-F162 HydrophobicContact CD2-CE2 4.29Å; L32-F162 HydrophobicContact CD2-CG 3.68Å; L32-F162 HydrophobicContact CD2-CZ 4.11Å; L32-F162 HydrophobicContact CG-CB 4.49Å; L32-F162 HydrophobicContact CG-CG 4.37Å; L32-V164 HydrophobicContact CD1-CG2 3.91Å; L32-M324 HydrophobicContact CB-CB 4.1Å; L32-M324 WeakPolarHBondContact CB-O 3.27Å; L32-M324 WeakPolarHBondContact CG-O 3.22Å; L32-M324 PolarHBondContact N-O 3.39Å
33	A	88.6	Confident	81.8	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.309	C	S	.	.	S	Bend	trans	-88.9	-23.6	-178.1	0	0	0	0	0	112.9	N31 A35 K36 V131 I322 M324	N31-A33 VanDerWaalsContact C-N 3.33Å; N31-A33 PolarHBondContact OD1-N 3.42Å; N31-A33 VanDerWaalsContact OD1-N 3.1Å; A33-A35 PolarHBondContact O-N 3.08Å; A33-K36 WeakPolarHBondContact O-CB 3.43Å; A33-K36 PolarHBondContact O-N 2.93Å; A33-K36 VanDerWaalsContact O-N 3.07Å; A33-V131 HydrophobicContact CB-CG1 4.24Å; A33-V131 WeakPolarHBondContact O-CB 3.49Å; A33-I322 HydrophobicContact CB-CG2 4.36Å; A33-I322 WeakPolarHBondContact CB-O 3.41Å; A33-M324 HydrophobicContact CB-CB 4.15Å; A33-M324 HydrophobicContact CB-CG 4Å; A33-M324 HydrophobicContact CB-SD 4.41Å
34	E	84.9	Confident	83.7	Confident	124 Å²	124	51.1 Å²	51.1	58%	0.579	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	127.1	-175.8	-166.4	175.9	160.1	0	0	112	N31 K36	N31-E34 HydrophobicContact CB-CB 4.25Å; E34-K36 PolarHBondContact O-N 3.46Å
35	A	81.7	Confident	85.3	Confident	92 Å²	92	49.2 Å²	49.2	76%	0.76	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	13.3	-175.9	0	0	0	0	0	115.8	A33 V131	A33-A35 PolarHBondContact O-N 3.08Å; A35-V131 PolarHBondContact N-O 2.8Å
36	K	87.2	Confident	86.3	Confident	38 Å²	38	51.8 Å²	51.8	17%	0.165	28%	0.278	C	S	.	.			trans	-76.9	155.1	176.1	-72.4	-50.3	-166.7	-172.6	0	112.5	L32 A33 E34 I38 I156 L158 E159	L32-K36 WeakPolarHBondContact O-CG 3.44Å; A33-K36 WeakPolarHBondContact O-CB 3.43Å; A33-K36 PolarHBondContact O-N 2.93Å; A33-K36 VanDerWaalsContact O-N 3.07Å; E34-K36 PolarHBondContact O-N 3.46Å; K36-I38 PolarHBondContact O-N 2.92Å; K36-I156 HydrophobicContact CB-CG2 4.16Å; K36-L158 WeakPolarHBondContact CE-O 3.19Å; K36-L158 HydrophobicContact CG-CD2 4.49Å; K36-E159 IonicContact NZ-OE2 3.62Å; K36-E159 PolarHBondContact NZ-OE2 3.33Å
37	K	90.2	Very high	86.8	Confident	135 Å²	135	53.5 Å²	53.5	59%	0.587	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68	115.2	177.3	178.3	-172.8	171.3	-161.4	0	109.8	D157	K37-D157 HydrophobicContact CB-CB 4.31Å; K37-D157 IonicContact NZ-OD2 2.71Å; K37-D157 PolarHBondContact O-N 3.5Å
38	I	93.8	Very high	86.9	Confident	12 Å²	12	60.8 Å²	60.8	6%	0.062	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	148.6	177.7	-169.9	161.1	0	0	0	110.4	K36 A127 M130 V131 I154 T155 I156 I322	K36-I38 PolarHBondContact O-N 2.92Å; I38-A127 HydrophobicContact CG1-CB 4.5Å; I38-A127 HydrophobicContact CG2-CB 3.92Å; I38-A127 WeakPolarHBondContact CG2-O 3.35Å; I38-M130 HydrophobicContact CD1-CB 4Å; I38-M130 HydrophobicContact CD1-CE 3.59Å; I38-M130 HydrophobicContact CD1-SD 4.3Å; I38-M130 HydrophobicContact CG1-CE 4.28Å; I38-V131 HydrophobicContact CB-CG2 4.16Å; I38-V131 HydrophobicContact CD1-CG1 3.86Å; I38-V131 HydrophobicContact CD1-CG2 4.48Å; I38-V131 HydrophobicContact CG2-CG2 3.68Å; I38-I154 HydrophobicContact CD1-CG2 3.8Å; I38-I154 HydrophobicContact CG1-CG2 4.03Å; I38-T155 CarbonylContact C-O 3.55Å; I38-T155 WeakPolarHBondContact CA-O 3.21Å; I38-I156 HydrophobicContact CB-CG1 4.21Å; I38-I156 HydrophobicContact CD1-CD1 3.99Å; I38-I156 HydrophobicContact CD1-CG1 3.63Å; I38-I156 HydrophobicContact CG1-CG1 3.74Å; I38-I322 HydrophobicContact CD1-CD1 4.3Å
39	T	93.6	Very high	86.7	Confident	70 Å²	70	59.4 Å²	59.4	43%	0.429	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	145.2	179.1	52.9	0	0	0	0	110.3	I154 T155	T39-I154 CarbonylContact O-C 3.52Å; T39-I154 WeakPolarHBondContact O-CA 3.45Å; T39-T155 PolarHBondContact N-O 2.98Å; T39-T155 PolarHBondContact O-N 2.04Å; T39-T155 PolarHBondContact OG1-O 2.87Å; T39-T155 VanDerWaalsContact OG1-O 3.11Å
40	V	92.9	Very high	86.7	Confident	36 Å²	36	60.4 Å²	60.4	22%	0.218	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	149.3	-178.4	-63	0	0	0	0	110.9	S42 T43 A127 M130 W138 N153 I154	V40-S42 VanDerWaalsContact C-N 3.32Å; V40-T43 VanDerWaalsContact CG2-OG1 3.31Å; V40-T43 WeakPolarHBondContact CG2-OG1 3.38Å; V40-A127 HydrophobicContact CB-CB 4.44Å; V40-A127 HydrophobicContact CG1-CB 3.7Å; V40-A127 HydrophobicContact CG2-CB 3.92Å; V40-M130 HydrophobicContact CG1-CE 3.73Å; V40-W138 HydrophobicContact CG1-CZ2 4.42Å; V40-N153 WeakPolarHBondContact CA-O 3.17Å; V40-I154 HydrophobicContact CG1-CB 4.3Å; V40-I154 HydrophobicContact CG1-CG1 3.99Å; V40-I154 HydrophobicContact CG1-CG2 4.08Å
41	T	92.7	Very high	86.6	Confident	85 Å²	85	60 Å²	60	52%	0.521	34%	0.338	S	S	.	.	S	Bend	trans	-74.1	-21.2	177.8	48.7	0	0	0	0	113.9	V152 N153	T41-V152 WeakPolarHBondContact OG1-CA 3.49Å; T41-N153 HydrophobicContact CG2-CB 3.79Å; T41-N153 PolarHBondContact N-O 2.94Å; T41-N153 VanDerWaalsContact N-O 3.11Å; T41-N153 PolarHBondContact OG1-N 2.9Å
42	S	90.2	Very high	86.8	Confident	16 Å²	16	60.2 Å²	60.2	11%	0.112	34%	0.339	C	S	.	.			trans	-163.1	133	179.5	58.4	0	0	0	0	112.3	V40 W138	V40-S42 VanDerWaalsContact C-N 3.32Å; S42-W138 WeakPolarHBondContact O-CZ2 3.5Å
43	T	92.6	Very high	86.5	Confident	15 Å²	15	67.3 Å²	67.3	9%	0.092	37%	0.365	C	S	.	.			trans	-116.6	148.6	171.1	-52.8	0	0	0	0	108.9	V40 H125 P141	V40-T43 VanDerWaalsContact CG2-OG1 3.31Å; V40-T43 WeakPolarHBondContact CG2-OG1 3.38Å; T43-H125 WeakPolarHBondContact CG2-O 3.22Å; T43-P141 WeakPolarHBondContact O-CG 3.3Å
44	C	91.8	Very high	86.1	Confident	1 Å²	1	67.9 Å²	67.9	1%	0.007	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	157.1	170.7	67.9	0	0	0	0	111.7	E46 E54 C116 Q139	C44-E46 PolarHBondContact O-N 3.3Å; C44-E54 WeakPolarHBondContact CA-OE2 3.45Å; C44-E54 WeakPolarHBondContact CB-OE2 3.38Å; C44-C116 HydrophobicContact CB-CB 3.68Å; C44-C116 WeakPolarHBondContact CB-SG 3.25Å; C44-C116 PolarHBondContact O-SG 2.83Å; C44-C116 WeakPolarHBondContact SG-CB 3.08Å; C44-C116 CovalentContact SG-SG 2.04Å; C44-C116 PolarHBondContact SG-SG 2.9Å; C44-Q139 PolarHBondContact N-O 2.79Å
45	G	88.4	Confident	86.1	Confident	0 Å²	0	65 Å²	65	0%	0	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.4	13.6	179.8	0	0	0	0	0	114.4	P51 I52 E54 A118	G45-P51 WeakPolarHBondContact O-CA 2.99Å; G45-I52 CarbonylContact C-O 3.54Å; G45-I52 VanDerWaalsContact C-O 3.28Å; G45-I52 WeakPolarHBondContact CA-O 2.97Å; G45-I52 PolarHBondContact O-N 3.25Å; G45-E54 PolarHBondContact N-OE1 2.91Å; G45-E54 VanDerWaalsContact N-OE1 3.16Å; G45-E54 PolarHBondContact N-OE2 3.11Å; G45-E54 VanDerWaalsContact N-OE2 3.12Å; G45-A118 VanDerWaalsContact O-CB 3.32Å; G45-A118 WeakPolarHBondContact O-CB 3.37Å
46	E	87.3	Confident	86.2	Confident	77 Å²	77	60.9 Å²	60.9	36%	0.36	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	133.3	180	-66.6	-172.4	-127.9	0	0	112.1	C44 A118 R145	C44-E46 PolarHBondContact O-N 3.3Å; E46-A118 HydrophobicContact CG-CB 3.54Å; E46-R145 PolarHBondContact O-NH1 3.4Å
47	Q	81.9	Confident	85.8	Confident	92 Å²	92	59.1 Å²	59.1	43%	0.43	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	116	171.6	-173.6	167.5	26.7	0	0	110.4	G49 Q50 I52	Q47-G49 PolarHBondContact O-N 3.44Å; Q47-Q50 PolarHBondContact N-O 2.69Å; Q47-Q50 WeakPolarHBondContact O-CB 3.47Å; Q47-Q50 PolarHBondContact O-N 2.82Å; Q47-I52 HydrophobicContact CB-CD1 3.7Å; Q47-I52 HydrophobicContact CB-CG1 4.15Å; Q47-I52 HydrophobicContact CB-CG2 4.31Å
48	N	78.2	Confident	84.8	Confident	157 Å²	157	54 Å²	54	84%	0.84	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	36.7	180	-53.8	-17.5	0	0	0	113.5	Q50	N48-Q50 VanDerWaalsContact C-N 3.27Å; N48-Q50 PolarHBondContact O-N 2.92Å
49	G	69.2	Low	83.4	Confident	58 Å²	58	55.3 Å²	55.3	60%	0.598	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	72	16.6	-176.4	0	0	0	0	0	114.5	Q47	Q47-G49 PolarHBondContact O-N 3.44Å
50	Q	78.5	Confident	81.3	Confident	133 Å²	133	55 Å²	55	62%	0.621	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.8	133.9	164.9	-63.5	-65.8	-86.5	0	0	109.2	Q47 N48	Q47-Q50 PolarHBondContact N-O 2.69Å; Q47-Q50 WeakPolarHBondContact O-CB 3.47Å; Q47-Q50 PolarHBondContact O-N 2.82Å; N48-Q50 VanDerWaalsContact C-N 3.27Å; N48-Q50 PolarHBondContact O-N 2.92Å
51	P	81.4	Confident	78.8	Confident	70 Å²	70	55.8 Å²	55.8	46%	0.455	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	135.5	173.4	29.1	-33.9	0	0	0	109.7	G45 A118 A119	G45-P51 WeakPolarHBondContact O-CA 2.99Å; P51-A118 HydrophobicContact CB-CB 4.2Å; P51-A119 HydrophobicContact CB-CB 3.98Å; P51-A119 HydrophobicContact CG-CB 4.29Å
52	I	87.7	Confident	75.8	Confident	51 Å²	51	56.8 Å²	56.8	26%	0.262	34%	0.339	S	S	.	.			trans	-133.8	161.9	173.4	58.9	162.4	0	0	0	109.2	G45 Q47 E54	G45-I52 CarbonylContact C-O 3.54Å; G45-I52 VanDerWaalsContact C-O 3.28Å; G45-I52 WeakPolarHBondContact CA-O 2.97Å; G45-I52 PolarHBondContact O-N 3.25Å; Q47-I52 HydrophobicContact CB-CD1 3.7Å; Q47-I52 HydrophobicContact CB-CG1 4.15Å; Q47-I52 HydrophobicContact CB-CG2 4.31Å; I52-E54 HydrophobicContact CD1-CG 3.97Å; I52-E54 WeakPolarHBondContact CD1-OE1 3.39Å; I52-E54 HydrophobicContact CG1-CG 4.27Å
53	R	83.9	Confident	72.7	Confident	151 Å²	151	60 Å²	60	57%	0.57	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.7	114.5	176.8	-179.1	168.8	167.8	178.2	-0	110.6	Y115 C116 D117	R53-Y115 HydrophobicContact CG-CD1 3.69Å; R53-Y115 HydrophobicContact CG-CE1 4.44Å; R53-Y115 HydrophobicContact CG-CG 4.32Å; R53-Y115 VanDerWaalsContact NE-CG 3.32Å; R53-Y115 VanDerWaalsContact NH2-CE2 3.29Å; R53-C116 WeakPolarHBondContact CA-O 3.41Å; R53-D117 HydrophobicContact CB-CB 4.38Å; R53-D117 HydrophobicContact CG-CB 4.29Å
54	E	80.3	Confident	69.5	Low	13 Å²	13	71 Å²	71	6%	0.061	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	155.6	-178.6	-71.3	171.8	-161.1	0	0	111.5	C44 G45 I52 Y115 C116 R145	C44-E54 WeakPolarHBondContact CA-OE2 3.45Å; C44-E54 WeakPolarHBondContact CB-OE2 3.38Å; G45-E54 PolarHBondContact N-OE1 2.91Å; G45-E54 VanDerWaalsContact N-OE1 3.16Å; G45-E54 PolarHBondContact N-OE2 3.11Å; G45-E54 VanDerWaalsContact N-OE2 3.12Å; I52-E54 HydrophobicContact CD1-CG 3.97Å; I52-E54 WeakPolarHBondContact CD1-OE1 3.39Å; I52-E54 HydrophobicContact CG1-CG 4.27Å; E54-Y115 CarbonylContact O-C 3.49Å; E54-Y115 WeakPolarHBondContact O-CA 3.42Å; E54-Y115 VanDerWaalsContact O-CD1 3.29Å; E54-Y115 WeakPolarHBondContact O-CD1 3.33Å; E54-C116 PolarHBondContact N-O 2.03Å; E54-C116 PolarHBondContact O-N 2.75Å; E54-R145 VanDerWaalsContact CD-CD 3.43Å; E54-R145 WeakPolarHBondContact OE1-CD 3.38Å; E54-R145 IonicContact OE1-CZ 2.66Å; E54-R145 IonicContact OE1-NE 3.69Å; E54-R145 IonicContact OE1-NH1 3.5Å; E54-R145 PolarHBondContact OE1-NH1 3.23Å
55	L	84	Confident	66.3	Low	62 Å²	62	81.4 Å²	81.4	33%	0.325	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	138.6	171.3	-174.5	77	0	0	0	108.6	C113 E114 Y115 L313	L55-C113 HydrophobicContact CD1-CB 4.41Å; L55-E114 WeakPolarHBondContact CD1-O 3.48Å; L55-Y115 HydrophobicContact CB-CD1 4.43Å; L55-Y115 HydrophobicContact CB-CE1 4.31Å; L55-Y115 HydrophobicContact CD1-CD1 4.15Å; L55-Y115 HydrophobicContact CD1-CD2 4.31Å; L55-Y115 HydrophobicContact CD1-CE1 3.87Å; L55-Y115 HydrophobicContact CD1-CE2 4.02Å; L55-Y115 HydrophobicContact CD1-CG 4.38Å; L55-L313 HydrophobicContact CB-CD2 4.31Å; L55-L313 HydrophobicContact CD2-CD1 3.99Å; L55-L313 HydrophobicContact CD2-CD2 4.4Å; L55-L313 HydrophobicContact CG-CD2 4.46Å; L55-L313 WeakPolarHBondContact O-CD2 3.44Å
56	Y	83.9	Confident	63.2	Low	6 Å²	6	86.4 Å²	86.4	2%	0.024	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	164.1	170.5	69	-90.2	0	0	0	110.1	C113 E114 C116 Y137 Q139 F316	Y56-C113 CarbonylContact O-C 3.47Å; Y56-C113 WeakPolarHBondContact O-CA 3.37Å; Y56-C113 WeakPolarHBondContact O-CB 3.43Å; Y56-E114 WeakPolarHBondContact CD1-O 3.17Å; Y56-E114 HydrophobicContact CE1-CB 3.96Å; Y56-E114 HydrophobicContact CE2-CB 4.14Å; Y56-E114 PolarHBondContact N-O 3.23Å; Y56-E114 PolarHBondContact O-N 2.02Å; Y56-E114 PolarHBondContact OH-OE2 3.01Å; Y56-C116 HydrophobicContact CD1-CB 4.06Å; Y56-C116 HydrophobicContact CE1-CB 4.11Å; Y56-Y137 PolarHBondContact OH-OH 2.84Å; Y56-Q139 VanDerWaalsContact CG-NE2 3.29Å; Y56-F316 HydrophobicContact CD2-CE1 4.04Å; Y56-F316 AromaticContact CD2-CZ 3.82Å; Y56-F316 HydrophobicContact CD2-CZ 3.82Å
57	C	78.6	Confident	60.4	Low	1 Å²	1	87.6 Å²	87.6	1%	0.007	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	121.4	-178.8	-64	0	0	0	0	112.8	N112 C113 L313 Q314	C57-N112 CarbonylContact C-O 3.54Å; C57-N112 WeakPolarHBondContact CA-O 3.24Å; C57-C113 HydrophobicContact CB-CB 4.06Å; C57-C113 WeakPolarHBondContact CB-SG 3.01Å; C57-C113 WeakPolarHBondContact SG-CB 3.36Å; C57-C113 CovalentContact SG-SG 2.04Å; C57-C113 PolarHBondContact SG-SG 2.92Å; C57-L313 HydrophobicContact CB-CB 4.15Å; C57-L313 PolarHBondContact N-O 3.47Å; C57-Q314 HydrophobicContact CB-CG 3.82Å; C57-Q314 VanDerWaalsContact O-CA 3.3Å; C57-Q314 WeakPolarHBondContact O-CA 3.45Å; C57-Q314 WeakPolarHBondContact O-CG 3.34Å
58	S	70.7	Confident	57.9	Low	29 Å²	29	88.9 Å²	88.9	20%	0.203	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	146.8	176.2	61.2	0	0	0	0	112.7	A60 Q111 N112	S58-A60 PolarHBondContact O-N 2.53Å; S58-A60 VanDerWaalsContact O-N 3.14Å; S58-Q111 WeakPolarHBondContact O-CA 3.32Å; S58-N112 PolarHBondContact N-O 2.98Å; S58-N112 PolarHBondContact O-N 3.01Å
59	L	63.8	Low	55.4	Low	38 Å²	38	89 Å²	89	20%	0.199	49%	0.485	C	S	.	.			trans	-82.5	85.9	-178.6	-81.5	166.6	0	0	0	111.8	G61 L279 Q314	L59-G61 PolarHBondContact O-N 3.47Å; L59-G61 VanDerWaalsContact O-N 3.1Å; L59-L279 HydrophobicContact CD1-CD1 4Å; L59-L279 HydrophobicContact CD2-CD1 4.14Å; L59-Q314 VanDerWaalsContact CD2-OE1 3.28Å; L59-Q314 HydrophobicContact CG-CB 4.3Å
60	A	50	Low	53.3	Low	64 Å²	64	89 Å²	89	53%	0.529	48%	0.484	S	S	.	.			trans	-59.7	109.7	171.5	0	0	0	0	0	111.9	S58	S58-A60 PolarHBondContact O-N 2.53Å; S58-A60 VanDerWaalsContact O-N 3.14Å
61	G	38.9	Very low	50.9	Low	52 Å²	52	92.1 Å²	92.1	54%	0.536	49%	0.492	S	S	.	.			trans	-71.9	132.5	-175	0	0	0	0	0	114.2	L59 T63	L59-G61 PolarHBondContact O-N 3.47Å; L59-G61 VanDerWaalsContact O-N 3.1Å; G61-T63 VanDerWaalsContact C-N 3.28Å; G61-T63 PolarHBondContact O-N 3.19Å
62	A	29.7	Very low	48.1	Very low	107 Å²	107	97.8 Å²	97.8	88%	0.884	51%	0.506	S	S	*	.	S	Bend	trans	-83.2	32.6	-170.8	0	0	0	0	0	115.9
63	T	26.3	Very low	45.2	Very low	84 Å²	84	99.8 Å²	99.8	52%	0.515	52%	0.524	S	S	.	.	S	Bend	trans	-145.2	150.4	173.8	39	0	0	0	0	112.4	G61 Y65	G61-T63 VanDerWaalsContact C-N 3.28Å; G61-T63 PolarHBondContact O-N 3.19Å; T63-Y65 PolarHBondContact O-N 3.23Å
64	R	25.8	Very low	42.3	Very low	244 Å²	244	103.1 Å²	103.1	92%	0.921	54%	0.539	S	S	*	.	S	Bend	trans	-67.9	78.9	-170.2	-58.8	-176.7	-169.8	170	1.7	115
65	Y	24.5	Very low	39.7	Very low	220 Å²	220	108.4 Å²	108.4	86%	0.863	57%	0.567	S	S	*	*			trans	-144.7	124.7	153.9	-111	-94.6	0	0	0	106.8	T63	T63-Y65 PolarHBondContact O-N 3.23Å
66	S	23.8	Very low	37.2	Very low	105 Å²	105	116.4 Å²	116.4	73%	0.734	60%	0.595	S	S	*	*			trans	-141.8	114.5	177.6	-174.7	0	0	0	0	110.8
67	P	28.4	Very low	34.4	Very low	103 Å²	103	124.7 Å²	124.7	67%	0.669	63%	0.633	S	S	*	*			trans	-117.9	68.9	161.8	36.5	-23.2	0	0	0	109.7
68	Y	28.3	Very low	32	Very low	118 Å²	118	131.6 Å²	131.6	46%	0.463	67%	0.671	S	S	.	*			trans	-141.7	101.2	167.6	-108.2	-80.7	0	0	0	108.8
69	E	26	Very low	30.1	Very low	160 Å²	160	138.1 Å²	138.1	75%	0.748	70%	0.703	S	S	*	*			trans	168	129.1	139.1	-96.2	-179.7	-177.3	0	0	111.4
70	G	25.1	Very low	28.5	Very low	57 Å²	57	144.4 Å²	144.4	59%	0.588	74%	0.736	S	S	*	*			trans	90.4	146.6	167.9	0	0	0	0	0	116.8
71	Y	27.2	Very low	27.5	Very low	199 Å²	199	148 Å²	148	78%	0.78	75%	0.751	S	S	*	*			cis	-153.2	123.6	-4.3	-137.5	-96.2	0	0	0	112.2
72	Y	24.2	Very low	27	Very low	190 Å²	190	151.2 Å²	151.2	75%	0.745	77%	0.765	S	S	*	*			trans	16	116.2	152.2	-60.6	-93.3	0	0	0	121.2
73	S	25.1	Very low	27	Very low	93 Å²	93	153.6 Å²	153.6	65%	0.65	76%	0.762	S	S	*	*				44.2	118	115.8	164.8	0	0	0	0	119.8
74	Y	23.1	Very low	27	Very low	221 Å²	221	161 Å²	161	87%	0.867	78%	0.781	S	S	*	*			trans	-148.3	128.8	135.5	-96.7	-68.8	0	0	0	113.8
75	N	27	Very low	27.3	Very low	124 Å²	124	156.3 Å²	156.3	66%	0.663	78%	0.779	S	S	*	*			trans	-16.1	138.8	171	-47.4	-6.9	0	0	0	119.9
76	Y	30.2	Very low	27.6	Very low	230 Å²	230	151.8 Å²	151.8	90%	0.902	78%	0.777	S	S	*	*			trans	-142.4	78.9	141.2	-111.1	-79.2	0	0	0	110.1
77	E	26.1	Very low	27.8	Very low	179 Å²	179	150.3 Å²	150.3	84%	0.836	78%	0.778	S	S	*	*			trans	-78	172.5	142.8	-68.8	-177.2	121	0	0	107.9
78	D	28.3	Very low	27.9	Very low	147 Å²	147	154.9 Å²	154.9	79%	0.786	79%	0.79	S	S	*	*			trans	64.2	81.5	-174.6	-64.8	-26.6	0	0	0	116.5
79	D	30.4	Very low	27.9	Very low	165 Å²	165	156.5 Å²	156.5	88%	0.882	81%	0.807	S	S	*	*	S	Bend		-173.4	76.8	117	-115.6	-18.4	0	0	0	113.7
80	L	30.6	Very low	28	Very low	170 Å²	170	154.9 Å²	154.9	89%	0.89	81%	0.81	S	S	*	*	S	Bend	trans	-162.7	15.1	160.2	-117.9	172.6	0	0	0	118.7
81	V	28.1	Very low	28.2	Very low	140 Å²	140	156.5 Å²	156.5	85%	0.848	82%	0.819	S	S	*	*			trans	-122.8	69.4	177.2	-165	0	0	0	0	113.8	L83	V81-L83 PolarHBondContact O-N 3.48Å
82	S	28.4	Very low	28.5	Very low	120 Å²	120	152.6 Å²	152.6	84%	0.839	82%	0.82	S	S	*	*			trans	-79	84.5	156.5	164.8	0	0	0	0	110.3
83	L	30.1	Very low	28.8	Very low	157 Å²	157	150.6 Å²	150.6	82%	0.822	82%	0.822	S	S	*	*			trans	-168.7	68.7	157.5	-105.8	162	0	0	0	115	V81	V81-L83 PolarHBondContact O-N 3.48Å
84	R	25.4	Very low	28.9	Very low	238 Å²	238	153.7 Å²	153.7	90%	0.898	83%	0.826	S	S	*	*			trans	15.1	125.4	155.2	-57.2	175.4	-176.5	160.7	0.8	121.1
85	V	32.7	Very low	29.3	Very low	146 Å²	146	149.5 Å²	149.5	89%	0.885	82%	0.818	S	S	*	*				-147.7	139.3	120.8	-171.1	0	0	0	0	108.9
86	P	30.2	Very low	29.6	Very low	125 Å²	125	154.4 Å²	154.4	81%	0.812	83%	0.828	S	S	*	*			trans	-108.2	146	-177.7	37.7	-31.4	0	0	0	115.7
87	G	29.5	Very low	29.5	Very low	74 Å²	74	152.8 Å²	152.8	76%	0.763	83%	0.825	S	S	*	*			trans	174.5	138.7	165.8	0	0	0	0	0	117.2
88	E	29	Very low	30.2	Very low	199 Å²	199	149.7 Å²	149.7	93%	0.93	82%	0.821	S	S	*	*			trans	71.5	78.8	151.2	-53.1	-166	132.8	0	0	122.4
89	D	29.6	Very low	30.2	Very low	152 Å²	152	150.7 Å²	150.7	81%	0.813	83%	0.825	S	S	*	*				57.3	116.7	124.3	-144.8	15.2	0	0	0	123.1
90	P	28.1	Very low	30.2	Very low	126 Å²	126	149.2 Å²	149.2	82%	0.818	82%	0.816	S	S	*	*			trans	-103.3	110.9	179.7	36.4	-29.8	0	0	0	115.2
91	A	29.8	Very low	30	Very low	92 Å²	92	149.6 Å²	149.6	76%	0.76	81%	0.813	S	S	*	*			trans	-148.9	45	-175.7	0	0	0	0	0	118.2
92	S	33.1	Very low	30	Very low	117 Å²	117	147.2 Å²	147.2	82%	0.818	81%	0.808	S	S	*	*			trans	-153.1	84.3	168	61.1	0	0	0	0	112
93	L	29.5	Very low	29.8	Very low	147 Å²	147	146.2 Å²	146.2	77%	0.77	80%	0.801	S	S	*	*				74.1	103.5	68.7	-157.7	92.6	0	0	0	114.4
94	E	28.4	Very low	29.5	Very low	159 Å²	159	148.3 Å²	148.3	74%	0.743	81%	0.807	S	S	*	*			trans	34.3	121.5	147.2	-54.7	178	110.6	0	0	120.5
95	N	31.3	Very low	29.6	Very low	132 Å²	132	140.8 Å²	140.8	71%	0.706	80%	0.803	S	S	*	*			trans	-163	116	134.1	-103.6	-72.1	0	0	0	114.4
96	R	31.9	Very low	29.3	Very low	227 Å²	227	142.2 Å²	142.2	86%	0.857	80%	0.801	S	S	*	*			trans	74.9	110.6	143.1	-60.8	171.8	-161.8	-129.8	-4.9	122.2
97	K	29.4	Very low	29.3	Very low	197 Å²	197	141.6 Å²	141.6	86%	0.857	80%	0.796	S	S	*	*			trans	-84.9	-160.7	140.6	-62.3	-178.8	172.4	-177.8	0	110.1
98	P	41.4	Very low	29	Very low	113 Å²	113	147.3 Å²	147.3	73%	0.734	80%	0.8	S	S	*	*				-123	-171.3	-90.6	40.7	-24.1	0	0	0	112.4
99	L	27.9	Very low	28.9	Very low	169 Å²	169	141.8 Å²	141.8	89%	0.885	80%	0.797	S	S	*	*			trans	-165.5	-177	149.8	-112.2	168.2	0	0	0	114.1
100	L	29.3	Very low	29.6	Very low	133 Å²	133	137.1 Å²	137.1	70%	0.696	79%	0.785	S	S	*	*			trans	-119.2	168.8	-151.5	-104.8	62.6	0	0	0	116
101	H	26	Very low	30.7	Very low	179 Å²	179	133.3 Å²	133.3	83%	0.829	76%	0.756	S	S	*	*			trans	100.5	154	139.8	-96.1	-150.5	0	0	0	122.9
102	A	28.1	Very low	32.5	Very low	89 Å²	89	132.8 Å²	132.8	74%	0.736	74%	0.741	S	S	*	*			trans	76.7	147.6	172.5	0	0	0	0	0	118.3
103	S	25.3	Very low	34.6	Very low	100 Å²	100	129.5 Å²	129.5	70%	0.699	72%	0.717	S	S	*	*				170.6	149	-51.4	49.9	0	0	0	0	109.9
104	E	24.2	Very low	37.1	Very low	200 Å²	200	126.6 Å²	126.6	94%	0.935	70%	0.7	S	S	*	*			trans	69.4	120.8	169	-54.1	-176.3	151.4	0	0	117.5
105	G	26.3	Very low	39.8	Very low	80 Å²	80	124 Å²	124	83%	0.825	68%	0.683	S	S	*	*			trans	156.8	80.4	171.3	0	0	0	0	0	117
106	Q	28	Very low	42.6	Very low	177 Å²	177	117.7 Å²	117.7	83%	0.827	65%	0.65	S	S	*	*			trans	-70.3	146.3	150.6	-91.1	-177.6	-33.2	0	0	108.4
107	P	28.7	Very low	45.3	Very low	111 Å²	111	108.3 Å²	108.3	72%	0.721	62%	0.617	S	S	*	*				-150.8	166.8	62.7	40	-20	0	0	0	118.6
108	F	24.6	Very low	48.1	Very low	194 Å²	194	100.3 Å²	100.3	85%	0.851	59%	0.587	S	S	*	*			trans	14.8	104.7	143.5	-64.6	-103.5	0	0	0	119.6
109	G	26.3	Very low	50.2	Low	83 Å²	83	98.4 Å²	98.4	86%	0.856	58%	0.581	S	S	*	*			trans	89.7	114.2	135.4	0	0	0	0	0	119.2
110	G	44.2	Very low	53	Low	54 Å²	54	92.7 Å²	92.7	56%	0.557	55%	0.551	S	S	*	*			trans	90	138	159.9	0	0	0	0	0	115.8
111	Q	51.7	Low	55.6	Low	47 Å²	47	91 Å²	91	22%	0.22	55%	0.548	C	S	.	.			trans	67.7	115.5	177.6	-59.9	147.2	17.7	0	0	115.1	S58 Q314	S58-Q111 WeakPolarHBondContact O-CA 3.32Å; Q111-Q314 VanDerWaalsContact CD-NE2 3.32Å; Q111-Q314 VanDerWaalsContact CG-CD 3.5Å; Q111-Q314 HydrophobicContact CG-CG 4.13Å; Q111-Q314 VanDerWaalsContact CG-OE1 3.29Å; Q111-Q314 VanDerWaalsContact NE2-CD 3.28Å
112	N	66.2	Low	58.2	Low	81 Å²	81	90.5 Å²	90.5	43%	0.433	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	144.6	157.7	-177.4	32.7	0	0	0	108.3	C57 S58 E114	C57-N112 CarbonylContact C-O 3.54Å; C57-N112 WeakPolarHBondContact CA-O 3.24Å; S58-N112 PolarHBondContact N-O 2.98Å; S58-N112 PolarHBondContact O-N 3.01Å; N112-E114 PolarHBondContact ND2-OE1 3.3Å
113	C	77	Confident	60.9	Low	48 Å²	48	88.6 Å²	88.6	32%	0.324	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	130.4	-173.8	-57.1	0	0	0	0	112.9	L55 Y56 C57	L55-C113 HydrophobicContact CD1-CB 4.41Å; Y56-C113 CarbonylContact O-C 3.47Å; Y56-C113 WeakPolarHBondContact O-CA 3.37Å; Y56-C113 WeakPolarHBondContact O-CB 3.43Å; C57-C113 HydrophobicContact CB-CB 4.06Å; C57-C113 WeakPolarHBondContact CB-SG 3.01Å; C57-C113 WeakPolarHBondContact SG-CB 3.36Å; C57-C113 CovalentContact SG-SG 2.04Å; C57-C113 PolarHBondContact SG-SG 2.92Å
114	E	83	Confident	64	Low	86 Å²	86	88.7 Å²	88.7	40%	0.402	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	171.4	-172.1	-79.6	166.5	-148.3	0	0	110.8	L55 Y56 N112	L55-E114 WeakPolarHBondContact CD1-O 3.48Å; Y56-E114 WeakPolarHBondContact CD1-O 3.17Å; Y56-E114 HydrophobicContact CE1-CB 3.96Å; Y56-E114 HydrophobicContact CE2-CB 4.14Å; Y56-E114 PolarHBondContact N-O 3.23Å; Y56-E114 PolarHBondContact O-N 2.02Å; Y56-E114 PolarHBondContact OH-OE2 3.01Å; N112-E114 PolarHBondContact ND2-OE1 3.3Å
115	Y	85.9	Confident	67.3	Low	103 Å²	103	80 Å²	80	40%	0.404	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	139.1	-178.3	-71	-88.6	0	0	0	111.5	R53 E54 L55	R53-Y115 HydrophobicContact CG-CD1 3.69Å; R53-Y115 HydrophobicContact CG-CE1 4.44Å; R53-Y115 HydrophobicContact CG-CG 4.32Å; R53-Y115 VanDerWaalsContact NE-CG 3.32Å; R53-Y115 VanDerWaalsContact NH2-CE2 3.29Å; E54-Y115 CarbonylContact O-C 3.49Å; E54-Y115 WeakPolarHBondContact O-CA 3.42Å; E54-Y115 VanDerWaalsContact O-CD1 3.29Å; E54-Y115 WeakPolarHBondContact O-CD1 3.33Å; L55-Y115 HydrophobicContact CB-CD1 4.43Å; L55-Y115 HydrophobicContact CB-CE1 4.31Å; L55-Y115 HydrophobicContact CD1-CD1 4.15Å; L55-Y115 HydrophobicContact CD1-CD2 4.31Å; L55-Y115 HydrophobicContact CD1-CE1 3.87Å; L55-Y115 HydrophobicContact CD1-CE2 4.02Å; L55-Y115 HydrophobicContact CD1-CG 4.38Å
116	C	89.4	Confident	70.5	Confident	0 Å²	0	77 Å²	77	0%	0	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	129.5	167.2	-178.4	0	0	0	0	109.3	C44 R53 E54 Y56 L123	C44-C116 HydrophobicContact CB-CB 3.68Å; C44-C116 WeakPolarHBondContact CB-SG 3.25Å; C44-C116 PolarHBondContact O-SG 2.83Å; C44-C116 WeakPolarHBondContact SG-CB 3.08Å; C44-C116 CovalentContact SG-SG 2.04Å; C44-C116 PolarHBondContact SG-SG 2.9Å; R53-C116 WeakPolarHBondContact CA-O 3.41Å; E54-C116 PolarHBondContact N-O 2.03Å; E54-C116 PolarHBondContact O-N 2.75Å; Y56-C116 HydrophobicContact CD1-CB 4.06Å; Y56-C116 HydrophobicContact CE1-CB 4.11Å; C116-L123 CarbonylContact C-O 3.45Å; C116-L123 WeakPolarHBondContact CA-O 3.03Å
117	D	88.8	Confident	73.5	Confident	31 Å²	31	68.8 Å²	68.8	17%	0.166	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	105.1	-173.3	-173.9	-24.8	0	0	0	109.6	R53 A119 N120 L123	R53-D117 HydrophobicContact CB-CB 4.38Å; R53-D117 HydrophobicContact CG-CB 4.29Å; D117-A119 PolarHBondContact O-N 3.24Å; D117-A119 VanDerWaalsContact O-N 3.15Å; D117-A119 WeakPolarHBondContact OD1-CB 3.44Å; D117-A119 PolarHBondContact OD1-N 2.84Å; D117-N120 HydrophobicContact CB-CB 4.35Å; D117-N120 PolarHBondContact O-N 3.27Å; D117-L123 HydrophobicContact CB-CB 4.17Å; D117-L123 PolarHBondContact N-O 2.98Å; D117-L123 CarbonylContact O-C 3.6Å
118	A	87.3	Confident	76.6	Confident	28 Å²	28	68.4 Å²	68.4	23%	0.231	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-16.4	-175.3	0	0	0	0	0	114	G45 E46 P51	G45-A118 VanDerWaalsContact O-CB 3.32Å; G45-A118 WeakPolarHBondContact O-CB 3.37Å; E46-A118 HydrophobicContact CG-CB 3.54Å; P51-A118 HydrophobicContact CB-CB 4.2Å
119	A	86.8	Confident	79.8	Confident	73 Å²	73	60 Å²	60	60%	0.603	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-13.3	174.6	0	0	0	0	0	113.3	P51 D117	P51-A119 HydrophobicContact CB-CB 3.98Å; P51-A119 HydrophobicContact CG-CB 4.29Å; D117-A119 PolarHBondContact O-N 3.24Å; D117-A119 VanDerWaalsContact O-N 3.15Å; D117-A119 WeakPolarHBondContact OD1-CB 3.44Å; D117-A119 PolarHBondContact OD1-N 2.84Å
120	N	86.7	Confident	83.1	Confident	50 Å²	50	56.2 Å²	56.2	27%	0.267	31%	0.308	S	S	.	.	S	Bend	trans	-105.7	116.5	177.6	-176.5	-0.8	0	0	0	111.3	D117 E122 L123 R124	D117-N120 HydrophobicContact CB-CB 4.35Å; D117-N120 PolarHBondContact O-N 3.27Å; N120-E122 PolarHBondContact O-N 3.44Å; N120-E122 PolarHBondContact OD1-N 3.31Å; N120-L123 HydrophobicContact CB-CB 4.2Å; N120-L123 HydrophobicContact CB-CG 4.49Å; N120-L123 WeakPolarHBondContact ND2-CD1 3.42Å; N120-L123 WeakPolarHBondContact ND2-CG 3.02Å; N120-L123 PolarHBondContact O-N 2.79Å; N120-R124 WeakPolarHBondContact O-CB 3.26Å; N120-R124 PolarHBondContact O-N 2.04Å
121	P	82.1	Confident	85.3	Confident	97 Å²	97	54 Å²	54	63%	0.63	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-27.1	175.7	-28.5	36.7	0	0	0	115.8
122	E	81.4	Confident	86.9	Confident	169 Å²	169	54.1 Å²	54.1	79%	0.79	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-18.1	179.1	-62	-179.7	160.9	0	0	113.9	N120	N120-E122 PolarHBondContact O-N 3.44Å; N120-E122 PolarHBondContact OD1-N 3.31Å
123	L	85.9	Confident	87.2	Confident	49 Å²	49	53.1 Å²	53.1	26%	0.257	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.7	10	-174.5	-58	178.4	0	0	0	113.3	C116 D117 N120 H125	C116-L123 CarbonylContact C-O 3.45Å; C116-L123 WeakPolarHBondContact CA-O 3.03Å; D117-L123 HydrophobicContact CB-CB 4.17Å; D117-L123 PolarHBondContact N-O 2.98Å; D117-L123 CarbonylContact O-C 3.6Å; N120-L123 HydrophobicContact CB-CB 4.2Å; N120-L123 HydrophobicContact CB-CG 4.49Å; N120-L123 WeakPolarHBondContact ND2-CD1 3.42Å; N120-L123 WeakPolarHBondContact ND2-CG 3.02Å; N120-L123 PolarHBondContact O-N 2.79Å; L123-H125 PolarHBondContact O-CD2 3.41Å
124	R	90.1	Very high	87.3	Confident	102 Å²	102	52.7 Å²	52.7	39%	0.385	29%	0.291	S	S	.	.			trans	-93.3	138.9	176.2	70.8	176.8	-157.6	158	13.2	110.4	N120 P126 Y129	N120-R124 WeakPolarHBondContact O-CB 3.26Å; N120-R124 PolarHBondContact O-N 2.04Å; R124-P126 HydrophobicContact CG-CG 4.49Å; R124-P126 WeakPolarHBondContact O-CD 3.5Å; R124-Y129 PolarHBondContact NE-OH 3.25Å; R124-Y129 PolarHBondContact NH2-OH 2.99Å; R124-Y129 WeakPolarHBondContact O-CE2 3.17Å
125	H	92.2	Very high	86.8	Confident	17 Å²	17	53.7 Å²	53.7	8%	0.079	31%	0.305	C	S	.	.			trans	-125.8	57.4	-180	-60.4	-73.8	0	0	0	111.7	T43 L123 Y137 W138 Q139	T43-H125 WeakPolarHBondContact CG2-O 3.22Å; L123-H125 PolarHBondContact O-CD2 3.41Å; H125-Y137 WeakPolarHBondContact CA-O 3.04Å; H125-Y137 WeakPolarHBondContact CB-O 3.39Å; H125-Y137 AromaticContact CE1-CE2 3.31Å; H125-Y137 WeakPolarHBondContact CE1-CE2 3.07Å; H125-Y137 AromaticContact CE1-CZ 3.34Å; H125-Y137 PolarHBondContact CE1-OH 3.33Å; H125-Y137 AromaticContact CG-CE2 3.84Å; H125-Y137 AromaticContact ND1-CD2 3.42Å; H125-Y137 WeakPolarHBondContact ND1-CD2 3.34Å; H125-Y137 AromaticContact ND1-CE2 3.13Å; H125-Y137 WeakPolarHBondContact ND1-CE2 3.41Å; H125-Y137 AromaticContact ND1-CZ 3.6Å; H125-Y137 PolarHBondContact ND1-O 3.48Å; H125-W138 VanDerWaalsContact O-CA 3.31Å; H125-W138 WeakPolarHBondContact O-CA 3.33Å; H125-Q139 HydrophobicContact CB-CB 3.74Å; H125-Q139 PolarHBondContact O-N 3.43Å
126	P	93.3	Very high	86.8	Confident	16 Å²	16	54.1 Å²	54.1	10%	0.104	31%	0.305	C	S	.	.			trans	-74	169.1	-175.8	38.3	-41.9	0	0	0	112.5	R124 E128 Y129 W138	R124-P126 HydrophobicContact CG-CG 4.49Å; R124-P126 WeakPolarHBondContact O-CD 3.5Å; P126-E128 VanDerWaalsContact CB-OE2 3.31Å; P126-E128 WeakPolarHBondContact CB-OE2 3.06Å; P126-E128 PolarHBondContact O-N 3.37Å; P126-Y129 HydrophobicContact CG-CD1 4.45Å; P126-Y129 HydrophobicContact CG-CD2 4.25Å; P126-Y129 HydrophobicContact CG-CE1 4.24Å; P126-Y129 HydrophobicContact CG-CE2 4.08Å; P126-Y129 HydrophobicContact CG-CG 4.45Å; P126-W138 WeakPolarHBondContact O-CB 3.24Å
127	A	92.7	Very high	86.9	Confident	6 Å²	6	56.1 Å²	56.1	5%	0.05	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-68.9	-29.9	-166	0	0	0	0	0	114.4	I38 V40 Y129 M130	I38-A127 HydrophobicContact CG1-CB 4.5Å; I38-A127 HydrophobicContact CG2-CB 3.92Å; I38-A127 WeakPolarHBondContact CG2-O 3.35Å; V40-A127 HydrophobicContact CB-CB 4.44Å; V40-A127 HydrophobicContact CG1-CB 3.7Å; V40-A127 HydrophobicContact CG2-CB 3.92Å; A127-Y129 PolarHBondContact O-N 3.31Å; A127-M130 HydrophobicContact CB-CE 3.95Å; A127-M130 WeakPolarHBondContact O-CB 3.45Å; A127-M130 WeakPolarHBondContact O-CE 3.37Å; A127-M130 PolarHBondContact O-N 3.15Å; A127-M130 VanDerWaalsContact O-N 3.09Å
128	E	92.3	Very high	87.2	Confident	102 Å²	102	54.7 Å²	54.7	48%	0.477	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-62.5	-26.4	-175.6	-56.9	77.4	-169.1	0	0	112	P126 M130 V131 D132	P126-E128 VanDerWaalsContact CB-OE2 3.31Å; P126-E128 WeakPolarHBondContact CB-OE2 3.06Å; P126-E128 PolarHBondContact O-N 3.37Å; E128-M130 PolarHBondContact O-N 3.06Å; E128-M130 VanDerWaalsContact O-N 3.11Å; E128-V131 VanDerWaalsContact O-CG2 3.3Å; E128-V131 WeakPolarHBondContact O-CG2 3.19Å; E128-V131 PolarHBondContact O-N 3.1Å; E128-D132 WeakPolarHBondContact O-CB 3.4Å; E128-D132 PolarHBondContact O-N 2.03Å; E128-D132 VanDerWaalsContact O-N 3.12Å
129	Y	93.5	Very high	87.5	Confident	19 Å²	19	53.3 Å²	53.3	8%	0.075	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-65	-11.2	176.9	-65.6	-8	0	0	0	113.7	R124 P126 A127 V131 D132 R136	R124-Y129 PolarHBondContact NE-OH 3.25Å; R124-Y129 PolarHBondContact NH2-OH 2.99Å; R124-Y129 WeakPolarHBondContact O-CE2 3.17Å; P126-Y129 HydrophobicContact CG-CD1 4.45Å; P126-Y129 HydrophobicContact CG-CD2 4.25Å; P126-Y129 HydrophobicContact CG-CE1 4.24Å; P126-Y129 HydrophobicContact CG-CE2 4.08Å; P126-Y129 HydrophobicContact CG-CG 4.45Å; A127-Y129 PolarHBondContact O-N 3.31Å; Y129-V131 VanDerWaalsContact C-N 3.33Å; Y129-D132 WeakPolarHBondContact CD1-OD2 3.47Å; Y129-R136 HydrophobicContact CD1-CB 4.25Å; Y129-R136 HydrophobicContact CD2-CB 3.55Å; Y129-R136 HydrophobicContact CD2-CG 4.42Å; Y129-R136 VanDerWaalsContact CE1-CZ 3.45Å; Y129-R136 HydrophobicContact CE2-CB 4.07Å; Y129-R136 HydrophobicContact CE2-CG 4.49Å; Y129-R136 HydrophobicContact CG-CB 3.64Å
130	M	93.8	Very high	87.8	Confident	2 Å²	2	49.9 Å²	49.9	1%	0.01	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-79.7	-14.2	171.3	-66.8	-176.6	-83.7	0	0	113.6	I38 V40 A127 E128 W138 I154 I319 E321 I322	I38-M130 HydrophobicContact CD1-CB 4Å; I38-M130 HydrophobicContact CD1-CE 3.59Å; I38-M130 HydrophobicContact CD1-SD 4.3Å; I38-M130 HydrophobicContact CG1-CE 4.28Å; V40-M130 HydrophobicContact CG1-CE 3.73Å; A127-M130 HydrophobicContact CB-CE 3.95Å; A127-M130 WeakPolarHBondContact O-CB 3.45Å; A127-M130 WeakPolarHBondContact O-CE 3.37Å; A127-M130 PolarHBondContact O-N 3.15Å; A127-M130 VanDerWaalsContact O-N 3.09Å; E128-M130 PolarHBondContact O-N 3.06Å; E128-M130 VanDerWaalsContact O-N 3.11Å; M130-W138 HydrophobicContact CE-CB 3.69Å; M130-W138 HydrophobicContact CE-CD2 3.73Å; M130-W138 HydrophobicContact CE-CE3 4.03Å; M130-W138 HydrophobicContact CE-CG 3.57Å; M130-W138 HydrophobicContact CG-CB 3.57Å; M130-W138 HydrophobicContact CG-CG 4.43Å; M130-W138 HydrophobicContact SD-CB 3.85Å; M130-W138 HydrophobicContact SD-CD2 4.01Å; M130-W138 HydrophobicContact SD-CE3 3.72Å; M130-W138 HydrophobicContact SD-CG 4.09Å; M130-I154 HydrophobicContact CE-CD1 4.44Å; M130-I154 HydrophobicContact CE-CG2 3.81Å; M130-I154 HydrophobicContact SD-CD1 4.1Å; M130-I154 HydrophobicContact SD-CG2 4.27Å; M130-I319 HydrophobicContact CG-CB 4.04Å; M130-I319 HydrophobicContact CG-CG2 3.94Å; M130-I319 HydrophobicContact SD-CB 3.78Å; M130-I319 HydrophobicContact SD-CD1 4.34Å; M130-I319 HydrophobicContact SD-CG2 3.94Å; M130-E321 CarbonylContact O-C 3.39Å; M130-I322 HydrophobicContact CB-CD1 3.92Å; M130-I322 HydrophobicContact CB-CG1 4.09Å; M130-I322 HydrophobicContact CG-CD1 4.35Å; M130-I322 PolarHBondContact O-N 3.3Å; M130-I322 HydrophobicContact SD-CD1 3.78Å
131	V	91.2	Very high	88	Confident	7 Å²	7	47.5 Å²	47.5	4%	0.042	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-137	5.6	-167.3	-68.1	0	0	0	0	113.9	A33 A35 I38 E128 Y129 I156 I322	A33-V131 HydrophobicContact CB-CG1 4.24Å; A33-V131 WeakPolarHBondContact O-CB 3.49Å; A35-V131 PolarHBondContact N-O 2.8Å; I38-V131 HydrophobicContact CB-CG2 4.16Å; I38-V131 HydrophobicContact CD1-CG1 3.86Å; I38-V131 HydrophobicContact CD1-CG2 4.48Å; I38-V131 HydrophobicContact CG2-CG2 3.68Å; E128-V131 VanDerWaalsContact O-CG2 3.3Å; E128-V131 WeakPolarHBondContact O-CG2 3.19Å; E128-V131 PolarHBondContact O-N 3.1Å; Y129-V131 VanDerWaalsContact C-N 3.33Å; V131-I156 HydrophobicContact CG1-CD1 4.32Å; V131-I322 HydrophobicContact CG1-CB 4.49Å
132	D	85.4	Confident	88.2	Confident	50 Å²	50	43 Å²	43	27%	0.267	22%	0.223	S	C	.	.	S	Bend	trans	-94.5	3.6	-179	74.2	0.8	0	0	0	114.4	E128 Y129 T134 R136	E128-D132 WeakPolarHBondContact O-CB 3.4Å; E128-D132 PolarHBondContact O-N 2.03Å; E128-D132 VanDerWaalsContact O-N 3.12Å; Y129-D132 WeakPolarHBondContact CD1-OD2 3.47Å; D132-T134 PolarHBondContact O-N 2.67Å; D132-T134 VanDerWaalsContact OD1-CB 3.28Å; D132-T134 WeakPolarHBondContact OD1-CB 3.4Å; D132-T134 WeakPolarHBondContact OD1-CG2 3.06Å; D132-T134 PolarHBondContact OD1-N 2.77Å; D132-T134 PolarHBondContact OD1-OG1 3.12Å; D132-T134 PolarHBondContact OD2-OG1 3.25Å; D132-T134 VanDerWaalsContact OD2-OG1 3.13Å; D132-R136 IonicContact OD2-CZ 2.83Å; D132-R136 IonicContact OD2-NE 2.71Å; D132-R136 IonicContact OD2-NH2 3.14Å; D132-R136 PolarHBondContact OD2-NH2 2.78Å
133	G	73.3	Confident	88.2	Confident	60 Å²	60	35.4 Å²	35.4	62%	0.619	19%	0.189	S	C	*	.	S	Bend	trans	68.3	6.3	-179.4	0	0	0	0	0	115
134	T	79	Confident	87.6	Confident	40 Å²	40	35.3 Å²	35.3	25%	0.245	19%	0.192	C	C	.	.	S	Bend	trans	-91.5	158.7	179.3	73.4	0	0	0	0	111.5	D132 R136	D132-T134 PolarHBondContact O-N 2.67Å; D132-T134 VanDerWaalsContact OD1-CB 3.28Å; D132-T134 WeakPolarHBondContact OD1-CB 3.4Å; D132-T134 WeakPolarHBondContact OD1-CG2 3.06Å; D132-T134 PolarHBondContact OD1-N 2.77Å; D132-T134 PolarHBondContact OD1-OG1 3.12Å; D132-T134 PolarHBondContact OD2-OG1 3.25Å; D132-T134 VanDerWaalsContact OD2-OG1 3.13Å; T134-R136 PolarHBondContact O-N 2.93Å; T134-R136 WeakPolarHBondContact OG1-CB 3.4Å; T134-R136 WeakPolarHBondContact OG1-CG 3.48Å; T134-R136 PolarHBondContact OG1-NE 3.23Å
135	P	70.9	Confident	87.1	Confident	107 Å²	107	33.3 Å²	33.3	70%	0.695	18%	0.184	S	C	*	.	S	Bend	trans	-75.9	20.5	176.3	32.6	-37.4	0	0	0	114
136	R	86.4	Confident	86.2	Confident	112 Å²	112	33.6 Å²	33.6	42%	0.423	19%	0.192	S	C	.	.			trans	-82.5	176.1	176	-61	-176.2	-70.7	-154.8	0.4	109.6	Y129 D132 T134 K320	Y129-R136 HydrophobicContact CD1-CB 4.25Å; Y129-R136 HydrophobicContact CD2-CB 3.55Å; Y129-R136 HydrophobicContact CD2-CG 4.42Å; Y129-R136 VanDerWaalsContact CE1-CZ 3.45Å; Y129-R136 HydrophobicContact CE2-CB 4.07Å; Y129-R136 HydrophobicContact CE2-CG 4.49Å; Y129-R136 HydrophobicContact CG-CB 3.64Å; D132-R136 IonicContact OD2-CZ 2.83Å; D132-R136 IonicContact OD2-NE 2.71Å; D132-R136 IonicContact OD2-NH2 3.14Å; D132-R136 PolarHBondContact OD2-NH2 2.78Å; T134-R136 PolarHBondContact O-N 2.93Å; T134-R136 WeakPolarHBondContact OG1-CB 3.4Å; T134-R136 WeakPolarHBondContact OG1-CG 3.48Å; T134-R136 PolarHBondContact OG1-NE 3.23Å; R136-K320 WeakPolarHBondContact O-CA 3.09Å; R136-K320 WeakPolarHBondContact O-CG 3.39Å
137	Y	91.6	Very high	85.3	Confident	42 Å²	42	37.7 Å²	37.7	17%	0.165	21%	0.211	C	C	.	.			trans	-147.8	147.1	-178	58.8	-95	0	0	0	112.6	Y56 H125 Q139 A172 N173 S318 I319	Y56-Y137 PolarHBondContact OH-OH 2.84Å; H125-Y137 WeakPolarHBondContact CA-O 3.04Å; H125-Y137 WeakPolarHBondContact CB-O 3.39Å; H125-Y137 AromaticContact CE1-CE2 3.31Å; H125-Y137 WeakPolarHBondContact CE1-CE2 3.07Å; H125-Y137 AromaticContact CE1-CZ 3.34Å; H125-Y137 PolarHBondContact CE1-OH 3.33Å; H125-Y137 AromaticContact CG-CE2 3.84Å; H125-Y137 AromaticContact ND1-CD2 3.42Å; H125-Y137 WeakPolarHBondContact ND1-CD2 3.34Å; H125-Y137 AromaticContact ND1-CE2 3.13Å; H125-Y137 WeakPolarHBondContact ND1-CE2 3.41Å; H125-Y137 AromaticContact ND1-CZ 3.6Å; H125-Y137 PolarHBondContact ND1-O 3.48Å; Y137-Q139 HydrophobicContact CD2-CB 4.35Å; Y137-Q139 HydrophobicContact CE2-CB 4.41Å; Y137-A172 HydrophobicContact CD1-CB 4.06Å; Y137-A172 HydrophobicContact CD2-CB 4.3Å; Y137-A172 HydrophobicContact CG-CB 3.74Å; Y137-N173 PolarHBondContact OH-ND2 2.75Å; Y137-S318 WeakPolarHBondContact CD2-OG 3.48Å; Y137-I319 WeakPolarHBondContact CA-O 3.31Å; Y137-I319 WeakPolarHBondContact CB-O 3.42Å
138	W	95.7	Very high	84.5	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	152	163.6	166	76.8	0	0	0	110.4	V40 S42 H125 P126 M130 V152 I154 L273 S318 I319	V40-W138 HydrophobicContact CG1-CZ2 4.42Å; S42-W138 WeakPolarHBondContact O-CZ2 3.5Å; H125-W138 VanDerWaalsContact O-CA 3.31Å; H125-W138 WeakPolarHBondContact O-CA 3.33Å; P126-W138 WeakPolarHBondContact O-CB 3.24Å; M130-W138 HydrophobicContact CE-CB 3.69Å; M130-W138 HydrophobicContact CE-CD2 3.73Å; M130-W138 HydrophobicContact CE-CE3 4.03Å; M130-W138 HydrophobicContact CE-CG 3.57Å; M130-W138 HydrophobicContact CG-CB 3.57Å; M130-W138 HydrophobicContact CG-CG 4.43Å; M130-W138 HydrophobicContact SD-CB 3.85Å; M130-W138 HydrophobicContact SD-CD2 4.01Å; M130-W138 HydrophobicContact SD-CE3 3.72Å; M130-W138 HydrophobicContact SD-CG 4.09Å; W138-V152 HydrophobicContact CH2-CG1 3.8Å; W138-V152 HydrophobicContact CZ2-CG1 3.81Å; W138-I154 HydrophobicContact CE3-CD1 4.21Å; W138-I154 HydrophobicContact CH2-CD1 4.05Å; W138-I154 HydrophobicContact CH2-CG1 4.32Å; W138-I154 HydrophobicContact CZ3-CD1 3.71Å; W138-I154 HydrophobicContact CZ3-CG1 4.42Å; W138-L273 HydrophobicContact CH2-CD1 4.4Å; W138-L273 HydrophobicContact CZ3-CD1 4.44Å; W138-S318 WeakPolarHBondContact O-CA 3.12Å; W138-S318 WeakPolarHBondContact O-CB 3.49Å; W138-S318 PolarHBondContact O-OG 3.14Å; W138-I319 HydrophobicContact CE3-CB 4.29Å; W138-I319 HydrophobicContact CE3-CG1 4.44Å; W138-I319 HydrophobicContact CZ3-CD1 4.35Å; W138-I319 HydrophobicContact CZ3-CG1 4.45Å; W138-I319 PolarHBondContact N-O 2.04Å; W138-I319 PolarHBondContact O-N 2.93Å
139	Q	92.9	Very high	84.1	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	133.6	175	-169.6	178.2	-86.2	0	0	111.8	C44 Y56 H125 Y137 N173 F316 Y317	C44-Q139 PolarHBondContact N-O 2.79Å; Y56-Q139 VanDerWaalsContact CG-NE2 3.29Å; H125-Q139 HydrophobicContact CB-CB 3.74Å; H125-Q139 PolarHBondContact O-N 3.43Å; Y137-Q139 HydrophobicContact CD2-CB 4.35Å; Y137-Q139 HydrophobicContact CE2-CB 4.41Å; Q139-N173 PolarHBondContact OE1-ND2 3.43Å; Q139-N173 PolarHBondContact OE1-OD1 3.41Å; Q139-F316 HydrophobicContact CG-CD2 3.68Å; Q139-F316 HydrophobicContact CG-CE2 4.07Å; Q139-F316 HydrophobicContact CG-CG 4.43Å; Q139-Y317 CarbonylContact C-O 3.32Å; Q139-Y317 WeakPolarHBondContact CA-O 3.16Å
140	S	93.5	Very high	83.6	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-73.4	161.3	173	80.5	0	0	0	0	111.5	Y317	S140-Y317 PolarHBondContact N-O 3.47Å; S140-Y317 PolarHBondContact OG-N 2.95Å
141	P	90.6	Very high	83.4	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-56	147.3	164.1	-24.1	36	0	0	0	111.5	T43 Y149	T43-P141 WeakPolarHBondContact O-CG 3.3Å; P141-Y149 HydrophobicContact CB-CD1 3.9Å; P141-Y149 HydrophobicContact CB-CD2 4.22Å; P141-Y149 HydrophobicContact CB-CE1 4.34Å; P141-Y149 HydrophobicContact CB-CG 3.86Å; P141-Y149 HydrophobicContact CG-CD1 3.69Å; P141-Y149 HydrophobicContact CG-CE1 3.92Å; P141-Y149 HydrophobicContact CG-CG 4.19Å
142	P	86	Confident	83.5	Confident	2 Å²	2	47.5 Å²	47.5	1%	0.013	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-72.6	149.8	170.7	29.6	-33.9	0	0	0	111.8	S144 R145 Y315 F316	P142-S144 WeakPolarHBondContact CG-OG 3.09Å; P142-S144 PolarHBondContact O-N 2.95Å; P142-R145 WeakPolarHBondContact O-CB 3.27Å; P142-R145 PolarHBondContact O-N 3.11Å; P142-Y315 WeakPolarHBondContact CA-O 3.08Å; P142-F316 HydrophobicContact CB-CD1 4.47Å
143	L	81.4	Confident	83.9	Confident	11 Å²	11	47.5 Å²	47.5	6%	0.058	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-57.7	-16.8	178.5	-65.7	-167.6	0	0	0	113.8	R145 G146 M147 N150 S312 Y315	L143-R145 PolarHBondContact O-N 3.19Å; L143-G146 CarbonylContact O-C 3.57Å; L143-G146 PolarHBondContact O-N 3.35Å; L143-M147 HydrophobicContact CD1-SD 4.21Å; L143-N150 HydrophobicContact CD2-CB 3.66Å; L143-N150 VanDerWaalsContact CD2-N 3.33Å; L143-S312 PolarHBondContact N-O 2.86Å; L143-Y315 HydrophobicContact CD1-CD2 4.49Å; L143-Y315 WeakPolarHBondContact CG-O 3.46Å; L143-Y315 PolarHBondContact N-O 3.23Å
144	S	73.8	Confident	85	Confident	47 Å²	47	44.7 Å²	44.7	33%	0.329	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-60.4	-17.2	168.8	58	0	0	0	0	114.1	P142 S312 L313	P142-S144 WeakPolarHBondContact CG-OG 3.09Å; P142-S144 PolarHBondContact O-N 2.95Å; S144-S312 PolarHBondContact N-O 3.13Å; S144-L313 WeakPolarHBondContact OG-CD2 3.39Å
145	R	79.2	Confident	85.8	Confident	59 Å²	59	44 Å²	44	22%	0.223	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-84.5	-13.3	169.8	-83.5	-163.4	55	-162.2	-5.4	114.1	E46 E54 P142 L143 Y149	E46-R145 PolarHBondContact O-NH1 3.4Å; E54-R145 VanDerWaalsContact CD-CD 3.43Å; E54-R145 WeakPolarHBondContact OE1-CD 3.38Å; E54-R145 IonicContact OE1-CZ 2.66Å; E54-R145 IonicContact OE1-NE 3.69Å; E54-R145 IonicContact OE1-NH1 3.5Å; E54-R145 PolarHBondContact OE1-NH1 3.23Å; P142-R145 WeakPolarHBondContact O-CB 3.27Å; P142-R145 PolarHBondContact O-N 3.11Å; L143-R145 PolarHBondContact O-N 3.19Å; R145-Y149 HydrophobicContact CB-CD2 3.74Å; R145-Y149 HydrophobicContact CB-CE2 3.66Å; R145-Y149 PolarHBondContact NH2-OH 3.03Å
146	G	73.2	Confident	87	Confident	23 Å²	23	39 Å²	39	24%	0.237	19%	0.193	C	C	.	.			trans	144.6	149.6	-179.2	0	0	0	0	0	112.6	L143 D148 Y149	L143-G146 CarbonylContact O-C 3.57Å; L143-G146 PolarHBondContact O-N 3.35Å; G146-D148 PolarHBondContact O-N 3.18Å; G146-Y149 WeakPolarHBondContact O-CD2 3.34Å; G146-Y149 PolarHBondContact O-N 2.87Å
147	M	75.1	Confident	87.3	Confident	103 Å²	103	35.4 Å²	35.4	51%	0.507	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	-70.1	-16.4	179.7	-64.5	-63.1	-84.2	0	0	113.2	L143 Y149 N150	L143-M147 HydrophobicContact CD1-SD 4.21Å; M147-Y149 PolarHBondContact O-N 2.91Å; M147-N150 WeakPolarHBondContact O-CB 3.25Å; M147-N150 PolarHBondContact O-N 2.94Å; M147-N150 VanDerWaalsContact O-N 3.1Å
148	D	75.5	Confident	87.2	Confident	137 Å²	137	33.4 Å²	33.4	73%	0.733	18%	0.175	S	C	*	.	G	3₁₀ helix	trans	-61.5	-31.9	174.1	-52.4	-48	0	0	0	111.8	G146 N150 Q151	G146-D148 PolarHBondContact O-N 3.18Å; D148-N150 PolarHBondContact O-N 2.99Å; D148-N150 VanDerWaalsContact O-N 3.11Å; D148-Q151 PolarHBondContact O-N 3.1Å
149	Y	85	Confident	86.7	Confident	54 Å²	54	36.9 Å²	36.9	21%	0.212	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-71.3	-0.1	176.6	-60.2	-65.5	0	0	0	114.1	P141 R145 G146 M147 V152	P141-Y149 HydrophobicContact CB-CD1 3.9Å; P141-Y149 HydrophobicContact CB-CD2 4.22Å; P141-Y149 HydrophobicContact CB-CE1 4.34Å; P141-Y149 HydrophobicContact CB-CG 3.86Å; P141-Y149 HydrophobicContact CG-CD1 3.69Å; P141-Y149 HydrophobicContact CG-CE1 3.92Å; P141-Y149 HydrophobicContact CG-CG 4.19Å; R145-Y149 HydrophobicContact CB-CD2 3.74Å; R145-Y149 HydrophobicContact CB-CE2 3.66Å; R145-Y149 PolarHBondContact NH2-OH 3.03Å; G146-Y149 WeakPolarHBondContact O-CD2 3.34Å; G146-Y149 PolarHBondContact O-N 2.87Å; M147-Y149 PolarHBondContact O-N 2.91Å; Y149-V152 WeakPolarHBondContact O-CG2 3.38Å
150	N	81.9	Confident	86.4	Confident	23 Å²	23	37.4 Å²	37.4	12%	0.123	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-73.7	-19	166.9	-147.6	17	0	0	0	111.2	L143 M147 D148 L274 T276 Y317	L143-N150 HydrophobicContact CD2-CB 3.66Å; L143-N150 VanDerWaalsContact CD2-N 3.33Å; M147-N150 WeakPolarHBondContact O-CB 3.25Å; M147-N150 PolarHBondContact O-N 2.94Å; M147-N150 VanDerWaalsContact O-N 3.1Å; D148-N150 PolarHBondContact O-N 2.99Å; D148-N150 VanDerWaalsContact O-N 3.11Å; N150-L274 CarbonylContact O-C 3.51Å; N150-T276 WeakPolarHBondContact OD1-CB 3.48Å; N150-T276 WeakPolarHBondContact OD1-CG2 3.41Å; N150-T276 PolarHBondContact OD1-N 3.01Å; N150-T276 PolarHBondContact OD1-OG1 2.96Å; N150-Y317 PolarHBondContact O-OH 3.26Å; N150-Y317 VanDerWaalsContact O-OH 3.06Å
151	Q	89.8	Confident	86.2	Confident	127 Å²	127	38.7 Å²	38.7	59%	0.593	20%	0.199	S	C	*	.			trans	-107	115.9	173.8	-60.3	-173.5	23.7	0	0	110.2	D148 L273 L274	D148-Q151 PolarHBondContact O-N 3.1Å; Q151-L273 CarbonylContact C-O 3.46Å; Q151-L273 VanDerWaalsContact CA-O 3.28Å; Q151-L273 WeakPolarHBondContact CA-O 3.4Å; Q151-L274 HydrophobicContact CG-CD2 4.43Å
152	V	93.2	Very high	86.2	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	125.5	-179.2	-173.3	0	0	0	0	110.3	T41 W138 Y149 L273 Y317	T41-V152 WeakPolarHBondContact OG1-CA 3.49Å; W138-V152 HydrophobicContact CH2-CG1 3.8Å; W138-V152 HydrophobicContact CZ2-CG1 3.81Å; Y149-V152 WeakPolarHBondContact O-CG2 3.38Å; V152-L273 HydrophobicContact CB-CB 4.37Å; V152-L273 HydrophobicContact CB-CD1 4.46Å; V152-L273 PolarHBondContact N-O 3.29Å; V152-L273 WeakPolarHBondContact O-CB 3.46Å; V152-L273 PolarHBondContact O-N 3.21Å; V152-Y317 HydrophobicContact CB-CD2 4.39Å; V152-Y317 HydrophobicContact CG2-CD2 4Å; V152-Y317 HydrophobicContact CG2-CE2 4.15Å
153	N	94.7	Very high	86.5	Confident	51 Å²	51	39.2 Å²	39.2	27%	0.273	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	124.9	176.4	-52.5	-27.5	0	0	0	109.1	V40 T41 I271 R272	V40-N153 WeakPolarHBondContact CA-O 3.17Å; T41-N153 HydrophobicContact CG2-CB 3.79Å; T41-N153 PolarHBondContact N-O 2.94Å; T41-N153 VanDerWaalsContact N-O 3.11Å; T41-N153 PolarHBondContact OG1-N 2.9Å; N153-I271 WeakPolarHBondContact CA-O 3.41Å; N153-R272 WeakPolarHBondContact OD1-CG 3.46Å
154	I	95.8	Very high	87	Confident	1 Å²	1	38.8 Å²	38.8	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	122.3	172.5	-54.4	166.2	0	0	0	106.7	I38 T39 V40 M130 W138 R270 I271 L273 I319 I322	I38-I154 HydrophobicContact CD1-CG2 3.8Å; I38-I154 HydrophobicContact CG1-CG2 4.03Å; T39-I154 CarbonylContact O-C 3.52Å; T39-I154 WeakPolarHBondContact O-CA 3.45Å; V40-I154 HydrophobicContact CG1-CB 4.3Å; V40-I154 HydrophobicContact CG1-CG1 3.99Å; V40-I154 HydrophobicContact CG1-CG2 4.08Å; M130-I154 HydrophobicContact CE-CD1 4.44Å; M130-I154 HydrophobicContact CE-CG2 3.81Å; M130-I154 HydrophobicContact SD-CD1 4.1Å; M130-I154 HydrophobicContact SD-CG2 4.27Å; W138-I154 HydrophobicContact CE3-CD1 4.21Å; W138-I154 HydrophobicContact CH2-CD1 4.05Å; W138-I154 HydrophobicContact CH2-CG1 4.32Å; W138-I154 HydrophobicContact CZ3-CD1 3.71Å; W138-I154 HydrophobicContact CZ3-CG1 4.42Å; I154-R270 CarbonylContact O-C 3.06Å; I154-R270 VanDerWaalsContact O-CA 3.25Å; I154-R270 WeakPolarHBondContact O-CA 3.29Å; I154-I271 HydrophobicContact CB-CB 4.29Å; I154-I271 PolarHBondContact N-O 3.15Å; I154-I271 PolarHBondContact O-N 2.8Å; I154-L273 HydrophobicContact CD1-CD1 4Å; I154-I319 HydrophobicContact CD1-CD1 3.64Å; I154-I322 HydrophobicContact CG2-CD1 4.47Å
155	T	96.2	Very high	87.6	Confident	24 Å²	24	37.2 Å²	37.2	15%	0.147	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	122.2	-176.1	-50.4	0	0	0	0	110.4	I38 T39 Y192 V269 R270	I38-T155 CarbonylContact C-O 3.55Å; I38-T155 WeakPolarHBondContact CA-O 3.21Å; T39-T155 PolarHBondContact N-O 2.98Å; T39-T155 PolarHBondContact O-N 2.04Å; T39-T155 PolarHBondContact OG1-O 2.87Å; T39-T155 VanDerWaalsContact OG1-O 3.11Å; T155-Y192 HydrophobicContact CG2-CE1 4.39Å; T155-Y192 VanDerWaalsContact CG2-OH 3.27Å; T155-Y192 WeakPolarHBondContact CG2-OH 3.12Å; T155-V269 WeakPolarHBondContact CA-O 3.47Å; T155-R270 HydrophobicContact CG2-CB 4.45Å; T155-R270 WeakPolarHBondContact OG1-CD 3.36Å; T155-R270 WeakPolarHBondContact OG1-CG 3.36Å
156	I	94.7	Very high	88.2	Confident	2 Å²	2	38.1 Å²	38.1	1%	0.01	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	132.6	177.4	-66.6	162.7	0	0	0	108.8	K36 I38 V131 L158 N268 V269 I322 M324	K36-I156 HydrophobicContact CB-CG2 4.16Å; I38-I156 HydrophobicContact CB-CG1 4.21Å; I38-I156 HydrophobicContact CD1-CD1 3.99Å; I38-I156 HydrophobicContact CD1-CG1 3.63Å; I38-I156 HydrophobicContact CG1-CG1 3.74Å; V131-I156 HydrophobicContact CG1-CD1 4.32Å; I156-L158 HydrophobicContact CG2-CD2 3.81Å; I156-N268 VanDerWaalsContact O-CA 3.23Å; I156-N268 WeakPolarHBondContact O-CA 3.33Å; I156-N268 WeakPolarHBondContact O-CB 3.45Å; I156-V269 PolarHBondContact N-O 2.73Å; I156-V269 PolarHBondContact O-N 2.9Å; I156-I322 HydrophobicContact CD1-CB 4.46Å; I156-I322 HydrophobicContact CD1-CD1 4.08Å; I156-I322 HydrophobicContact CD1-CG2 3.76Å; I156-M324 HydrophobicContact CD1-CE 3.59Å; I156-M324 HydrophobicContact CD1-SD 4.48Å
157	D	93	Very high	89.1	Confident	38 Å²	38	37 Å²	37	20%	0.203	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	110.8	178.8	-169.5	4.3	0	0	0	109.6	K37 E159 N268	K37-D157 HydrophobicContact CB-CB 4.31Å; K37-D157 IonicContact NZ-OD2 2.71Å; K37-D157 PolarHBondContact O-N 3.5Å; D157-E159 PolarHBondContact O-N 3.28Å; D157-E159 PolarHBondContact OD1-N 3.42Å; D157-N268 WeakPolarHBondContact CA-ND2 3.37Å; D157-N268 VanDerWaalsContact CG-ND2 3.34Å; D157-N268 PolarHBondContact OD1-ND2 2.9Å
158	L	91	Very high	89.9	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	-4.5	-178.1	-50.2	178.3	0	0	0	111.9	L32 K36 I156 Q160 F162 A266 T267 V269	L32-L158 HydrophobicContact CB-CD2 4.19Å; L32-L158 WeakPolarHBondContact O-CD2 3.42Å; K36-L158 WeakPolarHBondContact CE-O 3.19Å; K36-L158 HydrophobicContact CG-CD2 4.49Å; I156-L158 HydrophobicContact CG2-CD2 3.81Å; L158-Q160 PolarHBondContact O-N 2.9Å; L158-F162 HydrophobicContact CB-CD2 3.87Å; L158-F162 HydrophobicContact CB-CE2 3.98Å; L158-F162 HydrophobicContact CD1-CD2 4.16Å; L158-F162 WeakPolarHBondContact O-CE2 3.08Å; L158-A266 HydrophobicContact CD1-CB 4.37Å; L158-T267 VanDerWaalsContact CB-O 3.26Å; L158-T267 WeakPolarHBondContact CB-O 3.22Å; L158-T267 PolarHBondContact N-O 3.43Å; L158-V269 HydrophobicContact CD1-CG2 4.3Å
159	E	84.3	Confident	90.7	Very high	73 Å²	73	25.9 Å²	25.9	34%	0.341	12%	0.124	S	C	.	.	E	Extended strand (participates in β ladder)	trans	66.1	-29	-177.6	-54.3	173	94	0	0	115.5	K36 D157 H188 T346	K36-E159 IonicContact NZ-OE2 3.62Å; K36-E159 PolarHBondContact NZ-OE2 3.33Å; D157-E159 PolarHBondContact O-N 3.28Å; D157-E159 PolarHBondContact OD1-N 3.42Å; E159-H188 PolarHBondContact O-CE1 2.71Å; E159-T346 WeakPolarHBondContact OE1-CB 3.21Å; E159-T346 PolarHBondContact OE1-OG1 3.43Å
160	Q	86.5	Confident	90.9	Very high	10 Å²	10	25.3 Å²	25.3	5%	0.047	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	171.5	174.6	69.5	178.6	48.6	0	0	111.8	L158 F162 R347 L348	L158-Q160 PolarHBondContact O-N 2.9Å; Q160-F162 HydrophobicContact CG-CD2 3.97Å; Q160-F162 HydrophobicContact CG-CE1 4.17Å; Q160-F162 HydrophobicContact CG-CE2 3.28Å; Q160-F162 HydrophobicContact CG-CZ 3.41Å; Q160-F162 VanDerWaalsContact CG-CZ 3.41Å; Q160-F162 WeakPolarHBondContact O-CD2 3.08Å; Q160-R347 HydrophobicContact CB-CG 4.47Å; Q160-L348 PolarHBondContact NE2-O 3.34Å; Q160-L348 PolarHBondContact OE1-O 2.92Å
161	E	88.4	Confident	91.3	Very high	28 Å²	28	24.3 Å²	24.3	13%	0.131	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	129	177.8	-165.9	-172.6	-122.3	0	0	112.1	R265 A266 T267 V329	E161-R265 HydrophobicContact CG-CB 4Å; E161-R265 HydrophobicContact CG-CG 4.02Å; E161-R265 WeakPolarHBondContact OE1-CB 3.17Å; E161-R265 WeakPolarHBondContact OE1-CD 3.43Å; E161-R265 IonicContact OE1-NH1 2.63Å; E161-R265 WeakPolarHBondContact OE2-CD 3.33Å; E161-R265 IonicContact OE2-CZ 3.48Å; E161-R265 IonicContact OE2-NE 3.51Å; E161-R265 IonicContact OE2-NH1 2.67Å; E161-R265 PolarHBondContact OE2-NH1 3.44Å; E161-A266 WeakPolarHBondContact CA-O 3.25Å; E161-T267 HydrophobicContact CB-CG2 3.83Å; E161-T267 HydrophobicContact CG-CG2 4.3Å; E161-V329 HydrophobicContact CG-CG2 4.2Å
162	F	92	Very high	91.3	Very high	2 Å²	2	18.3 Å²	18.3	1%	0.009	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	157.3	175.2	-65.1	-86.1	0	0	0	111.5	F30 L32 L158 Q160 R265 A266 C328 L348	F30-F162 HydrophobicContact CZ-CD1 4.49Å; F30-F162 AromaticContact CZ-CE1 3.85Å; F30-F162 HydrophobicContact CZ-CE1 3.85Å; L32-F162 HydrophobicContact CD1-CB 3.46Å; L32-F162 VanDerWaalsContact CD1-CB 3.46Å; L32-F162 HydrophobicContact CD1-CD1 4.33Å; L32-F162 HydrophobicContact CD1-CD2 4.26Å; L32-F162 HydrophobicContact CD1-CG 3.8Å; L32-F162 HydrophobicContact CD2-CB 4.21Å; L32-F162 HydrophobicContact CD2-CD1 3.46Å; L32-F162 VanDerWaalsContact CD2-CD1 3.46Å; L32-F162 HydrophobicContact CD2-CD2 4.1Å; L32-F162 HydrophobicContact CD2-CE1 3.71Å; L32-F162 HydrophobicContact CD2-CE2 4.29Å; L32-F162 HydrophobicContact CD2-CG 3.68Å; L32-F162 HydrophobicContact CD2-CZ 4.11Å; L32-F162 HydrophobicContact CG-CB 4.49Å; L32-F162 HydrophobicContact CG-CG 4.37Å; L158-F162 HydrophobicContact CB-CD2 3.87Å; L158-F162 HydrophobicContact CB-CE2 3.98Å; L158-F162 HydrophobicContact CD1-CD2 4.16Å; L158-F162 WeakPolarHBondContact O-CE2 3.08Å; Q160-F162 HydrophobicContact CG-CD2 3.97Å; Q160-F162 HydrophobicContact CG-CE1 4.17Å; Q160-F162 HydrophobicContact CG-CE2 3.28Å; Q160-F162 HydrophobicContact CG-CZ 3.41Å; Q160-F162 VanDerWaalsContact CG-CZ 3.41Å; Q160-F162 WeakPolarHBondContact O-CD2 3.08Å; F162-R265 WeakPolarHBondContact O-CA 3.15Å; F162-A266 PolarHBondContact N-O 3.25Å; F162-A266 PolarHBondContact O-N 3.15Å; F162-C328 HydrophobicContact CD1-CB 4.5Å; F162-L348 HydrophobicContact CE1-CD1 4.44Å; F162-L348 HydrophobicContact CZ-CD1 4.48Å
163	H	90.8	Very high	91	Very high	11 Å²	11	19.2 Å²	19.2	5%	0.051	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	112.2	161.4	-75.1	-70.3	0	0	0	109.4	F254 Q261 T264 G326 R327	H163-F254 AromaticContact CE1-CZ 3.91Å; H163-F254 AromaticContact ND1-CZ 3.72Å; H163-Q261 PolarHBondContact CE1-O 3.02Å; H163-Q261 VanDerWaalsContact CE1-O 3.25Å; H163-T264 PolarHBondContact ND1-OG1 2.7Å; H163-G326 CarbonylContact O-C 3.59Å; H163-G326 WeakPolarHBondContact O-CA 3.5Å; H163-R327 HydrophobicContact CB-CG 4.19Å; H163-R327 PolarHBondContact N-O 3.08Å; H163-R327 PolarHBondContact O-N 3.1Å
164	V	92.6	Very high	90.6	Very high	1 Å²	1	16.9 Å²	16.9	1%	0.006	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	130.8	173.6	-169.1	0	0	0	0	109.2	L32 V167 W195 L244 T264 A266	L32-V164 HydrophobicContact CD1-CG2 3.91Å; V164-V167 HydrophobicContact CG1-CG2 4.15Å; V164-W195 HydrophobicContact CB-CH2 3.73Å; V164-W195 HydrophobicContact CB-CZ2 4.15Å; V164-W195 HydrophobicContact CG1-CH2 4.11Å; V164-W195 HydrophobicContact CG1-CZ3 4.49Å; V164-W195 HydrophobicContact CG2-CH2 3.67Å; V164-W195 HydrophobicContact CG2-CZ2 4.28Å; V164-L244 HydrophobicContact CB-CD1 3.96Å; V164-L244 HydrophobicContact CG1-CD1 3.94Å; V164-T264 PolarHBondContact N-O 2.71Å; V164-T264 WeakPolarHBondContact O-CB 3.4Å; V164-T264 WeakPolarHBondContact O-CG2 3.32Å; V164-A266 HydrophobicContact CG2-CB 4.2Å
165	A	87.5	Confident	90	Very high	14 Å²	14	17.7 Å²	17.7	12%	0.116	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	-36.1	178.9	0	0	0	0	0	112.5	Y29 L244 L245 G325	Y29-A165 HydrophobicContact CD1-CB 4.33Å; Y29-A165 HydrophobicContact CE1-CB 3.68Å; A165-L244 PolarHBondContact O-N 3.01Å; A165-L245 HydrophobicContact CB-CD1 3.89Å; A165-G325 PolarHBondContact N-O 2.97Å
166	Y	91.4	Very high	89.6	Confident	78 Å²	78	17.8 Å²	17.8	31%	0.306	9%	0.086	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	160.6	173.8	66.7	-96.4	0	0	0	112.8	F241 I242 G325	Y166-F241 HydrophobicContact CD1-CZ 4.35Å; Y166-F241 HydrophobicContact CD2-CD2 4.41Å; Y166-F241 AromaticContact CD2-CE2 3.53Å; Y166-F241 HydrophobicContact CD2-CE2 3.53Å; Y166-F241 AromaticContact CD2-CZ 3.92Å; Y166-F241 HydrophobicContact CD2-CZ 3.92Å; Y166-F241 AromaticContact CE2-CE2 3.9Å; Y166-F241 HydrophobicContact CE2-CE2 3.9Å; Y166-F241 HydrophobicContact CE2-CZ 4.42Å; Y166-F241 AromaticContact CG-CE2 4Å; Y166-F241 HydrophobicContact CG-CE2 4Å; Y166-F241 AromaticContact CG-CZ 3.89Å; Y166-F241 HydrophobicContact CG-CZ 3.89Å; Y166-I242 CarbonylContact C-O 3.5Å; Y166-I242 WeakPolarHBondContact CA-O 3.32Å; Y166-I242 VanDerWaalsContact CB-O 3.28Å; Y166-I242 WeakPolarHBondContact CB-O 3.31Å; Y166-G325 PolarHBondContact N-O 3.38Å; Y166-G325 PolarHBondContact O-N 3.04Å; Y166-G325 VanDerWaalsContact O-N 3.11Å
167	V	92.4	Very high	89.4	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	127.8	170.1	-179.2	0	0	0	0	108.6	V164 L169 L182 W195 I242 E323 M324	V164-V167 HydrophobicContact CG1-CG2 4.15Å; V167-L169 HydrophobicContact CG1-CD2 3.94Å; V167-L169 HydrophobicContact CG1-CG 4.4Å; V167-L182 HydrophobicContact CB-CD2 4.38Å; V167-L182 HydrophobicContact CG2-CD2 4.16Å; V167-W195 HydrophobicContact CG2-CZ3 4.36Å; V167-I242 HydrophobicContact CB-CB 4.37Å; V167-I242 HydrophobicContact CB-CD1 4.25Å; V167-I242 HydrophobicContact CG1-CD1 4.39Å; V167-I242 PolarHBondContact N-O 3.18Å; V167-I242 WeakPolarHBondContact O-CB 3.35Å; V167-I242 PolarHBondContact O-N 2.87Å; V167-E323 WeakPolarHBondContact CA-O 3.3Å; V167-M324 HydrophobicContact CG1-CE 3.99Å; V167-M324 HydrophobicContact CG1-CG 4.22Å; V167-M324 HydrophobicContact CG2-CE 4.47Å; V167-M324 HydrophobicContact CG2-CG 4.16Å
168	S	90.9	Very high	89.1	Confident	3 Å²	3	16 Å²	16	2%	0.021	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	129.9	178.2	-173.7	0	0	0	0	108.2	I240 I322 E323	S168-I240 CarbonylContact C-O 3.59Å; S168-I240 WeakPolarHBondContact CA-O 3.12Å; S168-I322 WeakPolarHBondContact O-CA 3.18Å; S168-E323 WeakPolarHBondContact CB-OE2 3.3Å; S168-E323 PolarHBondContact N-O 2.78Å; S168-E323 PolarHBondContact O-N 2.84Å; S168-E323 PolarHBondContact OG-OE2 2.9Å
169	L	92.3	Very high	89.2	Confident	3 Å²	3	16.2 Å²	16.2	2%	0.016	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	133.9	174.4	-45.2	171.9	0	0	0	109.2	V167 W180 Q239 I240 I271 I322	V167-L169 HydrophobicContact CG1-CD2 3.94Å; V167-L169 HydrophobicContact CG1-CG 4.4Å; L169-W180 HydrophobicContact CD1-CH2 3.78Å; L169-W180 HydrophobicContact CD1-CZ3 3.89Å; L169-Q239 CarbonylContact O-C 3.44Å; L169-Q239 WeakPolarHBondContact O-CA 3.48Å; L169-I240 HydrophobicContact CB-CB 4.17Å; L169-I240 HydrophobicContact CD1-CD1 4.47Å; L169-I240 HydrophobicContact CD1-CG2 4.41Å; L169-I240 PolarHBondContact N-O 3.2Å; L169-I240 PolarHBondContact O-N 2.84Å; L169-I271 HydrophobicContact CD1-CD1 4.21Å; L169-I271 HydrophobicContact CD2-CD1 3.55Å; L169-I322 HydrophobicContact CD2-CB 4.25Å; L169-I322 HydrophobicContact CD2-CD1 4.26Å; L169-I322 HydrophobicContact CD2-CG1 3.78Å; L169-I322 HydrophobicContact CD2-CG2 3.84Å
170	Q	89.9	Confident	89.7	Confident	43 Å²	43	12.8 Å²	12.8	20%	0.201	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	112.9	170.7	-170.1	170.1	91.4	0	0	110.2	K320 E321	Q170-K320 PolarHBondContact O-N 2.84Å; Q170-K320 VanDerWaalsContact OE1-CD 3.31Å; Q170-K320 VanDerWaalsContact OE1-CE 3.31Å; Q170-E321 HydrophobicContact CB-CB 4.13Å; Q170-E321 PolarHBondContact N-O 2.82Å; Q170-E321 PolarHBondContact O-N 2.82Å
171	M	90.7	Very high	90.1	Very high	1 Å²	1	12.3 Å²	12.3	1%	0.005	6%	0.059	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	151.3	171	-51.9	-56.1	-67.5	0	0	110.2	S174 P175 R176 P177 N237 G238 S318 I319	M171-S174 WeakPolarHBondContact CB-O 3.16Å; M171-S174 WeakPolarHBondContact CE-OG 3.48Å; M171-P175 WeakPolarHBondContact CE-O 3.4Å; M171-R176 HydrophobicContact CG-CG 3.93Å; M171-P177 HydrophobicContact CE-CG 4.29Å; M171-N237 WeakPolarHBondContact O-CA 3.13Å; M171-N237 PolarHBondContact O-N 2.9Å; M171-G238 WeakPolarHBondContact CG-O 3.37Å; M171-G238 PolarHBondContact N-O 3.03Å; M171-S318 CarbonylContact C-O 3.22Å; M171-S318 VanDerWaalsContact CA-O 3.3Å; M171-S318 WeakPolarHBondContact CA-O 3.25Å; M171-S318 WeakPolarHBondContact CE-O 3.36Å; M171-I319 HydrophobicContact CE-CG1 4.04Å; M171-I319 HydrophobicContact SD-CD1 4.45Å; M171-I319 HydrophobicContact SD-CG1 3.84Å
172	A	88.9	Confident	90.5	Very high	1 Å²	1	11 Å²	11	1%	0.008	5%	0.053	C	C	.	.			trans	-98.2	-106.5	176.4	0	0	0	0	0	111.9	Y137 S174 G236 N237 S318 K320	Y137-A172 HydrophobicContact CD1-CB 4.06Å; Y137-A172 HydrophobicContact CD2-CB 4.3Å; Y137-A172 HydrophobicContact CG-CB 3.74Å; A172-S174 VanDerWaalsContact C-N 3.29Å; A172-S174 PolarHBondContact O-N 3.01Å; A172-G236 CarbonylContact O-C 3.51Å; A172-G236 WeakPolarHBondContact O-CA 3.03Å; A172-N237 PolarHBondContact O-N 3.32Å; A172-S318 WeakPolarHBondContact CB-OG 3.45Å; A172-S318 PolarHBondContact N-O 3.48Å; A172-K320 HydrophobicContact CB-CB 4.01Å
173	N	86.9	Confident	90.7	Very high	20 Å²	20	11.3 Å²	11.3	11%	0.107	6%	0.055	C	C	.	.	S	Bend	trans	-86.3	15.4	-176.5	64.3	-4	0	0	0	114.3	Y137 Q139 F316 S318	Y137-N173 PolarHBondContact OH-ND2 2.75Å; Q139-N173 PolarHBondContact OE1-ND2 3.43Å; Q139-N173 PolarHBondContact OE1-OD1 3.41Å; N173-F316 WeakPolarHBondContact OD1-CE2 3.11Å; N173-S318 WeakPolarHBondContact OD1-CB 3.29Å; N173-S318 PolarHBondContact OD1-OG 3.06Å
174	S	85.6	Confident	90.9	Very high	2 Å²	2	12.1 Å²	12.1	1%	0.014	6%	0.057	C	C	.	.	S	Bend	trans	-129	151	-179.7	69.3	0	0	0	0	112.6	M171 A172 L235 S318	M171-S174 WeakPolarHBondContact CB-O 3.16Å; M171-S174 WeakPolarHBondContact CE-OG 3.48Å; A172-S174 VanDerWaalsContact C-N 3.29Å; A172-S174 PolarHBondContact O-N 3.01Å; S174-L235 CarbonylContact C-O 3.58Å; S174-S318 PolarHBondContact OG-N 2.79Å; S174-S318 PolarHBondContact OG-O 3.48Å
175	P	83.7	Confident	91	Very high	18 Å²	18	12.2 Å²	12.2	12%	0.117	6%	0.058	C	C	.	.	P	Polyproline II helix	trans	-64.1	164.9	171.9	28.2	-35.8	0	0	0	112.2	M171 I232 L235	M171-P175 WeakPolarHBondContact CE-O 3.4Å; P175-I232 HydrophobicContact CB-CG1 3.82Å; P175-I232 HydrophobicContact CG-CG1 4.25Å; P175-L235 VanDerWaalsContact N-O 3.1Å
176	R	87.9	Confident	91.2	Very high	25 Å²	25	14.5 Å²	14.5	9%	0.094	7%	0.071	C	C	.	.	P	Polyproline II helix	trans	-60.6	147.9	172.9	-63.9	-175	-71.4	178.9	5.9	111.5	M171 E228 Y229 Q231 I233 Q239 I240	M171-R176 HydrophobicContact CG-CG 3.93Å; R176-E228 PolarHBondContact NH2-O 2.89Å; R176-Y229 WeakPolarHBondContact CB-O 3.23Å; R176-Y229 WeakPolarHBondContact CD-O 3.3Å; R176-Q231 PolarHBondContact NE-O 3.38Å; R176-I233 PolarHBondContact NH2-O 2.92Å; R176-Q239 PolarHBondContact NH1-O 3.46Å; R176-I240 HydrophobicContact CB-CD1 4.32Å; R176-I240 HydrophobicContact CG-CD1 4.1Å; R176-I240 HydrophobicContact CG-CG1 4.15Å
177	P	91.1	Very high	91.2	Very high	4 Å²	4	12.7 Å²	12.7	3%	0.026	7%	0.067	C	C	.	.	P	Polyproline II helix	trans	-61.3	148.1	-179.5	-18.9	31.5	0	0	0	112.1	M171 W180 S230 L273 Y317	M171-P177 HydrophobicContact CE-CG 4.29Å; P177-W180 HydrophobicContact CB-CB 4.21Å; P177-W180 HydrophobicContact CB-CG 3.91Å; P177-W180 HydrophobicContact CG-CG 4.29Å; P177-S230 WeakPolarHBondContact O-CA 3.32Å; P177-L273 HydrophobicContact CB-CD2 4.18Å; P177-L273 HydrophobicContact CG-CD2 3.68Å; P177-Y317 HydrophobicContact CB-CD1 4.37Å; P177-Y317 HydrophobicContact CB-CE1 3.78Å; P177-Y317 HydrophobicContact CG-CD1 4.2Å; P177-Y317 HydrophobicContact CG-CE1 4.1Å
178	G	87.4	Confident	91.1	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.089	C	C	.	.	S	Bend	trans	-82	-44.8	178.6	0	0	0	0	0	112.8	A199 E200 S230 R275	G178-A199 CarbonylContact O-C 3.54Å; G178-A199 WeakPolarHBondContact O-CA 3.1Å; G178-E200 WeakPolarHBondContact O-CG 3.08Å; G178-E200 PolarHBondContact O-N 3.04Å; G178-S230 WeakPolarHBondContact O-CB 3.49Å; G178-S230 PolarHBondContact O-OG 3.24Å; G178-R275 PolarHBondContact N-O 3.31Å
179	L	92.1	Very high	90.9	Very high	3 Å²	3	18.7 Å²	18.7	2%	0.016	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	127.5	176.1	-173.5	75.9	0	0	0	109.1	F198 A199 F208 F209 L274 R275	L179-F198 WeakPolarHBondContact CA-O 3.48Å; L179-A199 HydrophobicContact CD1-CB 3.67Å; L179-F208 HydrophobicContact CD1-CB 4.14Å; L179-F208 HydrophobicContact CD1-CD2 4.14Å; L179-F208 HydrophobicContact CD1-CG 4.13Å; L179-F208 HydrophobicContact CD2-CB 4.23Å; L179-F208 HydrophobicContact CD2-CD1 3.5Å; L179-F208 HydrophobicContact CD2-CD2 3.86Å; L179-F208 HydrophobicContact CD2-CE1 3.71Å; L179-F208 HydrophobicContact CD2-CE2 4.07Å; L179-F208 HydrophobicContact CD2-CG 3.58Å; L179-F208 HydrophobicContact CD2-CZ 4Å; L179-F209 HydrophobicContact CD1-CE2 3.61Å; L179-F209 HydrophobicContact CD1-CZ 3.66Å; L179-F209 HydrophobicContact CG-CZ 4.17Å; L179-L274 HydrophobicContact CB-CB 4.36Å; L179-L274 HydrophobicContact CD2-CB 3.99Å; L179-L274 HydrophobicContact CD2-CD1 4.23Å; L179-L274 HydrophobicContact CG-CB 4.13Å; L179-L274 HydrophobicContact CG-CD1 4.33Å; L179-L274 WeakPolarHBondContact O-CA 3.46Å; L179-L274 WeakPolarHBondContact O-CB 3.38Å; L179-L274 PolarHBondContact O-N 2.71Å; L179-R275 HydrophobicContact CB-CB 3.73Å; L179-R275 PolarHBondContact N-O 2.82Å; L179-R275 PolarHBondContact O-N 3.48Å
180	W	94.7	Very high	90.7	Very high	1 Å²	1	26.2 Å²	26.2	0%	0.004	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.8	168.9	179.5	63.4	-69.3	0	0	0	112.7	L169 P177 L182 F198 I240 I242 I271 R272 L273	L169-W180 HydrophobicContact CD1-CH2 3.78Å; L169-W180 HydrophobicContact CD1-CZ3 3.89Å; P177-W180 HydrophobicContact CB-CB 4.21Å; P177-W180 HydrophobicContact CB-CG 3.91Å; P177-W180 HydrophobicContact CG-CG 4.29Å; W180-L182 HydrophobicContact CZ3-CB 4.34Å; W180-F198 VanDerWaalsContact CD1-CB 3.48Å; W180-F198 HydrophobicContact CD2-CB 3.97Å; W180-F198 AromaticContact CD2-CD2 3.76Å; W180-F198 HydrophobicContact CD2-CD2 3.76Å; W180-F198 HydrophobicContact CD2-CG 4.01Å; W180-F198 VanDerWaalsContact CE2-CB 3.49Å; W180-F198 AromaticContact CE2-CD2 3.6Å; W180-F198 AromaticContact CE2-CG 3.44Å; W180-F198 VanDerWaalsContact CE2-CG 3.44Å; W180-F198 AromaticContact CE3-CD2 3.86Å; W180-F198 HydrophobicContact CE3-CD2 3.86Å; W180-F198 HydrophobicContact CE3-CE2 4.29Å; W180-F198 HydrophobicContact CG-CB 3.98Å; W180-F198 HydrophobicContact CG-CD2 4.48Å; W180-F198 HydrophobicContact CH2-CD1 4.29Å; W180-F198 AromaticContact CH2-CD2 3.66Å; W180-F198 HydrophobicContact CH2-CD2 3.66Å; W180-F198 HydrophobicContact CH2-CE1 4.2Å; W180-F198 AromaticContact CH2-CE2 3.57Å; W180-F198 HydrophobicContact CH2-CE2 3.57Å; W180-F198 HydrophobicContact CH2-CG 4.05Å; W180-F198 AromaticContact CH2-CZ 3.86Å; W180-F198 HydrophobicContact CH2-CZ 3.86Å; W180-F198 HydrophobicContact CZ2-CB 4.03Å; W180-F198 AromaticContact CZ2-CD1 3.66Å; W180-F198 HydrophobicContact CZ2-CD1 3.66Å; W180-F198 AromaticContact CZ2-CD2 3.55Å; W180-F198 HydrophobicContact CZ2-CD2 3.55Å; W180-F198 AromaticContact CZ2-CE1 3.96Å; W180-F198 HydrophobicContact CZ2-CE1 3.96Å; W180-F198 AromaticContact CZ2-CE2 3.87Å; W180-F198 HydrophobicContact CZ2-CE2 3.87Å; W180-F198 AromaticContact CZ2-CG 3.46Å; W180-F198 HydrophobicContact CZ2-CG 3.46Å; W180-F198 VanDerWaalsContact CZ2-CG 3.46Å; W180-F198 HydrophobicContact CZ2-CZ 4.07Å; W180-F198 AromaticContact CZ3-CD2 3.83Å; W180-F198 HydrophobicContact CZ3-CD2 3.83Å; W180-F198 AromaticContact CZ3-CE2 3.81Å; W180-F198 HydrophobicContact CZ3-CE2 3.81Å; W180-F198 PolarHBondContact N-O 2.91Å; W180-F198 AromaticContact NE1-CG 3.69Å; W180-F198 PolarHBondContact O-N 3.07Å; W180-F198 VanDerWaalsContact O-O 3.13Å; W180-I240 HydrophobicContact CH2-CD1 4.41Å; W180-I240 HydrophobicContact CH2-CG2 3.84Å; W180-I240 HydrophobicContact CZ2-CD1 3.83Å; W180-I240 HydrophobicContact CZ2-CG2 3.79Å; W180-I242 HydrophobicContact CH2-CD1 3.71Å; W180-I242 HydrophobicContact CZ3-CD1 4.33Å; W180-I271 HydrophobicContact CE3-CG2 3.86Å; W180-I271 HydrophobicContact CZ3-CG2 4.06Å; W180-R272 CarbonylContact C-O 3.54Å; W180-R272 WeakPolarHBondContact CA-O 3.41Å; W180-R272 VanDerWaalsContact CB-O 3.32Å; W180-R272 WeakPolarHBondContact CB-O 3.48Å; W180-L273 HydrophobicContact CB-CD2 3.98Å; W180-L273 HydrophobicContact CG-CD2 4.4Å
181	V	95.5	Very high	90.7	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	141	-179.3	-165.3	0	0	0	0	110.1	E183 P194 Y197 F209 R272 L274	V181-E183 HydrophobicContact CB-CG 4.19Å; V181-E183 HydrophobicContact CG1-CG 3.62Å; V181-P194 HydrophobicContact CG1-CB 4.1Å; V181-Y197 HydrophobicContact CB-CD1 4.34Å; V181-Y197 HydrophobicContact CG1-CD1 3.58Å; V181-Y197 HydrophobicContact CG1-CE1 3.74Å; V181-Y197 HydrophobicContact CG2-CD1 3.97Å; V181-Y197 HydrophobicContact CG2-CE1 4.32Å; V181-F209 HydrophobicContact CG2-CE1 3.62Å; V181-F209 HydrophobicContact CG2-CZ 3.92Å; V181-R272 HydrophobicContact CB-CB 4.04Å; V181-R272 HydrophobicContact CG2-CB 4.47Å; V181-R272 PolarHBondContact N-O 3.15Å; V181-R272 PolarHBondContact O-N 3.49Å; V181-L274 HydrophobicContact CG2-CD1 3.93Å
182	L	96.1	Very high	90.8	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	122.7	162.6	-178.8	69.7	0	0	0	108.9	V167 W180 W195 Q196 F198 I242 V269 I271	V167-L182 HydrophobicContact CB-CD2 4.38Å; V167-L182 HydrophobicContact CG2-CD2 4.16Å; W180-L182 HydrophobicContact CZ3-CB 4.34Å; L182-W195 HydrophobicContact CD2-CB 4.2Å; L182-W195 HydrophobicContact CD2-CE3 3.82Å; L182-W195 HydrophobicContact CG-CB 4.32Å; L182-W195 HydrophobicContact CG-CE3 3.95Å; L182-W195 PolarHBondContact O-N 2.84Å; L182-Q196 PolarHBondContact N-O 2.98Å; L182-Q196 PolarHBondContact O-N 3.43Å; L182-F198 HydrophobicContact CB-CE2 3.94Å; L182-I242 HydrophobicContact CD2-CD1 3.87Å; L182-I242 HydrophobicContact CD2-CG2 3.97Å; L182-V269 HydrophobicContact CD1-CG1 3.81Å; L182-I271 HydrophobicContact CD1-CG1 4.03Å
183	E	96.2	Very high	91	Very high	9 Å²	9	34.8 Å²	34.8	4%	0.042	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	159.2	-176.6	-55.5	172.1	139.3	0	0	111.1	V181 Y192 L193 R270 R272	V181-E183 HydrophobicContact CB-CG 4.19Å; V181-E183 HydrophobicContact CG1-CG 3.62Å; E183-Y192 HydrophobicContact CB-CD1 4.47Å; E183-L193 CarbonylContact C-O 3.23Å; E183-L193 WeakPolarHBondContact CA-O 3.48Å; E183-R270 HydrophobicContact CB-CB 4.36Å; E183-R270 PolarHBondContact N-O 2.03Å; E183-R270 PolarHBondContact O-N 2.68Å; E183-R270 IonicContact OE1-NH2 3.59Å; E183-R270 IonicContact OE2-CZ 3.39Å; E183-R270 IonicContact OE2-NE 2.72Å; E183-R270 PolarHBondContact OE2-NE 3.32Å; E183-R270 IonicContact OE2-NH2 2.68Å; E183-R270 PolarHBondContact OE2-NH2 3.42Å; E183-R272 WeakPolarHBondContact OE1-CD 3.45Å; E183-R272 IonicContact OE1-CZ 2.71Å; E183-R272 IonicContact OE1-NE 2.65Å; E183-R272 IonicContact OE1-NH1 3.58Å; E183-R272 PolarHBondContact OE1-NH1 3.29Å; E183-R272 WeakPolarHBondContact OE2-CD 3.28Å
184	R	95.2	Very high	91.3	Very high	28 Å²	28	35.3 Å²	35.3	11%	0.106	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	155.8	180	57.7	132.6	-175.5	168.2	2.5	112.2	Y192 L193 W195 R262 F263 R265 A266 N268	R184-Y192 CarbonylContact O-C 3.54Å; R184-Y192 VanDerWaalsContact O-CA 3.28Å; R184-Y192 WeakPolarHBondContact O-CA 3.49Å; R184-L193 WeakPolarHBondContact CG-O 3.34Å; R184-L193 PolarHBondContact N-O 2.78Å; R184-L193 PolarHBondContact O-N 3.42Å; R184-W195 HydrophobicContact CB-CD2 3.84Å; R184-W195 HydrophobicContact CB-CE3 3.96Å; R184-W195 HydrophobicContact CB-CH2 3.88Å; R184-W195 HydrophobicContact CB-CZ2 3.76Å; R184-W195 HydrophobicContact CB-CZ3 3.99Å; R184-W195 VanDerWaalsContact CD-NE1 3.34Å; R184-W195 HydrophobicContact CG-CD2 3.72Å; R184-W195 VanDerWaalsContact CG-CE2 3.5Å; R184-W195 HydrophobicContact CG-CE3 4.35Å; R184-W195 HydrophobicContact CG-CG 3.95Å; R184-W195 HydrophobicContact CG-CZ2 3.95Å; R184-R262 PolarHBondContact NH1-O 3.28Å; R184-R262 PolarHBondContact NH2-O 3.1Å; R184-F263 VanDerWaalsContact CZ-O 3.24Å; R184-F263 PolarHBondContact NE-O 3.45Å; R184-F263 PolarHBondContact NH1-O 2.03Å; R184-R265 WeakPolarHBondContact CD-O 3.09Å; R184-R265 PolarHBondContact NH1-O 3.09Å; R184-A266 HydrophobicContact CB-CB 4.12Å; R184-N268 CarbonylContact C-O 3.55Å; R184-N268 WeakPolarHBondContact CA-O 3.22Å
185	S	95	Very high	91.8	Very high	3 Å²	3	35.2 Å²	35.2	2%	0.021	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	147.6	171.1	176.3	0	0	0	0	109.8	D187 G189 T191 A266 T267 N268	S185-D187 PolarHBondContact OG-N 2.71Å; S185-D187 PolarHBondContact OG-OD1 3.17Å; S185-G189 WeakPolarHBondContact OG-CA 3.47Å; S185-G189 PolarHBondContact OG-N 3.05Å; S185-T191 WeakPolarHBondContact CA-O 3.49Å; S185-T191 WeakPolarHBondContact CB-O 3.41Å; S185-T191 PolarHBondContact OG-O 3.01Å; S185-A266 CarbonylContact O-C 3.47Å; S185-A266 VanDerWaalsContact O-CA 3.29Å; S185-A266 WeakPolarHBondContact O-CA 3.37Å; S185-T267 PolarHBondContact O-N 3.07Å; S185-T267 PolarHBondContact O-OG1 2.69Å; S185-N268 PolarHBondContact N-O 2.91Å; S185-N268 PolarHBondContact O-N 2.66Å
186	T	91.8	Very high	92.2	Very high	62 Å²	62	35.8 Å²	35.8	38%	0.38	19%	0.185	S	C	.	.	S	Bend	trans	-119	10.1	169.5	55.8	0	0	0	0	112.4	R265	T186-R265 HydrophobicContact CG2-CB 3.9Å; T186-R265 VanDerWaalsContact CG2-O 3.29Å; T186-R265 WeakPolarHBondContact CG2-O 3.49Å
187	D	90.1	Very high	92.6	Very high	41 Å²	41	36.9 Å²	36.9	22%	0.219	19%	0.189	C	C	.	.	S	Bend	trans	-122.9	20.8	-172.8	67.7	6.1	0	0	0	113.6	S185 G189 K190 T191	S185-D187 PolarHBondContact OG-N 2.71Å; S185-D187 PolarHBondContact OG-OD1 3.17Å; D187-G189 PolarHBondContact OD1-N 2.87Å; D187-K190 WeakPolarHBondContact O-CD 3.45Å; D187-K190 WeakPolarHBondContact O-CE 3.46Å; D187-K190 PolarHBondContact O-NZ 3.12Å; D187-K190 WeakPolarHBondContact OD1-CA 3.5Å; D187-K190 WeakPolarHBondContact OD1-CB 3.34Å; D187-K190 PolarHBondContact OD1-N 2.82Å; D187-T191 PolarHBondContact OD1-N 2.96Å; D187-T191 WeakPolarHBondContact OD2-CB 3.26Å; D187-T191 WeakPolarHBondContact OD2-CG2 3.46Å; D187-T191 PolarHBondContact OD2-N 3.22Å; D187-T191 PolarHBondContact OD2-OG1 2.96Å
188	H	90.4	Very high	92.8	Very high	102 Å²	102	36.7 Å²	36.7	47%	0.472	19%	0.188	S	C	.	.	S	Bend	trans	63	47.3	-171.7	-60.1	-91.1	0	0	0	113.2	E159 T267 N268	E159-H188 PolarHBondContact O-CE1 2.71Å; H188-T267 WeakPolarHBondContact CA-OG1 3.02Å; H188-T267 PolarHBondContact N-OG1 3.07Å; H188-T267 VanDerWaalsContact N-OG1 3.11Å; H188-N268 VanDerWaalsContact C-OD1 3.32Å; H188-N268 VanDerWaalsContact CA-OD1 3.26Å; H188-N268 WeakPolarHBondContact CA-OD1 3.47Å
189	G	87.2	Confident	93	Very high	26 Å²	26	36.7 Å²	36.7	27%	0.268	19%	0.188	S	C	.	.	S	Bend	trans	81.4	19.6	166.2	0	0	0	0	0	115.6	S185 D187 Y192 N268	S185-G189 WeakPolarHBondContact OG-CA 3.47Å; S185-G189 PolarHBondContact OG-N 3.05Å; D187-G189 PolarHBondContact OD1-N 2.87Å; G189-Y192 WeakPolarHBondContact CA-OH 3.48Å; G189-Y192 WeakPolarHBondContact O-CE2 3.08Å; G189-N268 PolarHBondContact N-OD1 3.35Å; G189-N268 VanDerWaalsContact N-OD1 3.08Å
190	K	87.4	Confident	92.6	Very high	162 Å²	162	38.2 Å²	38.2	70%	0.704	20%	0.195	S	C	*	.	S	Bend	trans	-88.3	-42.3	178.7	-52.2	168.8	-171.9	122.5	0	111	D187	D187-K190 WeakPolarHBondContact O-CD 3.45Å; D187-K190 WeakPolarHBondContact O-CE 3.46Å; D187-K190 PolarHBondContact O-NZ 3.12Å; D187-K190 WeakPolarHBondContact OD1-CA 3.5Å; D187-K190 WeakPolarHBondContact OD1-CB 3.34Å; D187-K190 PolarHBondContact OD1-N 2.82Å
191	T	91	Very high	92.2	Very high	80 Å²	80	41 Å²	41	49%	0.491	21%	0.212	S	C	.	.	S	Bend	trans	-118.9	151.2	171.1	64.9	0	0	0	0	110.7	S185 D187	S185-T191 WeakPolarHBondContact CA-O 3.49Å; S185-T191 WeakPolarHBondContact CB-O 3.41Å; S185-T191 PolarHBondContact OG-O 3.01Å; D187-T191 PolarHBondContact OD1-N 2.96Å; D187-T191 WeakPolarHBondContact OD2-CB 3.26Å; D187-T191 WeakPolarHBondContact OD2-CG2 3.46Å; D187-T191 PolarHBondContact OD2-N 3.22Å; D187-T191 PolarHBondContact OD2-OG1 2.96Å
192	Y	93.1	Very high	91.7	Very high	48 Å²	48	44.5 Å²	44.5	19%	0.188	24%	0.235	C	C	.	.			trans	-131.8	133.1	177.1	-73.9	-93.8	0	0	0	109.5	T155 E183 R184 G189 N268 R270	T155-Y192 HydrophobicContact CG2-CE1 4.39Å; T155-Y192 VanDerWaalsContact CG2-OH 3.27Å; T155-Y192 WeakPolarHBondContact CG2-OH 3.12Å; E183-Y192 HydrophobicContact CB-CD1 4.47Å; R184-Y192 CarbonylContact O-C 3.54Å; R184-Y192 VanDerWaalsContact O-CA 3.28Å; R184-Y192 WeakPolarHBondContact O-CA 3.49Å; G189-Y192 WeakPolarHBondContact CA-OH 3.48Å; G189-Y192 WeakPolarHBondContact O-CE2 3.08Å; Y192-N268 HydrophobicContact CE1-CB 4.27Å; Y192-R270 HydrophobicContact CD1-CB 3.74Å; Y192-R270 HydrophobicContact CE1-CB 3.59Å
193	L	92.9	Very high	91	Very high	96 Å²	96	47.5 Å²	47.5	50%	0.503	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	143	175.8	-62.5	176.3	0	0	0	109.3	E183 R184	E183-L193 CarbonylContact C-O 3.23Å; E183-L193 WeakPolarHBondContact CA-O 3.48Å; R184-L193 WeakPolarHBondContact CG-O 3.34Å; R184-L193 PolarHBondContact N-O 2.78Å; R184-L193 PolarHBondContact O-N 3.42Å
194	P	93.8	Very high	90.5	Very high	32 Å²	32	48.9 Å²	48.9	21%	0.208	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	143.5	177.9	30.5	-35.7	0	0	0	111.3	V181 Y197 V223	V181-P194 HydrophobicContact CG1-CB 4.1Å; P194-Y197 HydrophobicContact CB-CE1 3.96Å; P194-Y197 HydrophobicContact CG-CE1 4.4Å; P194-V223 HydrophobicContact CB-CG1 3.91Å; P194-V223 HydrophobicContact CG-CG1 4.01Å; P194-V223 HydrophobicContact CG-CG2 4.39Å; P194-V223 WeakPolarHBondContact O-CG2 3.36Å
195	W	94.1	Very high	90.2	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	-43.7	164	-92.3	-30.9	0	0	0	110.9	V164 V167 L182 R184 L244 F263 A266 V269	V164-W195 HydrophobicContact CB-CH2 3.73Å; V164-W195 HydrophobicContact CB-CZ2 4.15Å; V164-W195 HydrophobicContact CG1-CH2 4.11Å; V164-W195 HydrophobicContact CG1-CZ3 4.49Å; V164-W195 HydrophobicContact CG2-CH2 3.67Å; V164-W195 HydrophobicContact CG2-CZ2 4.28Å; V167-W195 HydrophobicContact CG2-CZ3 4.36Å; L182-W195 HydrophobicContact CD2-CB 4.2Å; L182-W195 HydrophobicContact CD2-CE3 3.82Å; L182-W195 HydrophobicContact CG-CB 4.32Å; L182-W195 HydrophobicContact CG-CE3 3.95Å; L182-W195 PolarHBondContact O-N 2.84Å; R184-W195 HydrophobicContact CB-CD2 3.84Å; R184-W195 HydrophobicContact CB-CE3 3.96Å; R184-W195 HydrophobicContact CB-CH2 3.88Å; R184-W195 HydrophobicContact CB-CZ2 3.76Å; R184-W195 HydrophobicContact CB-CZ3 3.99Å; R184-W195 VanDerWaalsContact CD-NE1 3.34Å; R184-W195 HydrophobicContact CG-CD2 3.72Å; R184-W195 VanDerWaalsContact CG-CE2 3.5Å; R184-W195 HydrophobicContact CG-CE3 4.35Å; R184-W195 HydrophobicContact CG-CG 3.95Å; R184-W195 HydrophobicContact CG-CZ2 3.95Å; W195-L244 HydrophobicContact CB-CD2 3.89Å; W195-L244 HydrophobicContact CD2-CD1 3.76Å; W195-L244 HydrophobicContact CD2-CD2 3.83Å; W195-L244 HydrophobicContact CD2-CG 4.49Å; W195-L244 HydrophobicContact CE3-CD1 3.94Å; W195-L244 HydrophobicContact CE3-CD2 4.22Å; W195-L244 HydrophobicContact CG-CD1 4.41Å; W195-L244 HydrophobicContact CG-CD2 3.71Å; W195-L244 HydrophobicContact CH2-CD1 3.9Å; W195-L244 HydrophobicContact CZ2-CD1 3.69Å; W195-L244 HydrophobicContact CZ3-CD1 4.01Å; W195-F263 HydrophobicContact CB-CZ 4.47Å; W195-F263 AromaticContact CD1-CE1 3.58Å; W195-F263 AromaticContact CD1-CE2 3.94Å; W195-F263 AromaticContact CD1-CZ 3.48Å; W195-F263 VanDerWaalsContact CD1-CZ 3.48Å; W195-F263 HydrophobicContact CG-CE1 4.47Å; W195-F263 HydrophobicContact CG-CZ 4.31Å; W195-F263 PolarHBondContact NE1-O 2.84Å; W195-A266 HydrophobicContact CH2-CB 3.62Å; W195-A266 HydrophobicContact CZ2-CB 3.85Å; W195-V269 HydrophobicContact CE3-CG1 4.4Å; W195-V269 HydrophobicContact CH2-CG2 3.8Å; W195-V269 HydrophobicContact CZ3-CB 4.36Å; W195-V269 HydrophobicContact CZ3-CG1 3.79Å; W195-V269 HydrophobicContact CZ3-CG2 3.63Å
196	Q	93.1	Very high	89.9	Confident	29 Å²	29	52.5 Å²	52.5	14%	0.136	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	147.2	-179.4	-165.3	165.8	4.2	0	0	111.5	L182 F198 I224	L182-Q196 PolarHBondContact N-O 2.98Å; L182-Q196 PolarHBondContact O-N 3.43Å; Q196-F198 HydrophobicContact CB-CE2 3.85Å; Q196-F198 HydrophobicContact CB-CZ 3.83Å; Q196-F198 HydrophobicContact CG-CE1 4.24Å; Q196-F198 HydrophobicContact CG-CE2 4.04Å; Q196-F198 HydrophobicContact CG-CZ 3.73Å; Q196-F198 WeakPolarHBondContact O-CE2 3.22Å; Q196-I224 HydrophobicContact CG-CG1 4.38Å; Q196-I224 WeakPolarHBondContact CG-O 3.44Å
197	Y	95.6	Very high	89.7	Confident	49 Å²	49	56 Å²	56	19%	0.192	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	153.7	176	-61.9	-64.7	0	0	0	111.9	V181 P194 F209 V223 I224 C225 T226	V181-Y197 HydrophobicContact CB-CD1 4.34Å; V181-Y197 HydrophobicContact CG1-CD1 3.58Å; V181-Y197 HydrophobicContact CG1-CE1 3.74Å; V181-Y197 HydrophobicContact CG2-CD1 3.97Å; V181-Y197 HydrophobicContact CG2-CE1 4.32Å; P194-Y197 HydrophobicContact CB-CE1 3.96Å; P194-Y197 HydrophobicContact CG-CE1 4.4Å; Y197-F209 HydrophobicContact CD1-CB 4.1Å; Y197-F209 AromaticContact CD1-CD1 3.22Å; Y197-F209 HydrophobicContact CD1-CD1 3.22Å; Y197-F209 AromaticContact CD1-CD2 3.97Å; Y197-F209 HydrophobicContact CD1-CD2 3.97Å; Y197-F209 AromaticContact CD1-CE1 3.49Å; Y197-F209 HydrophobicContact CD1-CE1 3.49Å; Y197-F209 VanDerWaalsContact CD1-CE1 3.49Å; Y197-F209 HydrophobicContact CD1-CE2 4.18Å; Y197-F209 AromaticContact CD1-CG 3.49Å; Y197-F209 HydrophobicContact CD1-CG 3.49Å; Y197-F209 VanDerWaalsContact CD1-CG 3.49Å; Y197-F209 AromaticContact CD1-CZ 3.95Å; Y197-F209 HydrophobicContact CD1-CZ 3.95Å; Y197-F209 HydrophobicContact CD2-CB 3.83Å; Y197-F209 HydrophobicContact CD2-CD2 4.49Å; Y197-F209 HydrophobicContact CD2-CG 4.05Å; Y197-F209 HydrophobicContact CE1-CB 4.25Å; Y197-F209 AromaticContact CE1-CD1 3.42Å; Y197-F209 HydrophobicContact CE1-CD1 3.42Å; Y197-F209 VanDerWaalsContact CE1-CD1 3.42Å; Y197-F209 AromaticContact CE1-CE1 3.92Å; Y197-F209 HydrophobicContact CE1-CE1 3.92Å; Y197-F209 AromaticContact CE1-CG 3.94Å; Y197-F209 HydrophobicContact CE1-CG 3.94Å; Y197-F209 HydrophobicContact CE2-CB 3.96Å; Y197-F209 HydrophobicContact CE2-CG 4.42Å; Y197-F209 HydrophobicContact CG-CB 3.88Å; Y197-F209 AromaticContact CG-CD1 3.83Å; Y197-F209 HydrophobicContact CG-CD1 3.83Å; Y197-F209 AromaticContact CG-CD2 3.79Å; Y197-F209 HydrophobicContact CG-CD2 3.79Å; Y197-F209 HydrophobicContact CG-CE1 4.29Å; Y197-F209 HydrophobicContact CG-CE2 4.24Å; Y197-F209 AromaticContact CG-CG 3.55Å; Y197-F209 HydrophobicContact CG-CG 3.55Å; Y197-F209 HydrophobicContact CG-CZ 4.47Å; Y197-V223 HydrophobicContact CD2-CG1 3.71Å; Y197-V223 HydrophobicContact CE2-CB 4.49Å; Y197-V223 HydrophobicContact CE2-CG1 3.53Å; Y197-I224 PolarHBondContact N-O 2.76Å; Y197-C225 VanDerWaalsContact O-CA 3.29Å; Y197-C225 WeakPolarHBondContact O-CA 3.48Å; Y197-T226 PolarHBondContact O-N 3.12Å
198	F	95.2	Very high	89.6	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	124.4	-178.1	-56.7	-91	0	0	0	111.1	L179 W180 L182 Q196 T226 Y229 I242	L179-F198 WeakPolarHBondContact CA-O 3.48Å; W180-F198 VanDerWaalsContact CD1-CB 3.48Å; W180-F198 HydrophobicContact CD2-CB 3.97Å; W180-F198 AromaticContact CD2-CD2 3.76Å; W180-F198 HydrophobicContact CD2-CD2 3.76Å; W180-F198 HydrophobicContact CD2-CG 4.01Å; W180-F198 VanDerWaalsContact CE2-CB 3.49Å; W180-F198 AromaticContact CE2-CD2 3.6Å; W180-F198 AromaticContact CE2-CG 3.44Å; W180-F198 VanDerWaalsContact CE2-CG 3.44Å; W180-F198 AromaticContact CE3-CD2 3.86Å; W180-F198 HydrophobicContact CE3-CD2 3.86Å; W180-F198 HydrophobicContact CE3-CE2 4.29Å; W180-F198 HydrophobicContact CG-CB 3.98Å; W180-F198 HydrophobicContact CG-CD2 4.48Å; W180-F198 HydrophobicContact CH2-CD1 4.29Å; W180-F198 AromaticContact CH2-CD2 3.66Å; W180-F198 HydrophobicContact CH2-CD2 3.66Å; W180-F198 HydrophobicContact CH2-CE1 4.2Å; W180-F198 AromaticContact CH2-CE2 3.57Å; W180-F198 HydrophobicContact CH2-CE2 3.57Å; W180-F198 HydrophobicContact CH2-CG 4.05Å; W180-F198 AromaticContact CH2-CZ 3.86Å; W180-F198 HydrophobicContact CH2-CZ 3.86Å; W180-F198 HydrophobicContact CZ2-CB 4.03Å; W180-F198 AromaticContact CZ2-CD1 3.66Å; W180-F198 HydrophobicContact CZ2-CD1 3.66Å; W180-F198 AromaticContact CZ2-CD2 3.55Å; W180-F198 HydrophobicContact CZ2-CD2 3.55Å; W180-F198 AromaticContact CZ2-CE1 3.96Å; W180-F198 HydrophobicContact CZ2-CE1 3.96Å; W180-F198 AromaticContact CZ2-CE2 3.87Å; W180-F198 HydrophobicContact CZ2-CE2 3.87Å; W180-F198 AromaticContact CZ2-CG 3.46Å; W180-F198 HydrophobicContact CZ2-CG 3.46Å; W180-F198 VanDerWaalsContact CZ2-CG 3.46Å; W180-F198 HydrophobicContact CZ2-CZ 4.07Å; W180-F198 AromaticContact CZ3-CD2 3.83Å; W180-F198 HydrophobicContact CZ3-CD2 3.83Å; W180-F198 AromaticContact CZ3-CE2 3.81Å; W180-F198 HydrophobicContact CZ3-CE2 3.81Å; W180-F198 PolarHBondContact N-O 2.91Å; W180-F198 AromaticContact NE1-CG 3.69Å; W180-F198 PolarHBondContact O-N 3.07Å; W180-F198 VanDerWaalsContact O-O 3.13Å; L182-F198 HydrophobicContact CB-CE2 3.94Å; Q196-F198 HydrophobicContact CB-CE2 3.85Å; Q196-F198 HydrophobicContact CB-CZ 3.83Å; Q196-F198 HydrophobicContact CG-CE1 4.24Å; Q196-F198 HydrophobicContact CG-CE2 4.04Å; Q196-F198 HydrophobicContact CG-CZ 3.73Å; Q196-F198 WeakPolarHBondContact O-CE2 3.22Å; F198-T226 WeakPolarHBondContact CA-O 3.32Å; F198-T226 HydrophobicContact CD1-CG2 3.43Å; F198-T226 VanDerWaalsContact CD1-CG2 3.43Å; F198-T226 HydrophobicContact CE1-CG2 3.45Å; F198-T226 VanDerWaalsContact CE1-CG2 3.45Å; F198-Y229 HydrophobicContact CD1-CD2 4.31Å; F198-Y229 AromaticContact CE1-CD2 3.96Å; F198-Y229 HydrophobicContact CE1-CD2 3.96Å; F198-I242 HydrophobicContact CE2-CD1 4.47Å; F198-I242 HydrophobicContact CZ-CD1 3.95Å; F198-I242 HydrophobicContact CZ-CG1 4.09Å; F198-I242 HydrophobicContact CZ-CG2 4.09Å
199	A	91.6	Very high	89.7	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.289	C	S	.	.			trans	-142.3	164.2	-177	0	0	0	0	0	111.9	G178 L179 T201 Q204 F209 T226 T227 S230	G178-A199 CarbonylContact O-C 3.54Å; G178-A199 WeakPolarHBondContact O-CA 3.1Å; L179-A199 HydrophobicContact CD1-CB 3.67Å; A199-T201 PolarHBondContact O-N 3.22Å; A199-Q204 HydrophobicContact CB-CB 3.8Å; A199-F209 HydrophobicContact CB-CE2 4.32Å; A199-T226 PolarHBondContact N-O 2.04Å; A199-T227 VanDerWaalsContact O-CA 3.3Å; A199-T227 WeakPolarHBondContact O-CA 3.31Å; A199-T227 WeakPolarHBondContact O-CG2 3.09Å; A199-S230 PolarHBondContact N-OG 3.13Å; A199-S230 WeakPolarHBondContact O-CB 3.37Å; A199-S230 PolarHBondContact O-OG 3.22Å
200	E	84.9	Confident	89.7	Confident	34 Å²	34	55.1 Å²	55.1	16%	0.159	29%	0.289	C	S	.	.	S	Bend	trans	-75.6	-24.8	-173.8	-53.8	-171.8	-143.1	0	0	113.8	G178 R275 K277	G178-E200 WeakPolarHBondContact O-CG 3.08Å; G178-E200 PolarHBondContact O-N 3.04Å; E200-R275 VanDerWaalsContact CD-NH2 3.34Å; E200-R275 IonicContact OE1-CZ 2.63Å; E200-R275 IonicContact OE1-NE 2.71Å; E200-R275 IonicContact OE1-NH2 2.6Å; E200-R275 PolarHBondContact OE1-NH2 2.79Å; E200-K277 HydrophobicContact CG-CD 4.21Å; E200-K277 VanDerWaalsContact OE2-CD 3.28Å; E200-K277 WeakPolarHBondContact OE2-CD 3.34Å; E200-K277 WeakPolarHBondContact OE2-CE 3.35Å; E200-K277 IonicContact OE2-NZ 3.95Å; E200-K277 PolarHBondContact OE2-NZ 3.32Å
201	T	84.8	Confident	89.5	Confident	60 Å²	60	50.8 Å²	50.8	37%	0.368	28%	0.277	S	S	.	.	S	Bend	trans	-147.5	158.8	-178.1	61.9	0	0	0	0	110.1	A199 A203 Q204 C205	A199-T201 PolarHBondContact O-N 3.22Å; T201-A203 VanDerWaalsContact C-N 3.27Å; T201-A203 PolarHBondContact O-N 3.19Å; T201-Q204 PolarHBondContact O-N 3.21Å; T201-Q204 WeakPolarHBondContact OG1-CG 3.31Å; T201-Q204 PolarHBondContact OG1-N 3.38Å; T201-C205 PolarHBondContact O-N 2.94Å
202	P	85.2	Confident	89	Confident	74 Å²	74	53 Å²	53	48%	0.481	29%	0.286	S	S	.	.	H	α-helix	trans	-58.8	-37.3	176.8	-25.9	36.5	0	0	0	113.1	Q204 C205 E206 L214 T227	P202-Q204 PolarHBondContact O-N 3.43Å; P202-C205 WeakPolarHBondContact O-CA 3.5Å; P202-C205 VanDerWaalsContact O-CB 3.26Å; P202-C205 WeakPolarHBondContact O-CB 3.4Å; P202-C205 PolarHBondContact O-N 3.4Å; P202-E206 PolarHBondContact O-N 3.38Å; P202-E206 VanDerWaalsContact O-N 3.11Å; P202-L214 HydrophobicContact CB-CD1 4.39Å; P202-L214 HydrophobicContact CB-CD2 3.82Å; P202-T227 HydrophobicContact CG-CG2 4.39Å
203	A	81.3	Confident	88.7	Confident	63 Å²	63	50.9 Å²	50.9	52%	0.521	28%	0.278	S	S	.	.	H	α-helix	trans	-59.2	-32.8	175.3	0	0	0	0	0	112.7	T201 E206 E207	T201-A203 VanDerWaalsContact C-N 3.27Å; T201-A203 PolarHBondContact O-N 3.19Å; A203-E206 PolarHBondContact O-N 3.4Å; A203-E207 VanDerWaalsContact O-CB 3.24Å; A203-E207 WeakPolarHBondContact O-CB 3.11Å; A203-E207 PolarHBondContact O-N 3.2Å
204	Q	86.9	Confident	88.3	Confident	38 Å²	38	49.7 Å²	49.7	18%	0.178	27%	0.272	C	S	.	.	H	α-helix	trans	-79.2	-21.6	175.3	-70.9	178.3	4.5	0	0	113.3	A199 T201 P202 F208 R275	A199-Q204 HydrophobicContact CB-CB 3.8Å; T201-Q204 PolarHBondContact O-N 3.21Å; T201-Q204 WeakPolarHBondContact OG1-CG 3.31Å; T201-Q204 PolarHBondContact OG1-N 3.38Å; P202-Q204 PolarHBondContact O-N 3.43Å; Q204-F208 HydrophobicContact CB-CD2 4.45Å; Q204-F208 WeakPolarHBondContact O-CB 3.46Å; Q204-F208 WeakPolarHBondContact O-CD2 3.48Å; Q204-F208 PolarHBondContact O-N 2.95Å; Q204-R275 VanDerWaalsContact CD-NH2 3.31Å
205	C	89.4	Confident	87.6	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.007	29%	0.288	C	S	.	.	H	α-helix	trans	-66.3	-47.3	167	-64.2	0	0	0	0	110.2	T201 P202 F209 G210 S213 L214 C225	T201-C205 PolarHBondContact O-N 2.94Å; P202-C205 WeakPolarHBondContact O-CA 3.5Å; P202-C205 VanDerWaalsContact O-CB 3.26Å; P202-C205 WeakPolarHBondContact O-CB 3.4Å; P202-C205 PolarHBondContact O-N 3.4Å; C205-F209 CarbonylContact O-C 3.45Å; C205-F209 WeakPolarHBondContact O-CA 3.46Å; C205-F209 WeakPolarHBondContact O-CB 3.39Å; C205-F209 PolarHBondContact O-N 3.3Å; C205-G210 PolarHBondContact O-N 3.2Å; C205-S213 PolarHBondContact O-OG 2.77Å; C205-L214 HydrophobicContact CB-CD2 3.61Å; C205-L214 HydrophobicContact CB-CG 4.17Å; C205-C225 HydrophobicContact CB-CB 3.39Å; C205-C225 WeakPolarHBondContact CB-SG 3.43Å; C205-C225 WeakPolarHBondContact SG-CB 3.47Å; C205-C225 CovalentContact SG-SG 2.03Å; C205-C225 PolarHBondContact SG-SG 2.8Å
206	E	88.6	Confident	87	Confident	105 Å²	105	57.5 Å²	57.5	49%	0.491	31%	0.313	S	S	.	.	H	α-helix	trans	-62.9	-45.8	176.7	-173.9	170.3	-154	0	0	112.1	P202 A203 F208 G210 P211 L214	P202-E206 PolarHBondContact O-N 3.38Å; P202-E206 VanDerWaalsContact O-N 3.11Å; A203-E206 PolarHBondContact O-N 3.4Å; E206-F208 PolarHBondContact O-N 3.07Å; E206-G210 VanDerWaalsContact O-CA 3.3Å; E206-G210 WeakPolarHBondContact O-CA 3.42Å; E206-G210 PolarHBondContact O-N 3.36Å; E206-P211 HydrophobicContact CG-CB 4.26Å; E206-L214 HydrophobicContact CB-CD1 4.06Å
207	E	86.4	Confident	86.5	Confident	135 Å²	135	57.8 Å²	57.8	63%	0.631	32%	0.315	S	S	*	.	H	α-helix	trans	-61.4	-41.5	179.4	-176.6	-176.5	-163.3	0	0	113.8	A203	A203-E207 VanDerWaalsContact O-CB 3.24Å; A203-E207 WeakPolarHBondContact O-CB 3.11Å; A203-E207 PolarHBondContact O-N 3.2Å
208	F	89.2	Confident	85.8	Confident	96 Å²	96	62 Å²	62	42%	0.421	34%	0.339	S	S	.	.	H	α-helix	trans	-105.2	-18.9	-173	-74.1	-87.6	0	0	0	114.9	L179 Q204 E206	L179-F208 HydrophobicContact CD1-CB 4.14Å; L179-F208 HydrophobicContact CD1-CD2 4.14Å; L179-F208 HydrophobicContact CD1-CG 4.13Å; L179-F208 HydrophobicContact CD2-CB 4.23Å; L179-F208 HydrophobicContact CD2-CD1 3.5Å; L179-F208 HydrophobicContact CD2-CD2 3.86Å; L179-F208 HydrophobicContact CD2-CE1 3.71Å; L179-F208 HydrophobicContact CD2-CE2 4.07Å; L179-F208 HydrophobicContact CD2-CG 3.58Å; L179-F208 HydrophobicContact CD2-CZ 4Å; Q204-F208 HydrophobicContact CB-CD2 4.45Å; Q204-F208 WeakPolarHBondContact O-CB 3.46Å; Q204-F208 WeakPolarHBondContact O-CD2 3.48Å; Q204-F208 PolarHBondContact O-N 2.95Å; E206-F208 PolarHBondContact O-N 3.07Å
209	F	92.7	Very high	85.2	Confident	30 Å²	30	65.7 Å²	65.7	13%	0.132	36%	0.358	C	S	.	.	H	α-helix	trans	-134.2	3.6	-173.4	-46.4	-58.5	0	0	0	113.8	L179 V181 Y197 A199 C205 L274	L179-F209 HydrophobicContact CD1-CE2 3.61Å; L179-F209 HydrophobicContact CD1-CZ 3.66Å; L179-F209 HydrophobicContact CG-CZ 4.17Å; V181-F209 HydrophobicContact CG2-CE1 3.62Å; V181-F209 HydrophobicContact CG2-CZ 3.92Å; Y197-F209 HydrophobicContact CD1-CB 4.1Å; Y197-F209 AromaticContact CD1-CD1 3.22Å; Y197-F209 HydrophobicContact CD1-CD1 3.22Å; Y197-F209 AromaticContact CD1-CD2 3.97Å; Y197-F209 HydrophobicContact CD1-CD2 3.97Å; Y197-F209 AromaticContact CD1-CE1 3.49Å; Y197-F209 HydrophobicContact CD1-CE1 3.49Å; Y197-F209 VanDerWaalsContact CD1-CE1 3.49Å; Y197-F209 HydrophobicContact CD1-CE2 4.18Å; Y197-F209 AromaticContact CD1-CG 3.49Å; Y197-F209 HydrophobicContact CD1-CG 3.49Å; Y197-F209 VanDerWaalsContact CD1-CG 3.49Å; Y197-F209 AromaticContact CD1-CZ 3.95Å; Y197-F209 HydrophobicContact CD1-CZ 3.95Å; Y197-F209 HydrophobicContact CD2-CB 3.83Å; Y197-F209 HydrophobicContact CD2-CD2 4.49Å; Y197-F209 HydrophobicContact CD2-CG 4.05Å; Y197-F209 HydrophobicContact CE1-CB 4.25Å; Y197-F209 AromaticContact CE1-CD1 3.42Å; Y197-F209 HydrophobicContact CE1-CD1 3.42Å; Y197-F209 VanDerWaalsContact CE1-CD1 3.42Å; Y197-F209 AromaticContact CE1-CE1 3.92Å; Y197-F209 HydrophobicContact CE1-CE1 3.92Å; Y197-F209 AromaticContact CE1-CG 3.94Å; Y197-F209 HydrophobicContact CE1-CG 3.94Å; Y197-F209 HydrophobicContact CE2-CB 3.96Å; Y197-F209 HydrophobicContact CE2-CG 4.42Å; Y197-F209 HydrophobicContact CG-CB 3.88Å; Y197-F209 AromaticContact CG-CD1 3.83Å; Y197-F209 HydrophobicContact CG-CD1 3.83Å; Y197-F209 AromaticContact CG-CD2 3.79Å; Y197-F209 HydrophobicContact CG-CD2 3.79Å; Y197-F209 HydrophobicContact CG-CE1 4.29Å; Y197-F209 HydrophobicContact CG-CE2 4.24Å; Y197-F209 AromaticContact CG-CG 3.55Å; Y197-F209 HydrophobicContact CG-CG 3.55Å; Y197-F209 HydrophobicContact CG-CZ 4.47Å; A199-F209 HydrophobicContact CB-CE2 4.32Å; C205-F209 CarbonylContact O-C 3.45Å; C205-F209 WeakPolarHBondContact O-CA 3.46Å; C205-F209 WeakPolarHBondContact O-CB 3.39Å; C205-F209 PolarHBondContact O-N 3.3Å; F209-L274 HydrophobicContact CE1-CD1 4.35Å; F209-L274 HydrophobicContact CZ-CD1 4.45Å
210	G	86.1	Confident	84.9	Confident	25 Å²	25	66.3 Å²	66.3	26%	0.258	36%	0.361	S	S	.	.			trans	82.5	161	177.3	0	0	0	0	0	114.4	C205 E206 D212 S213	C205-G210 PolarHBondContact O-N 3.2Å; E206-G210 VanDerWaalsContact O-CA 3.3Å; E206-G210 WeakPolarHBondContact O-CA 3.42Å; E206-G210 PolarHBondContact O-N 3.36Å; G210-D212 VanDerWaalsContact C-N 3.28Å; G210-D212 PolarHBondContact O-N 2.89Å; G210-S213 WeakPolarHBondContact O-CB 3.3Å; G210-S213 PolarHBondContact O-N 3.1Å; G210-S213 VanDerWaalsContact O-N 3.14Å; G210-S213 PolarHBondContact O-OG 3.33Å
211	P	82.7	Confident	85.1	Confident	71 Å²	71	68.2 Å²	68.2	46%	0.461	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-65.1	-28.9	-175	26.4	-35.2	0	0	0	113.1	E206 S213 L214	E206-P211 HydrophobicContact CG-CB 4.26Å; P211-S213 PolarHBondContact O-N 3Å; P211-L214 WeakPolarHBondContact O-CB 3.47Å; P211-L214 PolarHBondContact O-N 2.95Å
212	D	81.1	Confident	85.3	Confident	127 Å²	127	66.8 Å²	66.8	68%	0.679	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-60.5	-27.1	176.3	-61.8	-39.1	0	0	0	112.5	G210 L214 Q215	G210-D212 VanDerWaalsContact C-N 3.28Å; G210-D212 PolarHBondContact O-N 2.89Å; D212-L214 PolarHBondContact O-N 3.3Å; D212-Q215 WeakPolarHBondContact O-CB 3.38Å; D212-Q215 WeakPolarHBondContact O-CG 3.35Å; D212-Q215 PolarHBondContact O-N 2.87Å; D212-Q215 VanDerWaalsContact O-N 3.13Å
213	S	86.4	Confident	85.6	Confident	3 Å²	3	65.1 Å²	65.1	2%	0.021	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-67.1	-16.1	176.8	77.2	0	0	0	0	113.8	C205 G210 P211 I224 C225	C205-S213 PolarHBondContact O-OG 2.77Å; G210-S213 WeakPolarHBondContact O-CB 3.3Å; G210-S213 PolarHBondContact O-N 3.1Å; G210-S213 VanDerWaalsContact O-N 3.14Å; G210-S213 PolarHBondContact O-OG 3.33Å; P211-S213 PolarHBondContact O-N 3Å; S213-I224 CarbonylContact O-C 3.45Å; S213-C225 PolarHBondContact O-N 3.3Å
214	L	85	Confident	86.1	Confident	72 Å²	72	63.7 Å²	63.7	38%	0.377	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-89.4	-6.8	175.1	-68.9	179.8	0	0	0	113.8	P202 C205 E206 P211 D212	P202-L214 HydrophobicContact CB-CD1 4.39Å; P202-L214 HydrophobicContact CB-CD2 3.82Å; C205-L214 HydrophobicContact CB-CD2 3.61Å; C205-L214 HydrophobicContact CB-CG 4.17Å; E206-L214 HydrophobicContact CB-CD1 4.06Å; P211-L214 WeakPolarHBondContact O-CB 3.47Å; P211-L214 PolarHBondContact O-N 2.95Å; D212-L214 PolarHBondContact O-N 3.3Å
215	Q	80.1	Confident	86.4	Confident	113 Å²	113	62.6 Å²	62.6	53%	0.528	33%	0.333	S	S	.	.	S	Bend	trans	-71.7	151.7	178.3	-60.7	-61.6	-21.4	0	0	111.4	D212 I224	D212-Q215 WeakPolarHBondContact O-CB 3.38Å; D212-Q215 WeakPolarHBondContact O-CG 3.35Å; D212-Q215 PolarHBondContact O-N 2.87Å; D212-Q215 VanDerWaalsContact O-N 3.13Å; Q215-I224 VanDerWaalsContact O-CG2 3.23Å; Q215-I224 WeakPolarHBondContact O-CG2 3.47Å
216	P	79.9	Confident	86.4	Confident	83 Å²	83	63.8 Å²	63.8	54%	0.539	34%	0.34	S	S	.	.			trans	-63.8	164.7	168.1	28.9	-34.9	0	0	0	111.3	M218	P216-M218 HydrophobicContact CG-CG 4.5Å; P216-M218 HydrophobicContact CG-SD 3.94Å; P216-M218 PolarHBondContact O-N 2.92Å
217	I	83.2	Confident	86.3	Confident	34 Å²	34	61.1 Å²	61.1	17%	0.174	33%	0.331	C	S	.	.			trans	-70.1	99.1	175	-60	-177.1	0	0	0	109	D219 I224 N247 R248	I217-D219 WeakPolarHBondContact CG2-O 3.11Å; I217-I224 HydrophobicContact CD1-CD1 4.05Å; I217-I224 HydrophobicContact CG1-CD1 3.97Å; I217-I224 HydrophobicContact CG1-CG1 4.35Å; I217-I224 HydrophobicContact CG1-CG2 3.8Å; I217-N247 HydrophobicContact CD1-CB 4.32Å; I217-N247 WeakPolarHBondContact CG2-O 3.07Å; I217-R248 HydrophobicContact CD1-CG 4.34Å; I217-R248 HydrophobicContact CG2-CB 4.41Å; I217-R248 HydrophobicContact CG2-CG 3.67Å
218	M	80.9	Confident	86.2	Confident	139 Å²	139	59.6 Å²	59.6	69%	0.685	32%	0.324	S	S	*	.			trans	-89	-28.5	177.5	-61.7	-58.9	-69.6	0	0	112.4	P216 P249	P216-M218 HydrophobicContact CG-CG 4.5Å; P216-M218 HydrophobicContact CG-SD 3.94Å; P216-M218 PolarHBondContact O-N 2.92Å; M218-P249 WeakPolarHBondContact O-CG 3.37Å
219	D	83.3	Confident	86	Confident	76 Å²	76	57 Å²	57	41%	0.406	31%	0.312	S	S	.	.	S	Bend	trans	-131.1	155.1	-173.1	-108	-63.5	0	0	0	111.2	I217 D221 S222 K259	I217-D219 WeakPolarHBondContact CG2-O 3.11Å; D219-D221 PolarHBondContact O-N 2.92Å; D219-D221 VanDerWaalsContact O-N 3.12Å; D219-S222 WeakPolarHBondContact CB-OG 3.4Å; D219-S222 PolarHBondContact N-OG 2.74Å; D219-S222 WeakPolarHBondContact O-CB 3.29Å; D219-S222 PolarHBondContact O-N 3.24Å; D219-S222 VanDerWaalsContact O-N 3.09Å; D219-S222 PolarHBondContact O-OG 2.63Å; D219-K259 IonicContact OD1-NZ 2.72Å; D219-K259 PolarHBondContact OD1-NZ 3.44Å; D219-K259 IonicContact OD2-NZ 3.12Å
220	D	85.8	Confident	85.6	Confident	14 Å²	14	55.5 Å²	55.5	8%	0.075	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-20.3	179.5	-85.1	-35.6	0	0	0	114	R248 G250 S257 K259 L260	D220-R248 WeakPolarHBondContact O-CD 3.02Å; D220-R248 PolarHBondContact O-NH1 2.87Å; D220-R248 WeakPolarHBondContact OD1-CB 3.47Å; D220-G250 VanDerWaalsContact CG-N 3.35Å; D220-G250 WeakPolarHBondContact OD1-CA 3.33Å; D220-G250 PolarHBondContact OD1-N 3.14Å; D220-G250 VanDerWaalsContact OD2-CA 3.31Å; D220-G250 WeakPolarHBondContact OD2-CA 3.32Å; D220-G250 PolarHBondContact OD2-N 3.43Å; D220-S257 WeakPolarHBondContact OD2-CB 3.47Å; D220-S257 PolarHBondContact OD2-OG 3.25Å; D220-K259 HydrophobicContact CB-CB 3.62Å; D220-K259 HydrophobicContact CB-CD 4.27Å; D220-L260 HydrophobicContact CB-CB 4.05Å
221	D	88.5	Confident	85	Confident	73 Å²	73	59.5 Å²	59.5	39%	0.39	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.2	6.7	176.9	47	8.5	0	0	0	114.3	D219 V223 K259 F263	D219-D221 PolarHBondContact O-N 2.92Å; D219-D221 VanDerWaalsContact O-N 3.12Å; D221-V223 PolarHBondContact O-N 2.88Å; D221-K259 WeakPolarHBondContact OD1-CD 3.34Å; D221-K259 WeakPolarHBondContact OD1-CE 3.32Å; D221-K259 IonicContact OD1-NZ 3.36Å; D221-K259 PolarHBondContact OD1-NZ 2.96Å; D221-K259 WeakPolarHBondContact OD2-CD 3.02Å; D221-K259 WeakPolarHBondContact OD2-CE 3.49Å; D221-K259 IonicContact OD2-NZ 3.58Å; D221-K259 PolarHBondContact OD2-NZ 2.88Å; D221-F263 HydrophobicContact CB-CD2 4.18Å
222	S	88.6	Confident	84.5	Confident	30 Å²	30	57.5 Å²	57.5	21%	0.21	30%	0.302	C	S	.	.			trans	-59.2	136.7	174.4	-59.4	0	0	0	0	112.5	D219 R248	D219-S222 WeakPolarHBondContact CB-OG 3.4Å; D219-S222 PolarHBondContact N-OG 2.74Å; D219-S222 WeakPolarHBondContact O-CB 3.29Å; D219-S222 PolarHBondContact O-N 3.24Å; D219-S222 VanDerWaalsContact O-N 3.09Å; D219-S222 PolarHBondContact O-OG 2.63Å; S222-R248 VanDerWaalsContact O-CZ 3.31Å; S222-R248 PolarHBondContact O-NH1 3.13Å; S222-R248 PolarHBondContact O-NH2 2.96Å
223	V	91.1	Very high	83.7	Confident	40 Å²	40	55.6 Å²	55.6	24%	0.242	29%	0.291	C	S	.	.			trans	-114	114.4	176.8	178.9	0	0	0	0	108.7	P194 Y197 D221 F263	P194-V223 HydrophobicContact CB-CG1 3.91Å; P194-V223 HydrophobicContact CG-CG1 4.01Å; P194-V223 HydrophobicContact CG-CG2 4.39Å; P194-V223 WeakPolarHBondContact O-CG2 3.36Å; Y197-V223 HydrophobicContact CD2-CG1 3.71Å; Y197-V223 HydrophobicContact CE2-CB 4.49Å; Y197-V223 HydrophobicContact CE2-CG1 3.53Å; D221-V223 PolarHBondContact O-N 2.88Å; V223-F263 HydrophobicContact CG2-CE2 4.24Å
224	I	91.4	Very high	83.1	Confident	33 Å²	33	58 Å²	58	17%	0.169	31%	0.307	C	S	.	.			trans	-109	166.9	-175.3	64.5	164.3	0	0	0	111.8	Q196 Y197 S213 Q215 I217	Q196-I224 HydrophobicContact CG-CG1 4.38Å; Q196-I224 WeakPolarHBondContact CG-O 3.44Å; Y197-I224 PolarHBondContact N-O 2.76Å; S213-I224 CarbonylContact O-C 3.45Å; Q215-I224 VanDerWaalsContact O-CG2 3.23Å; Q215-I224 WeakPolarHBondContact O-CG2 3.47Å; I217-I224 HydrophobicContact CD1-CD1 4.05Å; I217-I224 HydrophobicContact CG1-CD1 3.97Å; I217-I224 HydrophobicContact CG1-CG1 4.35Å; I217-I224 HydrophobicContact CG1-CG2 3.8Å
225	C	93.3	Very high	82.3	Confident	15 Å²	15	57.3 Å²	57.3	10%	0.101	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	139.7	169.1	-173.2	0	0	0	0	111.3	Y197 C205 S213	Y197-C225 VanDerWaalsContact O-CA 3.29Å; Y197-C225 WeakPolarHBondContact O-CA 3.48Å; C205-C225 HydrophobicContact CB-CB 3.39Å; C205-C225 WeakPolarHBondContact CB-SG 3.43Å; C205-C225 WeakPolarHBondContact SG-CB 3.47Å; C205-C225 CovalentContact SG-SG 2.03Å; C205-C225 PolarHBondContact SG-SG 2.8Å; S213-C225 PolarHBondContact O-N 3.3Å
226	T	89.4	Confident	82	Confident	26 Å²	26	52.8 Å²	52.8	16%	0.16	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	148.6	172.1	-177.3	0	0	0	0	112.3	Y197 F198 A199 E228 Y229	Y197-T226 PolarHBondContact O-N 3.12Å; F198-T226 WeakPolarHBondContact CA-O 3.32Å; F198-T226 HydrophobicContact CD1-CG2 3.43Å; F198-T226 VanDerWaalsContact CD1-CG2 3.43Å; F198-T226 HydrophobicContact CE1-CG2 3.45Å; F198-T226 VanDerWaalsContact CE1-CG2 3.45Å; A199-T226 PolarHBondContact N-O 2.04Å; T226-E228 PolarHBondContact OG1-N 3.36Å; T226-Y229 HydrophobicContact CG2-CD2 4.02Å
227	T	87.8	Confident	82	Confident	48 Å²	48	51.9 Å²	51.9	29%	0.294	28%	0.277	S	S	.	.	S	Bend	trans	-103.1	-4.6	178.6	62.4	0	0	0	0	113.4	A199 P202 Y229 S230	A199-T227 VanDerWaalsContact O-CA 3.3Å; A199-T227 WeakPolarHBondContact O-CA 3.31Å; A199-T227 WeakPolarHBondContact O-CG2 3.09Å; P202-T227 HydrophobicContact CG-CG2 4.39Å; T227-Y229 VanDerWaalsContact C-N 3.33Å; T227-Y229 PolarHBondContact O-N 3.16Å; T227-S230 PolarHBondContact O-N 2.81Å
228	E	82.9	Confident	81.7	Confident	103 Å²	103	50.2 Å²	50.2	48%	0.481	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-39	-176.4	-171.6	-177.4	152.4	0	0	112.8	R176 T226	R176-E228 PolarHBondContact NH2-O 2.89Å; T226-E228 PolarHBondContact OG1-N 3.36Å
229	Y	85.6	Confident	81.8	Confident	41 Å²	41	48.6 Å²	48.6	16%	0.161	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	3.5	-173.7	-58.7	-70.4	0	0	0	114.4	R176 F198 T226 T227 I240 F241	R176-Y229 WeakPolarHBondContact CB-O 3.23Å; R176-Y229 WeakPolarHBondContact CD-O 3.3Å; F198-Y229 HydrophobicContact CD1-CD2 4.31Å; F198-Y229 AromaticContact CE1-CD2 3.96Å; F198-Y229 HydrophobicContact CE1-CD2 3.96Å; T226-Y229 HydrophobicContact CG2-CD2 4.02Å; T227-Y229 VanDerWaalsContact C-N 3.33Å; T227-Y229 PolarHBondContact O-N 3.16Å; Y229-I240 HydrophobicContact CD1-CB 4.12Å; Y229-I240 HydrophobicContact CD1-CG1 4.24Å; Y229-I240 HydrophobicContact CD1-CG2 3.89Å; Y229-I240 HydrophobicContact CG-CB 4.48Å; Y229-I240 HydrophobicContact CG-CG2 3.82Å; Y229-F241 PolarHBondContact OH-O 3.25Å
230	S	84.9	Confident	82.1	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.24	C	C	.	.			trans	-111.3	20.3	-178.9	-55.3	0	0	0	0	113.7	P177 G178 A199 T227 K277	P177-S230 WeakPolarHBondContact O-CA 3.32Å; G178-S230 WeakPolarHBondContact O-CB 3.49Å; G178-S230 PolarHBondContact O-OG 3.24Å; A199-S230 PolarHBondContact N-OG 3.13Å; A199-S230 WeakPolarHBondContact O-CB 3.37Å; A199-S230 PolarHBondContact O-OG 3.22Å; T227-S230 PolarHBondContact O-N 2.81Å; S230-K277 VanDerWaalsContact O-CD 3.27Å; S230-K277 WeakPolarHBondContact O-CD 3.01Å; S230-K277 WeakPolarHBondContact O-CE 3.45Å; S230-K277 PolarHBondContact O-NZ 3.48Å
231	Q	73.2	Confident	82.2	Confident	108 Å²	108	48.3 Å²	48.3	51%	0.505	25%	0.254	S	S	.	.			trans	-84.3	141.8	172.3	-53.3	-175.6	14.5	0	0	110.5	R176 I233	R176-Q231 PolarHBondContact NE-O 3.38Å; Q231-I233 PolarHBondContact O-N 3.24Å
232	I	73	Confident	82.3	Confident	30 Å²	30	45 Å²	45	15%	0.154	24%	0.236	C	C	.	.	S	Bend	trans	-69.8	-15.4	-176.4	-154.7	178.6	0	0	0	113.1	P175 P234 L235 K277 L279	P175-I232 HydrophobicContact CB-CG1 3.82Å; P175-I232 HydrophobicContact CG-CG1 4.25Å; I232-P234 CarbonylContact O-C 3.54Å; I232-P234 VanDerWaalsContact O-C 3.23Å; I232-P234 VanDerWaalsContact O-O 3.11Å; I232-L235 HydrophobicContact CD1-CD2 4.34Å; I232-L235 HydrophobicContact CG1-CD2 4.07Å; I232-K277 HydrophobicContact CB-CD 3.74Å; I232-K277 HydrophobicContact CB-CG 3.95Å; I232-K277 HydrophobicContact CD1-CG 4.14Å; I232-K277 WeakPolarHBondContact CD1-O 3.31Å; I232-K277 HydrophobicContact CG1-CB 4.32Å; I232-K277 HydrophobicContact CG1-CD 4.28Å; I232-K277 HydrophobicContact CG1-CG 3.97Å; I232-L279 HydrophobicContact CD1-CD2 3.6Å; I232-L279 HydrophobicContact CD1-CG 3.73Å
233	I	64.3	Low	82.2	Confident	86 Å²	86	45.9 Å²	45.9	44%	0.441	24%	0.241	S	C	.	.			trans	-94.3	132.5	174.1	-60.6	180	0	0	0	108	R176 Q231 A1358	R176-I233 PolarHBondContact NH2-O 2.92Å; Q231-I233 PolarHBondContact O-N 3.24Å; I233-A1358 HydrophobicContact CD1-CB 4.27Å; I233-A1358 WeakPolarHBondContact CD1-O 3.28Å
234	P	72.6	Confident	82.2	Confident	53 Å²	53	44.1 Å²	44.1	34%	0.344	23%	0.23	S	C	.	.	S	Bend	cis	-78.1	157.3	-5.4	35.6	-37.3	0	0	0	112.9	I232 G236 G238	I232-P234 CarbonylContact O-C 3.54Å; I232-P234 VanDerWaalsContact O-C 3.23Å; I232-P234 VanDerWaalsContact O-O 3.11Å; P234-G236 WeakPolarHBondContact CB-O 3.02Å; P234-G236 WeakPolarHBondContact CG-O 3.25Å; P234-G236 PolarHBondContact O-N 3.05Å; P234-G238 VanDerWaalsContact CG-CA 3.42Å
235	L	68.9	Low	81.9	Confident	59 Å²	59	44.3 Å²	44.3	31%	0.309	23%	0.231	S	C	.	.	S	Bend	trans	-73.7	-3.3	-178.6	-66.4	172.7	0	0	0	114.5	S174 P175 I232	S174-L235 CarbonylContact C-O 3.58Å; P175-L235 VanDerWaalsContact N-O 3.1Å; I232-L235 HydrophobicContact CD1-CD2 4.34Å; I232-L235 HydrophobicContact CG1-CD2 4.07Å
236	G	73.6	Confident	81.1	Confident	18 Å²	18	46.2 Å²	46.2	19%	0.186	24%	0.24	C	C	.	.	S	Bend	trans	-176.9	165.7	-179.6	0	0	0	0	0	109	A172 P234 G238	A172-G236 CarbonylContact O-C 3.51Å; A172-G236 WeakPolarHBondContact O-CA 3.03Å; P234-G236 WeakPolarHBondContact CB-O 3.02Å; P234-G236 WeakPolarHBondContact CG-O 3.25Å; P234-G236 PolarHBondContact O-N 3.05Å; G236-G238 PolarHBondContact O-N 3.49Å; G236-G238 VanDerWaalsContact O-N 3.09Å
237	N	79	Confident	80.4	Confident	63 Å²	63	51.2 Å²	51.2	34%	0.337	27%	0.266	S	S	.	.	S	Bend	trans	53	26.3	-173.2	-61.3	-33.2	0	0	0	113.6	M171 A172 Q239	M171-N237 WeakPolarHBondContact O-CA 3.13Å; M171-N237 PolarHBondContact O-N 2.9Å; A172-N237 PolarHBondContact O-N 3.32Å; N237-Q239 PolarHBondContact O-N 2.92Å
238	G	77.7	Confident	80.2	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.255	C	S	.	.			trans	-76.9	117.2	-176.7	0	0	0	0	0	112	M171 P234 G236	M171-G238 WeakPolarHBondContact CG-O 3.37Å; M171-G238 PolarHBondContact N-O 3.03Å; P234-G238 VanDerWaalsContact CG-CA 3.42Å; G236-G238 PolarHBondContact O-N 3.49Å; G236-G238 VanDerWaalsContact O-N 3.09Å
239	Q	82.5	Confident	80.2	Confident	104 Å²	104	48.8 Å²	48.8	49%	0.486	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	147	175.1	-161.4	170.2	13.3	0	0	111.8	L169 R176 N237	L169-Q239 CarbonylContact O-C 3.44Å; L169-Q239 WeakPolarHBondContact O-CA 3.48Å; R176-Q239 PolarHBondContact NH1-O 3.46Å; N237-Q239 PolarHBondContact O-N 2.92Å
240	I	89	Confident	79.8	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.005	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	121.1	174.5	-60.2	177	0	0	0	106.2	S168 L169 R176 W180 Y229 I242	S168-I240 CarbonylContact C-O 3.59Å; S168-I240 WeakPolarHBondContact CA-O 3.12Å; L169-I240 HydrophobicContact CB-CB 4.17Å; L169-I240 HydrophobicContact CD1-CD1 4.47Å; L169-I240 HydrophobicContact CD1-CG2 4.41Å; L169-I240 PolarHBondContact N-O 3.2Å; L169-I240 PolarHBondContact O-N 2.84Å; R176-I240 HydrophobicContact CB-CD1 4.32Å; R176-I240 HydrophobicContact CG-CD1 4.1Å; R176-I240 HydrophobicContact CG-CG1 4.15Å; W180-I240 HydrophobicContact CH2-CD1 4.41Å; W180-I240 HydrophobicContact CH2-CG2 3.84Å; W180-I240 HydrophobicContact CZ2-CD1 3.83Å; W180-I240 HydrophobicContact CZ2-CG2 3.79Å; Y229-I240 HydrophobicContact CD1-CB 4.12Å; Y229-I240 HydrophobicContact CD1-CG1 4.24Å; Y229-I240 HydrophobicContact CD1-CG2 3.89Å; Y229-I240 HydrophobicContact CG-CB 4.48Å; Y229-I240 HydrophobicContact CG-CG2 3.82Å; I240-I242 HydrophobicContact CG2-CD1 3.96Å; I240-I242 HydrophobicContact CG2-CG1 3.81Å
241	F	88.7	Confident	79.5	Confident	84 Å²	84	52.8 Å²	52.8	37%	0.368	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	113.1	-175.4	-170.9	-100.1	0	0	0	110.6	Y166 Y229 T243	Y166-F241 HydrophobicContact CD1-CZ 4.35Å; Y166-F241 HydrophobicContact CD2-CD2 4.41Å; Y166-F241 AromaticContact CD2-CE2 3.53Å; Y166-F241 HydrophobicContact CD2-CE2 3.53Å; Y166-F241 AromaticContact CD2-CZ 3.92Å; Y166-F241 HydrophobicContact CD2-CZ 3.92Å; Y166-F241 AromaticContact CE2-CE2 3.9Å; Y166-F241 HydrophobicContact CE2-CE2 3.9Å; Y166-F241 HydrophobicContact CE2-CZ 4.42Å; Y166-F241 AromaticContact CG-CE2 4Å; Y166-F241 HydrophobicContact CG-CE2 4Å; Y166-F241 AromaticContact CG-CZ 3.89Å; Y166-F241 HydrophobicContact CG-CZ 3.89Å; Y229-F241 PolarHBondContact OH-O 3.25Å; F241-T243 HydrophobicContact CD1-CG2 3.9Å; F241-T243 HydrophobicContact CE1-CG2 3.43Å; F241-T243 VanDerWaalsContact CE1-CG2 3.43Å; F241-T243 HydrophobicContact CZ-CG2 4.32Å
242	I	90.2	Very high	79.1	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.01	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	110.2	-162.8	-48.2	165.9	0	0	0	108.3	Y166 V167 W180 L182 F198 I240	Y166-I242 CarbonylContact C-O 3.5Å; Y166-I242 WeakPolarHBondContact CA-O 3.32Å; Y166-I242 VanDerWaalsContact CB-O 3.28Å; Y166-I242 WeakPolarHBondContact CB-O 3.31Å; V167-I242 HydrophobicContact CB-CB 4.37Å; V167-I242 HydrophobicContact CB-CD1 4.25Å; V167-I242 HydrophobicContact CG1-CD1 4.39Å; V167-I242 PolarHBondContact N-O 3.18Å; V167-I242 WeakPolarHBondContact O-CB 3.35Å; V167-I242 PolarHBondContact O-N 2.87Å; W180-I242 HydrophobicContact CH2-CD1 3.71Å; W180-I242 HydrophobicContact CZ3-CD1 4.33Å; L182-I242 HydrophobicContact CD2-CD1 3.87Å; L182-I242 HydrophobicContact CD2-CG2 3.97Å; F198-I242 HydrophobicContact CE2-CD1 4.47Å; F198-I242 HydrophobicContact CZ-CD1 3.95Å; F198-I242 HydrophobicContact CZ-CG1 4.09Å; F198-I242 HydrophobicContact CZ-CG2 4.09Å; I240-I242 HydrophobicContact CG2-CD1 3.96Å; I240-I242 HydrophobicContact CG2-CG1 3.81Å
243	T	88.1	Confident	79	Confident	49 Å²	49	52 Å²	52	30%	0.301	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	105.9	-175.1	44.6	0	0	0	0	110.9	F241 L245 N246	F241-T243 HydrophobicContact CD1-CG2 3.9Å; F241-T243 HydrophobicContact CE1-CG2 3.43Å; F241-T243 VanDerWaalsContact CE1-CG2 3.43Å; F241-T243 HydrophobicContact CZ-CG2 4.32Å; T243-L245 PolarHBondContact O-N 2.63Å; T243-N246 VanDerWaalsContact CB-ND2 3.34Å; T243-N246 WeakPolarHBondContact CB-ND2 3.03Å; T243-N246 PolarHBondContact OG1-ND2 3.05Å
244	L	90.2	Very high	79.4	Confident	3 Å²	3	49.5 Å²	49.5	2%	0.016	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-16	-175.9	-61.7	177.2	0	0	0	113.3	V164 A165 W195 R248 F263	V164-L244 HydrophobicContact CB-CD1 3.96Å; V164-L244 HydrophobicContact CG1-CD1 3.94Å; A165-L244 PolarHBondContact O-N 3.01Å; W195-L244 HydrophobicContact CB-CD2 3.89Å; W195-L244 HydrophobicContact CD2-CD1 3.76Å; W195-L244 HydrophobicContact CD2-CD2 3.83Å; W195-L244 HydrophobicContact CD2-CG 4.49Å; W195-L244 HydrophobicContact CE3-CD1 3.94Å; W195-L244 HydrophobicContact CE3-CD2 4.22Å; W195-L244 HydrophobicContact CG-CD1 4.41Å; W195-L244 HydrophobicContact CG-CD2 3.71Å; W195-L244 HydrophobicContact CH2-CD1 3.9Å; W195-L244 HydrophobicContact CZ2-CD1 3.69Å; W195-L244 HydrophobicContact CZ3-CD1 4.01Å; L244-R248 WeakPolarHBondContact O-CD 3.37Å; L244-R248 PolarHBondContact O-NE 2.81Å; L244-F263 HydrophobicContact CB-CE1 4.49Å; L244-F263 HydrophobicContact CD2-CE1 4.34Å
245	L	84.2	Confident	79.3	Confident	37 Å²	37	48.2 Å²	48.2	19%	0.194	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-12.3	-176.2	-65.6	174.7	0	0	0	115	A165 T243 R251 F254 L260 T264	A165-L245 HydrophobicContact CB-CD1 3.89Å; T243-L245 PolarHBondContact O-N 2.63Å; L245-R251 WeakPolarHBondContact O-CB 3.02Å; L245-R251 WeakPolarHBondContact O-CD 3.4Å; L245-R251 VanDerWaalsContact O-CG 3.31Å; L245-R251 WeakPolarHBondContact O-CG 3.47Å; L245-F254 HydrophobicContact CD2-CD2 3.91Å; L245-F254 HydrophobicContact CD2-CE2 3.94Å; L245-L260 HydrophobicContact CD2-CD1 4.17Å; L245-L260 HydrophobicContact CD2-CD2 4.07Å; L245-L260 HydrophobicContact CD2-CG 4.14Å; L245-T264 HydrophobicContact CD2-CG2 3.77Å
246	N	76.7	Confident	79.4	Confident	56 Å²	56	48.4 Å²	48.4	30%	0.299	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	146.8	-176.8	-85.3	-26.2	0	0	0	111.5	T243 R248 R251	T243-N246 VanDerWaalsContact CB-ND2 3.34Å; T243-N246 WeakPolarHBondContact CB-ND2 3.03Å; T243-N246 PolarHBondContact OG1-ND2 3.05Å; N246-R248 PolarHBondContact O-N 2.77Å; N246-R251 PolarHBondContact OD1-NH1 2.86Å; N246-R251 PolarHBondContact OD1-NH2 3.1Å
247	N	75.6	Confident	79.9	Confident	131 Å²	131	48.3 Å²	48.3	70%	0.701	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	12	177.4	-55.6	-8.6	0	0	0	116.5	I217	I217-N247 HydrophobicContact CD1-CB 4.32Å; I217-N247 WeakPolarHBondContact CG2-O 3.07Å
248	R	83.9	Confident	80.1	Confident	14 Å²	14	48.3 Å²	48.3	5%	0.053	26%	0.264	C	S	.	.			trans	-88.2	133.5	174.9	-74.8	-179.5	-169.1	-71.2	-16.9	111.3	I217 D220 S222 L244 N246 G250 R251 L260 F263	I217-R248 HydrophobicContact CD1-CG 4.34Å; I217-R248 HydrophobicContact CG2-CB 4.41Å; I217-R248 HydrophobicContact CG2-CG 3.67Å; D220-R248 WeakPolarHBondContact O-CD 3.02Å; D220-R248 PolarHBondContact O-NH1 2.87Å; D220-R248 WeakPolarHBondContact OD1-CB 3.47Å; S222-R248 VanDerWaalsContact O-CZ 3.31Å; S222-R248 PolarHBondContact O-NH1 3.13Å; S222-R248 PolarHBondContact O-NH2 2.96Å; L244-R248 WeakPolarHBondContact O-CD 3.37Å; L244-R248 PolarHBondContact O-NE 2.81Å; N246-R248 PolarHBondContact O-N 2.77Å; R248-G250 VanDerWaalsContact C-N 3.31Å; R248-G250 PolarHBondContact O-N 3.15Å; R248-R251 WeakPolarHBondContact O-CB 3.26Å; R248-R251 PolarHBondContact O-N 3.03Å; R248-L260 HydrophobicContact CB-CD1 4.17Å; R248-L260 VanDerWaalsContact CD-CD1 3.43Å; R248-L260 HydrophobicContact CG-CD1 4.4Å; R248-F263 VanDerWaalsContact CZ-CZ 3.4Å
249	P	81.9	Confident	80.5	Confident	86 Å²	86	52.1 Å²	52.1	56%	0.558	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-54.1	-41.4	-173.8	-28.2	34.5	0	0	0	114.8	M218 R251	M218-P249 WeakPolarHBondContact O-CG 3.37Å; P249-R251 VanDerWaalsContact C-N 3.26Å; P249-R251 PolarHBondContact O-N 2.79Å
250	G	77.4	Confident	80.8	Confident	9 Å²	9	47.2 Å²	47.2	9%	0.093	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-77.7	0.4	179.3	0	0	0	0	0	114.7	D220 R248 G252 N253 F254 L260	D220-G250 VanDerWaalsContact CG-N 3.35Å; D220-G250 WeakPolarHBondContact OD1-CA 3.33Å; D220-G250 PolarHBondContact OD1-N 3.14Å; D220-G250 VanDerWaalsContact OD2-CA 3.31Å; D220-G250 WeakPolarHBondContact OD2-CA 3.32Å; D220-G250 PolarHBondContact OD2-N 3.43Å; R248-G250 VanDerWaalsContact C-N 3.31Å; R248-G250 PolarHBondContact O-N 3.15Å; G250-G252 VanDerWaalsContact C-N 3.27Å; G250-G252 PolarHBondContact O-N 3.05Å; G250-N253 CarbonylContact O-C 3.58Å; G250-N253 PolarHBondContact O-N 2.03Å; G250-F254 WeakPolarHBondContact O-CA 3.26Å; G250-F254 PolarHBondContact O-N 3.03Å; G250-L260 VanDerWaalsContact C-CD2 3.48Å
251	R	79.5	Confident	80.7	Confident	116 Å²	116	48 Å²	48	44%	0.438	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-53	-45.4	177.7	179.4	-166.8	177.6	168.7	8.7	111.8	L245 N246 R248 P249 N253	L245-R251 WeakPolarHBondContact O-CB 3.02Å; L245-R251 WeakPolarHBondContact O-CD 3.4Å; L245-R251 VanDerWaalsContact O-CG 3.31Å; L245-R251 WeakPolarHBondContact O-CG 3.47Å; N246-R251 PolarHBondContact OD1-NH1 2.86Å; N246-R251 PolarHBondContact OD1-NH2 3.1Å; R248-R251 WeakPolarHBondContact O-CB 3.26Å; R248-R251 PolarHBondContact O-N 3.03Å; P249-R251 VanDerWaalsContact C-N 3.26Å; P249-R251 PolarHBondContact O-N 2.79Å; R251-N253 PolarHBondContact O-N 2.98Å
252	G	65	Low	80.7	Confident	61 Å²	61	52.4 Å²	52.4	63%	0.629	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-69.4	-13.2	179.8	0	0	0	0	0	114	G250	G250-G252 VanDerWaalsContact C-N 3.27Å; G250-G252 PolarHBondContact O-N 3.05Å
253	N	69.6	Low	80.8	Confident	61 Å²	61	52.6 Å²	52.6	33%	0.326	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-146.2	56.6	-179.5	-165.4	-11.9	0	0	0	111.3	G250 R251 S255 H256 S257	G250-N253 CarbonylContact O-C 3.58Å; G250-N253 PolarHBondContact O-N 2.03Å; R251-N253 PolarHBondContact O-N 2.98Å; N253-S255 PolarHBondContact O-N 2.83Å; N253-S255 VanDerWaalsContact O-N 3.13Å; N253-H256 PolarHBondContact ND2-ND1 2.98Å; N253-H256 PolarHBondContact O-N 3.1Å; N253-H256 WeakPolarHBondContact OD1-CB 3.17Å; N253-H256 PolarHBondContact OD1-N 2.81Å; N253-H256 PolarHBondContact OD1-ND1 2.6Å; N253-S257 PolarHBondContact O-N 2.93Å; N253-S257 VanDerWaalsContact O-N 3.14Å
254	F	74	Confident	81	Confident	33 Å²	33	50.3 Å²	50.3	15%	0.145	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-35.2	-178.6	-178.2	-86.9	0	0	0	112.1	H163 L245 G250 H256 S257 L260 Q261 T264	H163-F254 AromaticContact CE1-CZ 3.91Å; H163-F254 AromaticContact ND1-CZ 3.72Å; L245-F254 HydrophobicContact CD2-CD2 3.91Å; L245-F254 HydrophobicContact CD2-CE2 3.94Å; G250-F254 WeakPolarHBondContact O-CA 3.26Å; G250-F254 PolarHBondContact O-N 3.03Å; F254-H256 VanDerWaalsContact C-N 3.3Å; F254-H256 PolarHBondContact O-N 2.98Å; F254-S257 PolarHBondContact O-N 3.4Å; F254-L260 HydrophobicContact CD2-CD2 3.81Å; F254-L260 HydrophobicContact CD2-CG 3.86Å; F254-L260 HydrophobicContact CE2-CG 4.1Å; F254-Q261 HydrophobicContact CD1-CG 4.13Å; F254-Q261 HydrophobicContact CE1-CG 3.69Å; F254-Q261 HydrophobicContact CE2-CG 4.49Å; F254-Q261 HydrophobicContact CZ-CG 3.9Å; F254-Q261 WeakPolarHBondContact O-CG 3.01Å; F254-Q261 PolarHBondContact O-NE2 2.55Å; F254-T264 HydrophobicContact CE2-CG2 4.15Å
255	S	69.3	Low	81.1	Confident	25 Å²	25	51.9 Å²	51.9	18%	0.175	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-30.3	178.7	-48.3	0	0	0	0	113.6	N253 Q261	N253-S255 PolarHBondContact O-N 2.83Å; N253-S255 VanDerWaalsContact O-N 3.13Å; S255-Q261 PolarHBondContact O-NE2 3.38Å
256	H	72.1	Confident	81.6	Confident	64 Å²	64	50.1 Å²	50.1	30%	0.296	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-22.7	176.9	-72.5	81.9	0	0	0	114.1	N253 F254 D258 E378	N253-H256 PolarHBondContact ND2-ND1 2.98Å; N253-H256 PolarHBondContact O-N 3.1Å; N253-H256 WeakPolarHBondContact OD1-CB 3.17Å; N253-H256 PolarHBondContact OD1-N 2.81Å; N253-H256 PolarHBondContact OD1-ND1 2.6Å; F254-H256 VanDerWaalsContact C-N 3.3Å; F254-H256 PolarHBondContact O-N 2.98Å; H256-D258 PolarHBondContact O-N 3.05Å; H256-D258 VanDerWaalsContact O-N 3.11Å; H256-E378 PolarHBondContact CE1-N 2.78Å
257	S	82.9	Confident	82.4	Confident	16 Å²	16	47.5 Å²	47.5	11%	0.112	24%	0.244	C	C	.	.			trans	-80.5	93.3	179.5	-176.9	0	0	0	0	112.6	D220 N253 F254 K259 L260 Q261	D220-S257 WeakPolarHBondContact OD2-CB 3.47Å; D220-S257 PolarHBondContact OD2-OG 3.25Å; N253-S257 PolarHBondContact O-N 2.93Å; N253-S257 VanDerWaalsContact O-N 3.14Å; F254-S257 PolarHBondContact O-N 3.4Å; S257-K259 PolarHBondContact O-N 2.04Å; S257-L260 PolarHBondContact O-N 3.14Å; S257-L260 WeakPolarHBondContact OG-CB 3.46Å; S257-L260 PolarHBondContact OG-N 2.89Å; S257-Q261 WeakPolarHBondContact O-CG 3.44Å; S257-Q261 PolarHBondContact O-N 2.88Å
258	D	83.7	Confident	83.3	Confident	63 Å²	63	41.6 Å²	41.6	34%	0.337	21%	0.213	S	C	.	.	H	α-helix	trans	-59.9	-27.5	170.7	-58.5	-45.3	0	0	0	111.8	H256 R262 R377	H256-D258 PolarHBondContact O-N 3.05Å; H256-D258 VanDerWaalsContact O-N 3.11Å; D258-R262 WeakPolarHBondContact O-CB 3.04Å; D258-R262 WeakPolarHBondContact O-CD 3.04Å; D258-R262 WeakPolarHBondContact O-CG 3.46Å; D258-R262 PolarHBondContact O-N 3.5Å; D258-R262 VanDerWaalsContact O-N 3.17Å; D258-R377 IonicContact OD1-CZ 3.74Å; D258-R377 IonicContact OD1-NH2 2.77Å; D258-R377 PolarHBondContact OD1-NH2 3.22Å; D258-R377 IonicContact OD2-CZ 3.5Å; D258-R377 IonicContact OD2-NH2 2.57Å; D258-R377 PolarHBondContact OD2-NH2 2.84Å
259	K	86.3	Confident	83.9	Confident	80 Å²	80	41 Å²	41	35%	0.348	21%	0.211	S	C	.	.	H	α-helix	trans	-64.7	-55.5	171.3	-85.3	-168	165	-158.5	0	111.1	D219 D220 D221 S257 Q261 R262 F263	D219-K259 IonicContact OD1-NZ 2.72Å; D219-K259 PolarHBondContact OD1-NZ 3.44Å; D219-K259 IonicContact OD2-NZ 3.12Å; D220-K259 HydrophobicContact CB-CB 3.62Å; D220-K259 HydrophobicContact CB-CD 4.27Å; D221-K259 WeakPolarHBondContact OD1-CD 3.34Å; D221-K259 WeakPolarHBondContact OD1-CE 3.32Å; D221-K259 IonicContact OD1-NZ 3.36Å; D221-K259 PolarHBondContact OD1-NZ 2.96Å; D221-K259 WeakPolarHBondContact OD2-CD 3.02Å; D221-K259 WeakPolarHBondContact OD2-CE 3.49Å; D221-K259 IonicContact OD2-NZ 3.58Å; D221-K259 PolarHBondContact OD2-NZ 2.88Å; S257-K259 PolarHBondContact O-N 2.04Å; K259-Q261 VanDerWaalsContact C-N 3.33Å; K259-Q261 PolarHBondContact O-N 3.19Å; K259-R262 CarbonylContact O-C 3.48Å; K259-R262 PolarHBondContact O-N 2.88Å; K259-F263 WeakPolarHBondContact O-CB 3.38Å; K259-F263 PolarHBondContact O-N 2.03Å
260	L	89	Confident	84.6	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-66.9	-34.9	-175.6	-169.7	56.7	0	0	0	112.3	D220 L245 R248 G250 F254 S257 R262 F263 T264	D220-L260 HydrophobicContact CB-CB 4.05Å; L245-L260 HydrophobicContact CD2-CD1 4.17Å; L245-L260 HydrophobicContact CD2-CD2 4.07Å; L245-L260 HydrophobicContact CD2-CG 4.14Å; R248-L260 HydrophobicContact CB-CD1 4.17Å; R248-L260 VanDerWaalsContact CD-CD1 3.43Å; R248-L260 HydrophobicContact CG-CD1 4.4Å; G250-L260 VanDerWaalsContact C-CD2 3.48Å; F254-L260 HydrophobicContact CD2-CD2 3.81Å; F254-L260 HydrophobicContact CD2-CG 3.86Å; F254-L260 HydrophobicContact CE2-CG 4.1Å; S257-L260 PolarHBondContact O-N 3.14Å; S257-L260 WeakPolarHBondContact OG-CB 3.46Å; S257-L260 PolarHBondContact OG-N 2.89Å; L260-R262 VanDerWaalsContact C-N 3.34Å; L260-F263 PolarHBondContact O-N 2.74Å; L260-T264 HydrophobicContact CD1-CG2 4.39Å; L260-T264 WeakPolarHBondContact O-CG2 3.16Å; L260-T264 PolarHBondContact O-N 3.08Å; L260-T264 PolarHBondContact O-OG1 3.46Å
261	Q	86.5	Confident	85.4	Confident	17 Å²	17	39.1 Å²	39.1	8%	0.079	19%	0.19	C	C	.	.	H	α-helix	trans	-63	-38.3	170.9	-73.5	-179.4	41	0	0	112.4	H163 F254 S255 S257 K259 T264 R265	H163-Q261 PolarHBondContact CE1-O 3.02Å; H163-Q261 VanDerWaalsContact CE1-O 3.25Å; F254-Q261 HydrophobicContact CD1-CG 4.13Å; F254-Q261 HydrophobicContact CE1-CG 3.69Å; F254-Q261 HydrophobicContact CE2-CG 4.49Å; F254-Q261 HydrophobicContact CZ-CG 3.9Å; F254-Q261 WeakPolarHBondContact O-CG 3.01Å; F254-Q261 PolarHBondContact O-NE2 2.55Å; S255-Q261 PolarHBondContact O-NE2 3.38Å; S257-Q261 WeakPolarHBondContact O-CG 3.44Å; S257-Q261 PolarHBondContact O-N 2.88Å; K259-Q261 VanDerWaalsContact C-N 3.33Å; K259-Q261 PolarHBondContact O-N 3.19Å; Q261-T264 PolarHBondContact O-OG1 2.9Å; Q261-R265 WeakPolarHBondContact O-CD 3.5Å; Q261-R265 VanDerWaalsContact O-CG 3.32Å; Q261-R265 WeakPolarHBondContact O-CG 3.13Å
262	R	89	Confident	86.2	Confident	178 Å²	178	37.2 Å²	37.2	67%	0.672	18%	0.183	S	C	*	.	H	α-helix	trans	-75.9	-31.1	174.1	-73.2	172.3	-172.9	160.8	4.8	112.9	R184 D258 K259 L260	R184-R262 PolarHBondContact NH1-O 3.28Å; R184-R262 PolarHBondContact NH2-O 3.1Å; D258-R262 WeakPolarHBondContact O-CB 3.04Å; D258-R262 WeakPolarHBondContact O-CD 3.04Å; D258-R262 WeakPolarHBondContact O-CG 3.46Å; D258-R262 PolarHBondContact O-N 3.5Å; D258-R262 VanDerWaalsContact O-N 3.17Å; K259-R262 CarbonylContact O-C 3.48Å; K259-R262 PolarHBondContact O-N 2.88Å; L260-R262 VanDerWaalsContact C-N 3.34Å
263	F	92.2	Very high	87.6	Confident	6 Å²	6	34.4 Å²	34.4	3%	0.026	15%	0.153	C	C	.	.	H	α-helix	trans	-67.8	-45.2	177.7	-175.1	-95.4	0	0	0	111.5	R184 W195 D221 V223 L244 R248 K259 L260 R265	R184-F263 VanDerWaalsContact CZ-O 3.24Å; R184-F263 PolarHBondContact NE-O 3.45Å; R184-F263 PolarHBondContact NH1-O 2.03Å; W195-F263 HydrophobicContact CB-CZ 4.47Å; W195-F263 AromaticContact CD1-CE1 3.58Å; W195-F263 AromaticContact CD1-CE2 3.94Å; W195-F263 AromaticContact CD1-CZ 3.48Å; W195-F263 VanDerWaalsContact CD1-CZ 3.48Å; W195-F263 HydrophobicContact CG-CE1 4.47Å; W195-F263 HydrophobicContact CG-CZ 4.31Å; W195-F263 PolarHBondContact NE1-O 2.84Å; D221-F263 HydrophobicContact CB-CD2 4.18Å; V223-F263 HydrophobicContact CG2-CE2 4.24Å; L244-F263 HydrophobicContact CB-CE1 4.49Å; L244-F263 HydrophobicContact CD2-CE1 4.34Å; R248-F263 VanDerWaalsContact CZ-CZ 3.4Å; K259-F263 WeakPolarHBondContact O-CB 3.38Å; K259-F263 PolarHBondContact O-N 2.03Å; L260-F263 PolarHBondContact O-N 2.74Å; F263-R265 VanDerWaalsContact C-N 3.3Å; F263-R265 PolarHBondContact O-N 3.26Å
264	T	91.9	Very high	88.7	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.006	14%	0.144	C	C	.	.	S	Bend	trans	-74.6	-9.8	-177.8	50	0	0	0	0	115.3	H163 V164 L245 F254 L260 Q261	H163-T264 PolarHBondContact ND1-OG1 2.7Å; V164-T264 PolarHBondContact N-O 2.71Å; V164-T264 WeakPolarHBondContact O-CB 3.4Å; V164-T264 WeakPolarHBondContact O-CG2 3.32Å; L245-T264 HydrophobicContact CD2-CG2 3.77Å; F254-T264 HydrophobicContact CE2-CG2 4.15Å; L260-T264 HydrophobicContact CD1-CG2 4.39Å; L260-T264 WeakPolarHBondContact O-CG2 3.16Å; L260-T264 PolarHBondContact O-N 3.08Å; L260-T264 PolarHBondContact O-OG1 3.46Å; Q261-T264 PolarHBondContact O-OG1 2.9Å
265	R	93.2	Very high	89.4	Confident	35 Å²	35	33.3 Å²	33.3	13%	0.132	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	135.9	179	-82.9	167.2	-172	-121.2	2.2	112.6	E161 F162 R184 T186 Q261 F263 V329 H331	E161-R265 HydrophobicContact CG-CB 4Å; E161-R265 HydrophobicContact CG-CG 4.02Å; E161-R265 WeakPolarHBondContact OE1-CB 3.17Å; E161-R265 WeakPolarHBondContact OE1-CD 3.43Å; E161-R265 IonicContact OE1-NH1 2.63Å; E161-R265 WeakPolarHBondContact OE2-CD 3.33Å; E161-R265 IonicContact OE2-CZ 3.48Å; E161-R265 IonicContact OE2-NE 3.51Å; E161-R265 IonicContact OE2-NH1 2.67Å; E161-R265 PolarHBondContact OE2-NH1 3.44Å; F162-R265 WeakPolarHBondContact O-CA 3.15Å; R184-R265 WeakPolarHBondContact CD-O 3.09Å; R184-R265 PolarHBondContact NH1-O 3.09Å; T186-R265 HydrophobicContact CG2-CB 3.9Å; T186-R265 VanDerWaalsContact CG2-O 3.29Å; T186-R265 WeakPolarHBondContact CG2-O 3.49Å; Q261-R265 WeakPolarHBondContact O-CD 3.5Å; Q261-R265 VanDerWaalsContact O-CG 3.32Å; Q261-R265 WeakPolarHBondContact O-CG 3.13Å; F263-R265 VanDerWaalsContact C-N 3.3Å; F263-R265 PolarHBondContact O-N 3.26Å; R265-V329 HydrophobicContact CG-CG2 4.25Å; R265-V329 VanDerWaalsContact CZ-CG1 3.48Å; R265-H331 PolarHBondContact NH2-CE1 3.49Å; R265-H331 PolarHBondContact NH2-NE2 2.76Å
266	A	94.4	Very high	90	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	143.2	166.6	0	0	0	0	0	112.6	L158 E161 F162 V164 R184 S185 W195 V269	L158-A266 HydrophobicContact CD1-CB 4.37Å; E161-A266 WeakPolarHBondContact CA-O 3.25Å; F162-A266 PolarHBondContact N-O 3.25Å; F162-A266 PolarHBondContact O-N 3.15Å; V164-A266 HydrophobicContact CG2-CB 4.2Å; R184-A266 HydrophobicContact CB-CB 4.12Å; S185-A266 CarbonylContact O-C 3.47Å; S185-A266 VanDerWaalsContact O-CA 3.29Å; S185-A266 WeakPolarHBondContact O-CA 3.37Å; W195-A266 HydrophobicContact CH2-CB 3.62Å; W195-A266 HydrophobicContact CZ2-CB 3.85Å; A266-V269 HydrophobicContact CB-CG2 4.04Å
267	T	93.9	Very high	90.2	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.006	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	-28.9	161.9	59.8	0	0	0	0	111.7	L158 E161 S185 H188	L158-T267 VanDerWaalsContact CB-O 3.26Å; L158-T267 WeakPolarHBondContact CB-O 3.22Å; L158-T267 PolarHBondContact N-O 3.43Å; E161-T267 HydrophobicContact CB-CG2 3.83Å; E161-T267 HydrophobicContact CG-CG2 4.3Å; S185-T267 PolarHBondContact O-N 3.07Å; S185-T267 PolarHBondContact O-OG1 2.69Å; H188-T267 WeakPolarHBondContact CA-OG1 3.02Å; H188-T267 PolarHBondContact N-OG1 3.07Å; H188-T267 VanDerWaalsContact N-OG1 3.11Å
268	N	94.6	Very high	89.4	Confident	8 Å²	8	30.9 Å²	30.9	4%	0.043	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	146.3	178.1	-49.6	79.8	0	0	0	109	I156 D157 R184 S185 H188 G189 Y192	I156-N268 VanDerWaalsContact O-CA 3.23Å; I156-N268 WeakPolarHBondContact O-CA 3.33Å; I156-N268 WeakPolarHBondContact O-CB 3.45Å; D157-N268 WeakPolarHBondContact CA-ND2 3.37Å; D157-N268 VanDerWaalsContact CG-ND2 3.34Å; D157-N268 PolarHBondContact OD1-ND2 2.9Å; R184-N268 CarbonylContact C-O 3.55Å; R184-N268 WeakPolarHBondContact CA-O 3.22Å; S185-N268 PolarHBondContact N-O 2.91Å; S185-N268 PolarHBondContact O-N 2.66Å; H188-N268 VanDerWaalsContact C-OD1 3.32Å; H188-N268 VanDerWaalsContact CA-OD1 3.26Å; H188-N268 WeakPolarHBondContact CA-OD1 3.47Å; G189-N268 PolarHBondContact N-OD1 3.35Å; G189-N268 VanDerWaalsContact N-OD1 3.08Å; Y192-N268 HydrophobicContact CE1-CB 4.27Å
269	V	95.2	Very high	88.2	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.006	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	134.6	176.9	-178	0	0	0	0	108.4	T155 I156 L158 L182 W195 A266 M324	T155-V269 WeakPolarHBondContact CA-O 3.47Å; I156-V269 PolarHBondContact N-O 2.73Å; I156-V269 PolarHBondContact O-N 2.9Å; L158-V269 HydrophobicContact CD1-CG2 4.3Å; L182-V269 HydrophobicContact CD1-CG1 3.81Å; W195-V269 HydrophobicContact CE3-CG1 4.4Å; W195-V269 HydrophobicContact CH2-CG2 3.8Å; W195-V269 HydrophobicContact CZ3-CB 4.36Å; W195-V269 HydrophobicContact CZ3-CG1 3.79Å; W195-V269 HydrophobicContact CZ3-CG2 3.63Å; A266-V269 HydrophobicContact CB-CG2 4.04Å; V269-M324 HydrophobicContact CB-CE 3.75Å; V269-M324 HydrophobicContact CB-SD 3.92Å; V269-M324 HydrophobicContact CG1-CE 3.51Å; V269-M324 HydrophobicContact CG1-SD 4.14Å; V269-M324 HydrophobicContact CG2-CE 4.28Å; V269-M324 HydrophobicContact CG2-SD 3.82Å
270	R	96.1	Very high	86.6	Confident	53 Å²	53	33.8 Å²	33.8	20%	0.2	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	125.1	-177.3	-172.8	171.1	74.8	-171.9	4.8	110.9	I154 T155 E183 Y192	I154-R270 CarbonylContact O-C 3.06Å; I154-R270 VanDerWaalsContact O-CA 3.25Å; I154-R270 WeakPolarHBondContact O-CA 3.29Å; T155-R270 HydrophobicContact CG2-CB 4.45Å; T155-R270 WeakPolarHBondContact OG1-CD 3.36Å; T155-R270 WeakPolarHBondContact OG1-CG 3.36Å; E183-R270 HydrophobicContact CB-CB 4.36Å; E183-R270 PolarHBondContact N-O 2.03Å; E183-R270 PolarHBondContact O-N 2.68Å; E183-R270 IonicContact OE1-NH2 3.59Å; E183-R270 IonicContact OE2-CZ 3.39Å; E183-R270 IonicContact OE2-NE 2.72Å; E183-R270 PolarHBondContact OE2-NE 3.32Å; E183-R270 IonicContact OE2-NH2 2.68Å; E183-R270 PolarHBondContact OE2-NH2 3.42Å; Y192-R270 HydrophobicContact CD1-CB 3.74Å; Y192-R270 HydrophobicContact CE1-CB 3.59Å
271	I	96.1	Very high	84.6	Confident	2 Å²	2	34.5 Å²	34.5	1%	0.01	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	116	174.1	-56.3	162	0	0	0	106.3	N153 I154 L169 W180 L182 L273 I322	N153-I271 WeakPolarHBondContact CA-O 3.41Å; I154-I271 HydrophobicContact CB-CB 4.29Å; I154-I271 PolarHBondContact N-O 3.15Å; I154-I271 PolarHBondContact O-N 2.8Å; L169-I271 HydrophobicContact CD1-CD1 4.21Å; L169-I271 HydrophobicContact CD2-CD1 3.55Å; W180-I271 HydrophobicContact CE3-CG2 3.86Å; W180-I271 HydrophobicContact CZ3-CG2 4.06Å; L182-I271 HydrophobicContact CD1-CG1 4.03Å; I271-L273 HydrophobicContact CG2-CD2 3.7Å; I271-L273 HydrophobicContact CG2-CG 4.27Å; I271-I322 HydrophobicContact CD1-CD1 3.89Å
272	R	95.2	Very high	82.4	Confident	77 Å²	77	36.9 Å²	36.9	29%	0.291	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	90.8	-175.1	-139.3	-178.2	81.3	-158.1	11.5	109	N153 W180 V181 E183	N153-R272 WeakPolarHBondContact OD1-CG 3.46Å; W180-R272 CarbonylContact C-O 3.54Å; W180-R272 WeakPolarHBondContact CA-O 3.41Å; W180-R272 VanDerWaalsContact CB-O 3.32Å; W180-R272 WeakPolarHBondContact CB-O 3.48Å; V181-R272 HydrophobicContact CB-CB 4.04Å; V181-R272 HydrophobicContact CG2-CB 4.47Å; V181-R272 PolarHBondContact N-O 3.15Å; V181-R272 PolarHBondContact O-N 3.49Å; E183-R272 WeakPolarHBondContact OE1-CD 3.45Å; E183-R272 IonicContact OE1-CZ 2.71Å; E183-R272 IonicContact OE1-NE 2.65Å; E183-R272 IonicContact OE1-NH1 3.58Å; E183-R272 PolarHBondContact OE1-NH1 3.29Å; E183-R272 WeakPolarHBondContact OE2-CD 3.28Å
273	L	94.6	Very high	80	Confident	2 Å²	2	33.2 Å²	33.2	1%	0.01	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	126.4	177.3	-51.8	180	0	0	0	108.2	W138 Q151 V152 I154 P177 W180 I271 Y317	W138-L273 HydrophobicContact CH2-CD1 4.4Å; W138-L273 HydrophobicContact CZ3-CD1 4.44Å; Q151-L273 CarbonylContact C-O 3.46Å; Q151-L273 VanDerWaalsContact CA-O 3.28Å; Q151-L273 WeakPolarHBondContact CA-O 3.4Å; V152-L273 HydrophobicContact CB-CB 4.37Å; V152-L273 HydrophobicContact CB-CD1 4.46Å; V152-L273 PolarHBondContact N-O 3.29Å; V152-L273 WeakPolarHBondContact O-CB 3.46Å; V152-L273 PolarHBondContact O-N 3.21Å; I154-L273 HydrophobicContact CD1-CD1 4Å; P177-L273 HydrophobicContact CB-CD2 4.18Å; P177-L273 HydrophobicContact CG-CD2 3.68Å; W180-L273 HydrophobicContact CB-CD2 3.98Å; W180-L273 HydrophobicContact CG-CD2 4.4Å; I271-L273 HydrophobicContact CG2-CD2 3.7Å; I271-L273 HydrophobicContact CG2-CG 4.27Å; L273-Y317 HydrophobicContact CB-CD2 4.18Å; L273-Y317 HydrophobicContact CB-CE1 4.14Å; L273-Y317 HydrophobicContact CB-CE2 3.7Å; L273-Y317 HydrophobicContact CD1-CD1 3.89Å; L273-Y317 HydrophobicContact CD1-CD2 3.72Å; L273-Y317 HydrophobicContact CD1-CE1 4.28Å; L273-Y317 HydrophobicContact CD1-CE2 4.13Å; L273-Y317 HydrophobicContact CD1-CG 3.55Å
274	L	92.1	Very high	77.5	Confident	25 Å²	25	39.6 Å²	39.6	13%	0.131	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	-33.1	-172	-66.6	175.5	0	0	0	114.3	N150 Q151 L179 V181 F209	N150-L274 CarbonylContact O-C 3.51Å; Q151-L274 HydrophobicContact CG-CD2 4.43Å; L179-L274 HydrophobicContact CB-CB 4.36Å; L179-L274 HydrophobicContact CD2-CB 3.99Å; L179-L274 HydrophobicContact CD2-CD1 4.23Å; L179-L274 HydrophobicContact CG-CB 4.13Å; L179-L274 HydrophobicContact CG-CD1 4.33Å; L179-L274 WeakPolarHBondContact O-CA 3.46Å; L179-L274 WeakPolarHBondContact O-CB 3.38Å; L179-L274 PolarHBondContact O-N 2.71Å; V181-L274 HydrophobicContact CG2-CD1 3.93Å; F209-L274 HydrophobicContact CE1-CD1 4.35Å; F209-L274 HydrophobicContact CZ-CD1 4.45Å
275	R	88.2	Confident	74.9	Confident	46 Å²	46	44.9 Å²	44.9	17%	0.174	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	128.3	176.5	-155.2	178	67.1	-140.8	-5.1	112.7	G178 L179 E200 Q204 Y317	G178-R275 PolarHBondContact N-O 3.31Å; L179-R275 HydrophobicContact CB-CB 3.73Å; L179-R275 PolarHBondContact N-O 2.82Å; L179-R275 PolarHBondContact O-N 3.48Å; E200-R275 VanDerWaalsContact CD-NH2 3.34Å; E200-R275 IonicContact OE1-CZ 2.63Å; E200-R275 IonicContact OE1-NE 2.71Å; E200-R275 IonicContact OE1-NH2 2.6Å; E200-R275 PolarHBondContact OE1-NH2 2.79Å; Q204-R275 VanDerWaalsContact CD-NH2 3.31Å; R275-Y317 WeakPolarHBondContact CA-OH 3.39Å; R275-Y317 PolarHBondContact N-OH 3.23Å; R275-Y317 VanDerWaalsContact N-OH 3.15Å; R275-Y317 PolarHBondContact O-OH 3.11Å
276	T	83.8	Confident	72.1	Confident	5 Å²	5	50 Å²	50	3%	0.031	25%	0.246	C	C	.	.			trans	-70.5	146.9	168.1	52.7	0	0	0	0	110.6	N150 T278 Y317	N150-T276 WeakPolarHBondContact OD1-CB 3.48Å; N150-T276 WeakPolarHBondContact OD1-CG2 3.41Å; N150-T276 PolarHBondContact OD1-N 3.01Å; N150-T276 PolarHBondContact OD1-OG1 2.96Å; T276-T278 PolarHBondContact O-N 3.06Å; T276-Y317 HydrophobicContact CG2-CD1 4.12Å; T276-Y317 HydrophobicContact CG2-CD2 4.29Å; T276-Y317 HydrophobicContact CG2-CE1 3.63Å; T276-Y317 HydrophobicContact CG2-CE2 3.82Å; T276-Y317 HydrophobicContact CG2-CG 4.45Å; T276-Y317 VanDerWaalsContact CG2-CZ 3.49Å; T276-Y317 PolarHBondContact N-OH 3.11Å; T276-Y317 VanDerWaalsContact N-OH 3.11Å
277	K	74.4	Confident	69.2	Low	33 Å²	33	55 Å²	55	14%	0.143	27%	0.273	C	S	.	.			trans	-90.9	90.4	-179.7	-169.3	155.2	-179.9	134.7	0	110.9	E200 S230 I232	E200-K277 HydrophobicContact CG-CD 4.21Å; E200-K277 VanDerWaalsContact OE2-CD 3.28Å; E200-K277 WeakPolarHBondContact OE2-CD 3.34Å; E200-K277 WeakPolarHBondContact OE2-CE 3.35Å; E200-K277 IonicContact OE2-NZ 3.95Å; E200-K277 PolarHBondContact OE2-NZ 3.32Å; S230-K277 VanDerWaalsContact O-CD 3.27Å; S230-K277 WeakPolarHBondContact O-CD 3.01Å; S230-K277 WeakPolarHBondContact O-CE 3.45Å; S230-K277 PolarHBondContact O-NZ 3.48Å; I232-K277 HydrophobicContact CB-CD 3.74Å; I232-K277 HydrophobicContact CB-CG 3.95Å; I232-K277 HydrophobicContact CD1-CG 4.14Å; I232-K277 WeakPolarHBondContact CD1-O 3.31Å; I232-K277 HydrophobicContact CG1-CB 4.32Å; I232-K277 HydrophobicContact CG1-CD 4.28Å; I232-K277 HydrophobicContact CG1-CG 3.97Å
278	T	66.2	Low	66.5	Low	15 Å²	15	62.3 Å²	62.3	9%	0.092	31%	0.312	C	S	.	.			trans	-73.8	149	176	86.1	0	0	0	0	111.1	T276 Q280 G281 H282 Y315	T276-T278 PolarHBondContact O-N 3.06Å; T278-Q280 PolarHBondContact O-N 2.94Å; T278-G281 WeakPolarHBondContact OG1-CA 3.14Å; T278-G281 PolarHBondContact OG1-N 2.86Å; T278-H282 PolarHBondContact O-CE1 3.26Å; T278-H282 PolarHBondContact OG1-CD2 3.37Å; T278-H282 PolarHBondContact OG1-CE1 3.39Å; T278-H282 VanDerWaalsContact OG1-CE1 3.23Å; T278-H282 PolarHBondContact OG1-N 2.91Å; T278-H282 PolarHBondContact OG1-ND1 2.86Å; T278-H282 PolarHBondContact OG1-NE2 3.39Å; T278-Y315 HydrophobicContact CG2-CD1 4.13Å; T278-Y315 HydrophobicContact CG2-CD2 3.8Å; T278-Y315 HydrophobicContact CG2-CE1 4.17Å; T278-Y315 HydrophobicContact CG2-CE2 3.81Å; T278-Y315 HydrophobicContact CG2-CG 3.98Å
279	L	59.8	Low	63.7	Low	100 Å²	100	71 Å²	71	52%	0.524	35%	0.35	S	S	.	.	S	Bend	trans	-75.2	72.8	174.5	-77.2	163.4	0	0	0	110.5	L59 I232 G281	L59-L279 HydrophobicContact CD1-CD1 4Å; L59-L279 HydrophobicContact CD2-CD1 4.14Å; I232-L279 HydrophobicContact CD1-CD2 3.6Å; I232-L279 HydrophobicContact CD1-CG 3.73Å; L279-G281 PolarHBondContact O-N 3.06Å
280	Q	53.2	Low	60.7	Low	105 Å²	105	80.8 Å²	80.8	49%	0.491	39%	0.392	S	S	.	.	S	Bend	trans	57.8	5.1	-171.4	-58.7	-179.6	7.5	0	0	114.6	T278 H282 L283 D1361	T278-Q280 PolarHBondContact O-N 2.94Å; Q280-H282 VanDerWaalsContact C-N 3.26Å; Q280-H282 PolarHBondContact O-N 2.04Å; Q280-L283 HydrophobicContact CB-CD1 3.85Å; Q280-L283 HydrophobicContact CG-CD1 4.31Å; Q280-L283 WeakPolarHBondContact O-CB 2.99Å; Q280-L283 PolarHBondContact O-N 3.29Å; Q280-D1361 PolarHBondContact NE2-OD1 2.85Å; Q280-D1361 PolarHBondContact NE2-OD2 3.1Å
281	G	45.8	Very low	57.6	Low	15 Å²	15	82.7 Å²	82.7	16%	0.155	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-58.7	-31.2	-179.1	0	0	0	0	0	114.4	T278 L279 L283 M284	T278-G281 WeakPolarHBondContact OG1-CA 3.14Å; T278-G281 PolarHBondContact OG1-N 2.86Å; L279-G281 PolarHBondContact O-N 3.06Å; G281-L283 PolarHBondContact O-N 3.06Å; G281-M284 VanDerWaalsContact O-CB 3.25Å; G281-M284 WeakPolarHBondContact O-CB 3.47Å; G281-M284 WeakPolarHBondContact O-CG 3.31Å; G281-M284 PolarHBondContact O-N 3.04Å
282	H	40.5	Very low	54.6	Low	67 Å²	67	88.2 Å²	88.2	31%	0.31	44%	0.443	S	S	.	.	G	3₁₀ helix	trans	-61.3	-17	171.8	33.5	-137.6	0	0	0	114.7	T278 Q280 M284 D285	T278-H282 PolarHBondContact O-CE1 3.26Å; T278-H282 PolarHBondContact OG1-CD2 3.37Å; T278-H282 PolarHBondContact OG1-CE1 3.39Å; T278-H282 VanDerWaalsContact OG1-CE1 3.23Å; T278-H282 PolarHBondContact OG1-N 2.91Å; T278-H282 PolarHBondContact OG1-ND1 2.86Å; T278-H282 PolarHBondContact OG1-NE2 3.39Å; Q280-H282 VanDerWaalsContact C-N 3.26Å; Q280-H282 PolarHBondContact O-N 2.04Å; H282-M284 PolarHBondContact O-N 3.01Å; H282-D285 PolarHBondContact O-N 3.42Å
283	L	39.4	Very low	51.5	Low	101 Å²	101	89.6 Å²	89.6	53%	0.529	46%	0.46	S	S	.	.	G	3₁₀ helix	trans	-73.8	-11	169.3	-76.5	124	0	0	0	113.4	Q280 G281 N287	Q280-L283 HydrophobicContact CB-CD1 3.85Å; Q280-L283 HydrophobicContact CG-CD1 4.31Å; Q280-L283 WeakPolarHBondContact O-CB 2.99Å; Q280-L283 PolarHBondContact O-N 3.29Å; G281-L283 PolarHBondContact O-N 3.06Å; L283-N287 PolarHBondContact O-ND2 2.99Å
284	M	37.8	Very low	48.7	Very low	139 Å²	139	96.6 Å²	96.6	69%	0.685	50%	0.495	S	S	*	.	G	3₁₀ helix	trans	-77.7	-24.3	173.7	-55.4	-173.5	-168.7	0	0	112.4	G281 H282	G281-M284 VanDerWaalsContact O-CB 3.25Å; G281-M284 WeakPolarHBondContact O-CB 3.47Å; G281-M284 WeakPolarHBondContact O-CG 3.31Å; G281-M284 PolarHBondContact O-N 3.04Å; H282-M284 PolarHBondContact O-N 3.01Å
285	D	38.5	Very low	45.6	Very low	112 Å²	112	101 Å²	101	60%	0.599	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-24.2	-173	-138.8	22.2	0	0	0	112.8	H282 N287	H282-D285 PolarHBondContact O-N 3.42Å; D285-N287 VanDerWaalsContact C-N 3.34Å; D285-N287 PolarHBondContact O-N 2.87Å
286	L	34.3	Very low	42.8	Very low	142 Å²	142	110.7 Å²	110.7	74%	0.743	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	-11.2	-178.7	-76.3	165	0	0	0	114.6
287	N	32.8	Very low	40.1	Very low	105 Å²	105	122.2 Å²	122.2	56%	0.561	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	-4.9	-176.1	-86.8	-59.4	0	0	0	114.9	L283 D285 K289	L283-N287 PolarHBondContact O-ND2 2.99Å; D285-N287 VanDerWaalsContact C-N 3.34Å; D285-N287 PolarHBondContact O-N 2.87Å; N287-K289 PolarHBondContact O-N 3.05Å
288	D	39	Very low	37.9	Very low	156 Å²	156	127.4 Å²	127.4	83%	0.834	64%	0.637	S	S	*	*	S	Bend	trans	-70.2	4.3	-176	-123.8	25.8	0	0	0	114.1
289	K	34.7	Very low	35.9	Very low	189 Å²	189	137.5 Å²	137.5	82%	0.822	67%	0.674	S	S	*	*	S	Bend	trans	-136.8	79.8	174.8	-67.2	176.9	-174.1	160.9	0	113.2	N287	N287-K289 PolarHBondContact O-N 3.05Å
290	K	31.4	Very low	34.4	Very low	207 Å²	207	141.9 Å²	141.9	90%	0.9	69%	0.689	S	S	*	*	S	Bend	trans	99	58.1	155.2	-48.7	168.1	-178.2	171.3	0	120.1
291	D	32.3	Very low	33.2	Very low	93 Å²	93	145.7 Å²	145.7	50%	0.497	71%	0.706	S	S	.	*			trans	-149.7	121	133.9	-163.4	-59.9	0	0	0	111.8	T293	D291-T293 WeakPolarHBondContact OD1-CA 3.42Å; D291-T293 WeakPolarHBondContact OD1-CB 3.13Å; D291-T293 PolarHBondContact OD1-N 2.65Å; D291-T293 PolarHBondContact OD1-OG1 2.87Å
292	P	33.4	Very low	32.5	Very low	119 Å²	119	150.9 Å²	150.9	77%	0.773	74%	0.74	S	S	*	*			trans	-87.5	6.9	-176.7	36.2	-36.5	0	0	0	115.1
293	T	30.3	Very low	32.1	Very low	106 Å²	106	154.7 Å²	154.7	65%	0.65	76%	0.756	S	S	*	*			trans	-100.8	-18.4	-160.3	-33	0	0	0	0	114.9	D291 T295	D291-T293 WeakPolarHBondContact OD1-CA 3.42Å; D291-T293 WeakPolarHBondContact OD1-CB 3.13Å; D291-T293 PolarHBondContact OD1-N 2.65Å; D291-T293 PolarHBondContact OD1-OG1 2.87Å; T293-T295 VanDerWaalsContact C-N 3.31Å; T293-T295 PolarHBondContact O-N 3.37Å
294	I	35.1	Very low	31.7	Very low	148 Å²	148	155.2 Å²	155.2	76%	0.759	76%	0.758	S	S	*	*			trans	-86.6	58	-171.3	-44.6	-176.8	0	0	0	112.4
295	T	27.6	Very low	31.4	Very low	119 Å²	119	156.7 Å²	156.7	73%	0.73	77%	0.768	S	S	*	*			trans	-138.4	77.5	-180	52	0	0	0	0	113.8	T293	T293-T295 VanDerWaalsContact C-N 3.31Å; T293-T295 PolarHBondContact O-N 3.37Å
296	R	28.6	Very low	31.1	Very low	249 Å²	249	154 Å²	154	94%	0.94	76%	0.761	S	S	*	*			trans	-143.1	7.8	178.3	-119.6	176.6	-167.6	-158.5	3.3	121.5
297	R	27.4	Very low	31.2	Very low	247 Å²	247	149.7 Å²	149.7	93%	0.932	74%	0.741	S	S	*	*	S	Bend	trans	-147.2	127.6	151.9	-73.3	-177.6	177.9	173	-1.8	104.6
298	V	27.5	Very low	31.4	Very low	142 Å²	142	149.9 Å²	149.9	86%	0.861	74%	0.742	S	S	*	*			cis	-124.9	151.3	23.2	-179.2	0	0	0	0	111.2
299	R	24.4	Very low	31.6	Very low	227 Å²	227	147.4 Å²	147.4	86%	0.857	73%	0.728	S	S	*	*			trans	-86.3	127	169.5	-64.8	176.5	179	167.7	-0.7	110.3
300	F	29.4	Very low	32.1	Very low	192 Å²	192	143.2 Å²	143.2	84%	0.842	71%	0.71	S	S	*	*			trans	-167.7	100.6	130.9	-100.3	-62.8	0	0	0	110.8	S302	F300-S302 PolarHBondContact O-N 2.89Å
301	H	27.8	Very low	33	Very low	185 Å²	185	139 Å²	139	86%	0.856	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	75.2	-169.4	-172.1	-75.3	0	0	0	112.4
302	S	30.4	Very low	34.2	Very low	123 Å²	123	136.1 Å²	136.1	86%	0.86	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-162.6	-10.6	163.2	-118.8	0	0	0	0	114.6	F300	F300-S302 PolarHBondContact O-N 2.89Å
303	F	31.6	Very low	35.7	Very low	148 Å²	148	131.5 Å²	131.5	65%	0.649	65%	0.645	S	S	*	*			trans	-101.9	-11.5	-168.6	-151.1	-118.2	0	0	0	114.5	L305 A306 V307	F303-L305 VanDerWaalsContact C-N 3.35Å; F303-L305 PolarHBondContact O-N 3.46Å; F303-A306 WeakPolarHBondContact O-CB 3.35Å; F303-A306 PolarHBondContact O-N 3.36Å; F303-V307 HydrophobicContact CD1-CG2 3.48Å; F303-V307 VanDerWaalsContact CD1-CG2 3.48Å; F303-V307 HydrophobicContact CE1-CG2 4.03Å; F303-V307 HydrophobicContact CG-CG2 4.42Å; F303-V307 PolarHBondContact O-N 3.14Å
304	I	32.3	Very low	37.7	Very low	112 Å²	112	126.9 Å²	126.9	57%	0.574	62%	0.616	S	S	*	*	H	α-helix	trans	-65.1	-32.2	-166.1	-68.7	176	0	0	0	113.5	A306 V307 N308	I304-A306 PolarHBondContact O-N 2.05Å; I304-A306 VanDerWaalsContact O-N 3.12Å; I304-V307 PolarHBondContact O-N 2.7Å; I304-N308 PolarHBondContact O-N 2.82Å
305	L	31.2	Very low	39.9	Very low	169 Å²	169	120.8 Å²	120.8	89%	0.885	58%	0.584	S	S	*	*	H	α-helix	trans	-64.9	-11.7	173.1	-70.9	173.4	0	0	0	114.2	F303	F303-L305 VanDerWaalsContact C-N 3.35Å; F303-L305 PolarHBondContact O-N 3.46Å
306	A	32.7	Very low	42.8	Very low	55 Å²	55	115.6 Å²	115.6	46%	0.455	55%	0.551	S	S	.	*	H	α-helix	trans	-105.3	-18.3	174.4	0	0	0	0	0	113.6	F303 I304	F303-A306 WeakPolarHBondContact O-CB 3.35Å; F303-A306 PolarHBondContact O-N 3.36Å; I304-A306 PolarHBondContact O-N 2.05Å; I304-A306 VanDerWaalsContact O-N 3.12Å
307	V	36.1	Very low	45.9	Very low	52 Å²	52	103.9 Å²	103.9	32%	0.315	51%	0.506	S	S	.	.	H	α-helix	trans	-81.7	-42.7	-177.1	177.7	0	0	0	0	111.8	F303 I304 N309 K310	F303-V307 HydrophobicContact CD1-CG2 3.48Å; F303-V307 VanDerWaalsContact CD1-CG2 3.48Å; F303-V307 HydrophobicContact CE1-CG2 4.03Å; F303-V307 HydrophobicContact CG-CG2 4.42Å; F303-V307 PolarHBondContact O-N 3.14Å; I304-V307 PolarHBondContact O-N 2.7Å; V307-N309 PolarHBondContact O-N 3.26Å; V307-K310 PolarHBondContact O-N 3.48Å
308	N	35.8	Very low	49	Very low	109 Å²	109	92.1 Å²	92.1	58%	0.583	46%	0.462	S	S	*	.	H	α-helix	trans	-59.8	-34.5	-178.4	-69.5	23.8	0	0	0	111.9	I304 K310	I304-N308 PolarHBondContact O-N 2.82Å; N308-K310 VanDerWaalsContact C-N 3.35Å; N308-K310 PolarHBondContact O-N 3.14Å
309	N	43.2	Very low	52.2	Low	104 Å²	104	85.4 Å²	85.4	56%	0.556	42%	0.421	S	S	*	.	H	α-helix	trans	-72.2	-24.4	176.7	-68	7.3	0	0	0	113.4	V307	V307-N309 PolarHBondContact O-N 3.26Å
310	K	45.2	Very low	55.3	Low	102 Å²	102	76.4 Å²	76.4	44%	0.443	39%	0.388	S	S	.	.	H	α-helix	trans	-77.6	-28.5	-170.8	-150.6	-164.1	-179.1	-136.1	0	113.2	V307 N308 L313 Q314	V307-K310 PolarHBondContact O-N 3.48Å; N308-K310 VanDerWaalsContact C-N 3.35Å; N308-K310 PolarHBondContact O-N 3.14Å; K310-L313 HydrophobicContact CG-CD1 4.19Å; K310-Q314 PolarHBondContact O-NE2 3.41Å
311	W	50.1	Low	58.2	Low	117 Å²	117	70 Å²	70	44%	0.443	36%	0.361	S	S	.	.	H	α-helix	trans	-72.9	-41.9	175	-62.9	106.9	0	0	0	111.6	L313 Q314	W311-L313 PolarHBondContact O-N 2.83Å; W311-L313 VanDerWaalsContact O-N 3.1Å; W311-Q314 WeakPolarHBondContact O-CB 3.45Å; W311-Q314 PolarHBondContact O-N 2.88Å
312	S	57.5	Low	61.3	Low	34 Å²	34	61.3 Å²	61.3	24%	0.238	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-68	-8.4	179.5	-43.6	0	0	0	0	114.9	L143 S144	L143-S312 PolarHBondContact N-O 2.86Å; S144-S312 PolarHBondContact N-O 3.13Å
313	L	66.8	Low	64.2	Low	22 Å²	22	58.5 Å²	58.5	12%	0.115	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-72.2	-15	168	-67.5	167.5	0	0	0	113.3	L55 C57 S144 K310 W311	L55-L313 HydrophobicContact CB-CD2 4.31Å; L55-L313 HydrophobicContact CD2-CD1 3.99Å; L55-L313 HydrophobicContact CD2-CD2 4.4Å; L55-L313 HydrophobicContact CG-CD2 4.46Å; L55-L313 WeakPolarHBondContact O-CD2 3.44Å; C57-L313 HydrophobicContact CB-CB 4.15Å; C57-L313 PolarHBondContact N-O 3.47Å; S144-L313 WeakPolarHBondContact OG-CD2 3.39Å; K310-L313 HydrophobicContact CG-CD1 4.19Å; W311-L313 PolarHBondContact O-N 2.83Å; W311-L313 VanDerWaalsContact O-N 3.1Å
314	Q	70.4	Confident	67	Low	8 Å²	8	51.5 Å²	51.5	4%	0.037	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-100.3	-0.2	-174.2	-65.8	153.6	77.1	0	0	114	C57 L59 Q111 K310 W311	C57-Q314 HydrophobicContact CB-CG 3.82Å; C57-Q314 VanDerWaalsContact O-CA 3.3Å; C57-Q314 WeakPolarHBondContact O-CA 3.45Å; C57-Q314 WeakPolarHBondContact O-CG 3.34Å; L59-Q314 VanDerWaalsContact CD2-OE1 3.28Å; L59-Q314 HydrophobicContact CG-CB 4.3Å; Q111-Q314 VanDerWaalsContact CD-NE2 3.32Å; Q111-Q314 VanDerWaalsContact CG-CD 3.5Å; Q111-Q314 HydrophobicContact CG-CG 4.13Å; Q111-Q314 VanDerWaalsContact CG-OE1 3.29Å; Q111-Q314 VanDerWaalsContact NE2-CD 3.28Å; K310-Q314 PolarHBondContact O-NE2 3.41Å; W311-Q314 WeakPolarHBondContact O-CB 3.45Å; W311-Q314 PolarHBondContact O-N 2.88Å
315	Y	81.7	Confident	69.6	Low	21 Å²	21	46.2 Å²	46.2	8%	0.082	24%	0.237	C	C	.	.			trans	-118.1	104.2	-177.9	-52.3	-43.3	0	0	0	108.6	P142 L143 T278	P142-Y315 WeakPolarHBondContact CA-O 3.08Å; L143-Y315 HydrophobicContact CD1-CD2 4.49Å; L143-Y315 WeakPolarHBondContact CG-O 3.46Å; L143-Y315 PolarHBondContact N-O 3.23Å; T278-Y315 HydrophobicContact CG2-CD1 4.13Å; T278-Y315 HydrophobicContact CG2-CD2 3.8Å; T278-Y315 HydrophobicContact CG2-CE1 4.17Å; T278-Y315 HydrophobicContact CG2-CE2 3.81Å; T278-Y315 HydrophobicContact CG2-CG 3.98Å
316	F	89.7	Confident	72.2	Confident	10 Å²	10	38.1 Å²	38.1	4%	0.044	20%	0.195	C	C	.	.			trans	-156	169.4	176.5	52.7	-92.4	0	0	0	107.6	Y56 Q139 P142 N173	Y56-F316 HydrophobicContact CD2-CE1 4.04Å; Y56-F316 AromaticContact CD2-CZ 3.82Å; Y56-F316 HydrophobicContact CD2-CZ 3.82Å; Q139-F316 HydrophobicContact CG-CD2 3.68Å; Q139-F316 HydrophobicContact CG-CE2 4.07Å; Q139-F316 HydrophobicContact CG-CG 4.43Å; P142-F316 HydrophobicContact CB-CD1 4.47Å; N173-F316 WeakPolarHBondContact OD1-CE2 3.11Å
317	Y	93	Very high	74.9	Confident	2 Å²	2	36.9 Å²	36.9	1%	0.008	18%	0.178	C	C	.	.			trans	-106	141.8	170.8	-55.9	-72.6	0	0	0	110	Q139 S140 N150 V152 P177 L273 R275 T276	Q139-Y317 CarbonylContact C-O 3.32Å; Q139-Y317 WeakPolarHBondContact CA-O 3.16Å; S140-Y317 PolarHBondContact N-O 3.47Å; S140-Y317 PolarHBondContact OG-N 2.95Å; N150-Y317 PolarHBondContact O-OH 3.26Å; N150-Y317 VanDerWaalsContact O-OH 3.06Å; V152-Y317 HydrophobicContact CB-CD2 4.39Å; V152-Y317 HydrophobicContact CG2-CD2 4Å; V152-Y317 HydrophobicContact CG2-CE2 4.15Å; P177-Y317 HydrophobicContact CB-CD1 4.37Å; P177-Y317 HydrophobicContact CB-CE1 3.78Å; P177-Y317 HydrophobicContact CG-CD1 4.2Å; P177-Y317 HydrophobicContact CG-CE1 4.1Å; L273-Y317 HydrophobicContact CB-CD2 4.18Å; L273-Y317 HydrophobicContact CB-CE1 4.14Å; L273-Y317 HydrophobicContact CB-CE2 3.7Å; L273-Y317 HydrophobicContact CD1-CD1 3.89Å; L273-Y317 HydrophobicContact CD1-CD2 3.72Å; L273-Y317 HydrophobicContact CD1-CE1 4.28Å; L273-Y317 HydrophobicContact CD1-CE2 4.13Å; L273-Y317 HydrophobicContact CD1-CG 3.55Å; R275-Y317 WeakPolarHBondContact CA-OH 3.39Å; R275-Y317 PolarHBondContact N-OH 3.23Å; R275-Y317 VanDerWaalsContact N-OH 3.15Å; R275-Y317 PolarHBondContact O-OH 3.11Å; T276-Y317 HydrophobicContact CG2-CD1 4.12Å; T276-Y317 HydrophobicContact CG2-CD2 4.29Å; T276-Y317 HydrophobicContact CG2-CE1 3.63Å; T276-Y317 HydrophobicContact CG2-CE2 3.82Å; T276-Y317 HydrophobicContact CG2-CG 4.45Å; T276-Y317 VanDerWaalsContact CG2-CZ 3.49Å; T276-Y317 PolarHBondContact N-OH 3.11Å; T276-Y317 VanDerWaalsContact N-OH 3.11Å
318	S	92.5	Very high	77.4	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	131.3	168.4	-175.6	0	0	0	0	111.5	Y137 W138 M171 A172 N173 S174	Y137-S318 WeakPolarHBondContact CD2-OG 3.48Å; W138-S318 WeakPolarHBondContact O-CA 3.12Å; W138-S318 WeakPolarHBondContact O-CB 3.49Å; W138-S318 PolarHBondContact O-OG 3.14Å; M171-S318 CarbonylContact C-O 3.22Å; M171-S318 VanDerWaalsContact CA-O 3.3Å; M171-S318 WeakPolarHBondContact CA-O 3.25Å; M171-S318 WeakPolarHBondContact CE-O 3.36Å; A172-S318 WeakPolarHBondContact CB-OG 3.45Å; A172-S318 PolarHBondContact N-O 3.48Å; N173-S318 WeakPolarHBondContact OD1-CB 3.29Å; N173-S318 PolarHBondContact OD1-OG 3.06Å; S174-S318 PolarHBondContact OG-N 2.79Å; S174-S318 PolarHBondContact OG-O 3.48Å
319	I	93.7	Very high	80	Confident	1 Å²	1	29.3 Å²	29.3	1%	0.005	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	129	-177.6	-63.4	173.1	0	0	0	107.7	M130 Y137 W138 I154 M171 I322	M130-I319 HydrophobicContact CG-CB 4.04Å; M130-I319 HydrophobicContact CG-CG2 3.94Å; M130-I319 HydrophobicContact SD-CB 3.78Å; M130-I319 HydrophobicContact SD-CD1 4.34Å; M130-I319 HydrophobicContact SD-CG2 3.94Å; Y137-I319 WeakPolarHBondContact CA-O 3.31Å; Y137-I319 WeakPolarHBondContact CB-O 3.42Å; W138-I319 HydrophobicContact CE3-CB 4.29Å; W138-I319 HydrophobicContact CE3-CG1 4.44Å; W138-I319 HydrophobicContact CZ3-CD1 4.35Å; W138-I319 HydrophobicContact CZ3-CG1 4.45Å; W138-I319 PolarHBondContact N-O 2.04Å; W138-I319 PolarHBondContact O-N 2.93Å; I154-I319 HydrophobicContact CD1-CD1 3.64Å; M171-I319 HydrophobicContact CE-CG1 4.04Å; M171-I319 HydrophobicContact SD-CD1 4.45Å; M171-I319 HydrophobicContact SD-CG1 3.84Å; I319-I322 HydrophobicContact CG2-CD1 4.21Å; I319-I322 HydrophobicContact CG2-CG1 3.79Å
320	K	89.9	Confident	82.2	Confident	38 Å²	38	24.6 Å²	24.6	17%	0.165	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	-38.4	176.9	173.2	179.5	158.2	-65.6	0	111.4	R136 Q170 A172	R136-K320 WeakPolarHBondContact O-CA 3.09Å; R136-K320 WeakPolarHBondContact O-CG 3.39Å; Q170-K320 PolarHBondContact O-N 2.84Å; Q170-K320 VanDerWaalsContact OE1-CD 3.31Å; Q170-K320 VanDerWaalsContact OE1-CE 3.31Å; A172-K320 HydrophobicContact CB-CB 4.01Å
321	E	90.9	Very high	84.2	Confident	58 Å²	58	21.2 Å²	21.2	27%	0.271	10%	0.097	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	138.7	-165.1	-166.5	162	-162.8	0	0	111.5	M130 Q170 E323	M130-E321 CarbonylContact O-C 3.39Å; Q170-E321 HydrophobicContact CB-CB 4.13Å; Q170-E321 PolarHBondContact N-O 2.82Å; Q170-E321 PolarHBondContact O-N 2.82Å; E321-E323 HydrophobicContact CG-CG 4.41Å
322	I	93	Very high	85.7	Confident	3 Å²	3	16 Å²	16	2%	0.015	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	115.4	174.7	-60	179.1	0	0	0	108	A33 I38 M130 V131 I154 I156 S168 L169 I271 I319 M324	A33-I322 HydrophobicContact CB-CG2 4.36Å; A33-I322 WeakPolarHBondContact CB-O 3.41Å; I38-I322 HydrophobicContact CD1-CD1 4.3Å; M130-I322 HydrophobicContact CB-CD1 3.92Å; M130-I322 HydrophobicContact CB-CG1 4.09Å; M130-I322 HydrophobicContact CG-CD1 4.35Å; M130-I322 PolarHBondContact O-N 3.3Å; M130-I322 HydrophobicContact SD-CD1 3.78Å; V131-I322 HydrophobicContact CG1-CB 4.49Å; I154-I322 HydrophobicContact CG2-CD1 4.47Å; I156-I322 HydrophobicContact CD1-CB 4.46Å; I156-I322 HydrophobicContact CD1-CD1 4.08Å; I156-I322 HydrophobicContact CD1-CG2 3.76Å; S168-I322 WeakPolarHBondContact O-CA 3.18Å; L169-I322 HydrophobicContact CD2-CB 4.25Å; L169-I322 HydrophobicContact CD2-CD1 4.26Å; L169-I322 HydrophobicContact CD2-CG1 3.78Å; L169-I322 HydrophobicContact CD2-CG2 3.84Å; I271-I322 HydrophobicContact CD1-CD1 3.89Å; I319-I322 HydrophobicContact CG2-CD1 4.21Å; I319-I322 HydrophobicContact CG2-CG1 3.79Å; I322-M324 HydrophobicContact CG2-CE 3.76Å; I322-M324 HydrophobicContact CG2-CG 4.37Å
323	E	90.1	Very high	87.2	Confident	64 Å²	64	14.3 Å²	14.3	30%	0.299	7%	0.067	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	141.4	172.1	-39.9	164.7	92.5	0	0	109.6	N31 V167 S168 E321	N31-E323 WeakPolarHBondContact OD1-CA 3.3Å; V167-E323 WeakPolarHBondContact CA-O 3.3Å; S168-E323 WeakPolarHBondContact CB-OE2 3.3Å; S168-E323 PolarHBondContact N-O 2.78Å; S168-E323 PolarHBondContact O-N 2.84Å; S168-E323 PolarHBondContact OG-OE2 2.9Å; E321-E323 HydrophobicContact CG-CG 4.41Å
324	M	90.5	Very high	88.1	Confident	0 Å²	0	13.3 Å²	13.3	0%	0	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	92.1	176.1	-67.9	-171.5	-179.5	0	0	109.9	N31 L32 A33 I156 V167 V269 I322 G326	N31-M324 PolarHBondContact OD1-N 3.25Å; L32-M324 HydrophobicContact CB-CB 4.1Å; L32-M324 WeakPolarHBondContact CB-O 3.27Å; L32-M324 WeakPolarHBondContact CG-O 3.22Å; L32-M324 PolarHBondContact N-O 3.39Å; A33-M324 HydrophobicContact CB-CB 4.15Å; A33-M324 HydrophobicContact CB-CG 4Å; A33-M324 HydrophobicContact CB-SD 4.41Å; I156-M324 HydrophobicContact CD1-CE 3.59Å; I156-M324 HydrophobicContact CD1-SD 4.48Å; V167-M324 HydrophobicContact CG1-CE 3.99Å; V167-M324 HydrophobicContact CG1-CG 4.22Å; V167-M324 HydrophobicContact CG2-CE 4.47Å; V167-M324 HydrophobicContact CG2-CG 4.16Å; V269-M324 HydrophobicContact CB-CE 3.75Å; V269-M324 HydrophobicContact CB-SD 3.92Å; V269-M324 HydrophobicContact CG1-CE 3.51Å; V269-M324 HydrophobicContact CG1-SD 4.14Å; V269-M324 HydrophobicContact CG2-CE 4.28Å; V269-M324 HydrophobicContact CG2-SD 3.82Å; I322-M324 HydrophobicContact CG2-CE 3.76Å; I322-M324 HydrophobicContact CG2-CG 4.37Å; M324-G326 PolarHBondContact O-N 3Å
325	G	86.6	Confident	88.6	Confident	1 Å²	1	18.9 Å²	18.9	1%	0.01	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	114.3	178.3	0	0	0	0	0	111.1	A165 Y166	A165-G325 PolarHBondContact N-O 2.97Å; Y166-G325 PolarHBondContact N-O 3.38Å; Y166-G325 PolarHBondContact O-N 3.04Å; Y166-G325 VanDerWaalsContact O-N 3.11Å
326	G	87.3	Confident	88.5	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	179.2	-179.2	0	0	0	0	0	113.7	Y29 F30 H163 M324	Y29-G326 WeakPolarHBondContact CA-O 3.34Å; F30-G326 PolarHBondContact N-O 3.32Å; F30-G326 PolarHBondContact O-N 2.88Å; H163-G326 CarbonylContact O-C 3.59Å; H163-G326 WeakPolarHBondContact O-CA 3.5Å; M324-G326 PolarHBondContact O-N 3Å
327	R	88.8	Confident	88.2	Confident	28 Å²	28	20.3 Å²	20.3	11%	0.106	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	157.6	-174.2	66.8	-179.6	-177.7	-179.3	6.5	111.8	N26 P27 P28 Y29 H163	N26-R327 VanDerWaalsContact CB-NH1 3.33Å; N26-R327 PolarHBondContact OD1-NH1 3.36Å; N26-R327 PolarHBondContact OD1-NH2 2.91Å; P27-R327 HydrophobicContact CB-CB 4.47Å; P27-R327 WeakPolarHBondContact O-CD 3.41Å; P28-R327 VanDerWaalsContact O-CB 3.32Å; P28-R327 WeakPolarHBondContact O-CB 3.46Å; Y29-R327 HydrophobicContact CD1-CB 4.09Å; Y29-R327 HydrophobicContact CD1-CG 4.26Å; Y29-R327 HydrophobicContact CE1-CB 4.23Å; Y29-R327 HydrophobicContact CE1-CG 3.87Å; H163-R327 HydrophobicContact CB-CG 4.19Å; H163-R327 PolarHBondContact N-O 3.08Å; H163-R327 PolarHBondContact O-N 3.1Å
328	C	88.8	Confident	87.5	Confident	2 Å²	2	22.9 Å²	22.9	1%	0.014	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	144.4	177.9	-59.9	0	0	0	0	112.4	P27 F162 C330 C337	P27-C328 HydrophobicContact CG-CB 4.12Å; F162-C328 HydrophobicContact CD1-CB 4.5Å; C328-C330 PolarHBondContact O-N 3.41Å; C328-C337 HydrophobicContact CB-CB 3.59Å; C328-C337 WeakPolarHBondContact CB-SG 3.49Å; C328-C337 WeakPolarHBondContact SG-CB 3.49Å; C328-C337 CovalentContact SG-SG 2.03Å; C328-C337 PolarHBondContact SG-SG 2.91Å
329	V	89.5	Confident	86.8	Confident	1 Å²	1	27.6 Å²	27.6	1%	0.006	14%	0.138	C	C	.	.			trans	-77.5	100.6	170.7	179.3	0	0	0	0	108.4	E161 R265 C350 Q360	E161-V329 HydrophobicContact CG-CG2 4.2Å; R265-V329 HydrophobicContact CG-CG2 4.25Å; R265-V329 VanDerWaalsContact CZ-CG1 3.48Å; V329-C350 PolarHBondContact O-SG 3.41Å; V329-C350 VanDerWaalsContact O-SG 3.34Å; V329-Q360 WeakPolarHBondContact O-CA 3.49Å; V329-Q360 WeakPolarHBondContact O-CB 3.28Å; V329-Q360 WeakPolarHBondContact O-CG 3.15Å
330	C	89.4	Confident	85.8	Confident	4 Å²	4	30.9 Å²	30.9	3%	0.027	16%	0.155	C	C	.	.			trans	-119.8	16	177.3	-53.6	0	0	0	0	113.7	P27 C328 G332 H333 A334 C350 Q360	P27-C330 HydrophobicContact CG-CB 4.27Å; P27-C330 WeakPolarHBondContact CG-SG 3.43Å; C328-C330 PolarHBondContact O-N 3.41Å; C330-G332 PolarHBondContact O-N 3.33Å; C330-H333 PolarHBondContact O-N 2.71Å; C330-A334 HydrophobicContact CB-CB 3.68Å; C330-C350 WeakPolarHBondContact CA-SG 3.25Å; C330-C350 HydrophobicContact CB-CB 3.74Å; C330-C350 WeakPolarHBondContact CB-SG 3.25Å; C330-C350 WeakPolarHBondContact SG-CB 3.16Å; C330-C350 CovalentContact SG-SG 2.03Å; C330-C350 PolarHBondContact SG-SG 3.25Å; C330-Q360 CarbonylContact C-O 3.02Å; C330-Q360 WeakPolarHBondContact CA-O 3Å
331	H	87.4	Confident	84.9	Confident	32 Å²	32	30.9 Å²	30.9	15%	0.148	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.5	18.5	176.1	-77	-82.9	0	0	0	117.1	R265 H333 W373 P375 V376	R265-H331 PolarHBondContact NH2-CE1 3.49Å; R265-H331 PolarHBondContact NH2-NE2 2.76Å; H331-H333 PolarHBondContact O-CD2 3.26Å; H331-W373 HydrophobicContact CB-CH2 4.24Å; H331-W373 HydrophobicContact CB-CZ2 3.77Å; H331-W373 AromaticContact CE1-CH2 3.77Å; H331-W373 AromaticContact CG-CH2 3.74Å; H331-W373 AromaticContact CG-CZ2 3.71Å; H331-W373 AromaticContact ND1-CH2 3.53Å; H331-W373 AromaticContact ND1-CZ2 3.97Å; H331-P375 HydrophobicContact CB-CB 4.08Å; H331-P375 WeakPolarHBondContact O-CA 3.44Å; H331-V376 PolarHBondContact O-N 3.44Å
332	G	82.2	Confident	84.1	Confident	6 Å²	6	33.6 Å²	33.6	6%	0.062	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.2	3.6	-177	0	0	0	0	0	115	L25 C330 V376	L25-G332 WeakPolarHBondContact CB-O 3.36Å; L25-G332 PolarHBondContact N-O 3.48Å; L25-G332 CarbonylContact O-C 3.45Å; L25-G332 WeakPolarHBondContact O-CA 3.48Å; L25-G332 VanDerWaalsContact O-O 3.12Å; C330-G332 PolarHBondContact O-N 3.33Å; G332-V376 VanDerWaalsContact C-CG2 3.41Å; G332-V376 WeakPolarHBondContact O-CG2 3.21Å
333	H	89.3	Confident	83.2	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	-108.5	14	-172.7	-56.6	-77.7	0	0	0	114.2	C330 H331 E353 H354 T356 C361 W373 R374 P375 V376 I381 F382	C330-H333 PolarHBondContact O-N 2.71Å; H331-H333 PolarHBondContact O-CD2 3.26Å; H333-E353 PolarHBondContact O-N 2.94Å; H333-H354 AromaticContact CG-ND1 3.76Å; H333-H354 WeakPolarHBondContact ND1-CB 3.27Å; H333-H354 AromaticContact ND1-CG 3.59Å; H333-H354 AromaticContact ND1-ND1 2.94Å; H333-H354 PolarHBondContact ND1-ND1 3.48Å; H333-T356 HydrophobicContact CB-CG2 4.21Å; H333-T356 WeakPolarHBondContact CB-OG1 3.22Å; H333-C361 HydrophobicContact CB-CB 3.87Å; H333-W373 AromaticContact NE2-CE2 3.74Å; H333-W373 AromaticContact NE2-CZ2 3.88Å; H333-W373 AromaticContact NE2-NE1 3.6Å; H333-R374 PolarHBondContact CE1-O 3.22Å; H333-R374 VanDerWaalsContact CE1-O 3.25Å; H333-R374 PolarHBondContact NE2-O 2.98Å; H333-P375 WeakPolarHBondContact NE2-CA 3.39Å; H333-V376 VanDerWaalsContact ND1-CG2 3.35Å; H333-V376 WeakPolarHBondContact ND1-CG2 3.31Å; H333-I381 PolarHBondContact CE1-O 3.12Å; H333-F382 VanDerWaalsContact CE1-C 3.44Å; H333-F382 PolarHBondContact CE1-O 2.79Å
334	A	85.7	Confident	82.5	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.219	C	C	.	.			trans	-149.1	135.6	175.1	0	0	0	0	0	112.8	L25 N26 P27 C330 C350 R351	L25-A334 CarbonylContact C-O 3.58Å; L25-A334 VanDerWaalsContact O-O 3.12Å; N26-A334 CarbonylContact C-O 3.56Å; N26-A334 PolarHBondContact N-O 3.38Å; P27-A334 WeakPolarHBondContact CD-O 3.45Å; C330-A334 HydrophobicContact CB-CB 3.68Å; A334-C350 HydrophobicContact CB-CB 3.86Å; A334-R351 WeakPolarHBondContact CA-O 3.24Å; A334-R351 WeakPolarHBondContact CB-O 3.45Å
335	Q	80.4	Confident	81.7	Confident	126 Å²	126	45.7 Å²	45.7	59%	0.589	24%	0.244	S	C	*	.	S	Bend	trans	-80.6	-24.6	177.2	-166.8	179	11.7	0	0	113.3	P27	P27-Q335 WeakPolarHBondContact CA-O 3.07Å
336	T	80.8	Confident	80.9	Confident	47 Å²	47	49.6 Å²	49.6	29%	0.288	27%	0.268	S	S	.	.			trans	-139.1	164.5	176.6	74.7	0	0	0	0	112.1	R351	T336-R351 PolarHBondContact O-N 2.87Å; T336-R351 WeakPolarHBondContact OG1-CD 3.29Å
337	C	81.5	Confident	80.3	Confident	14 Å²	14	53.4 Å²	53.4	10%	0.095	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	127.5	165.3	53	0	0	0	0	109.4	C328 L348 L349	C328-C337 HydrophobicContact CB-CB 3.59Å; C328-C337 WeakPolarHBondContact CB-SG 3.49Å; C328-C337 WeakPolarHBondContact SG-CB 3.49Å; C328-C337 CovalentContact SG-SG 2.03Å; C328-C337 PolarHBondContact SG-SG 2.91Å; C337-L348 HydrophobicContact CB-CB 4.2Å; C337-L349 CarbonylContact C-O 3.44Å; C337-L349 WeakPolarHBondContact CA-O 3.28Å
338	D	79.5	Confident	80	Confident	56 Å²	56	54.1 Å²	54.1	30%	0.299	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	170.3	-172.2	-63.9	-30.6	0	0	0	110.5	L340 L349 R351	D338-L340 HydrophobicContact CB-CD2 3.97Å; D338-L340 HydrophobicContact CB-CG 4.29Å; D338-L340 PolarHBondContact O-N 2.84Å; D338-L349 PolarHBondContact N-O 3.18Å; D338-L349 PolarHBondContact O-N 2.89Å; D338-R351 IonicContact OD2-CZ 2.84Å; D338-R351 IonicContact OD2-NE 2.93Å; D338-R351 PolarHBondContact OD2-NE 3.46Å; D338-R351 IonicContact OD2-NH2 3.34Å; D338-R351 PolarHBondContact OD2-NH2 3.15Å
339	I	77.1	Confident	79.7	Confident	98 Å²	98	54.9 Å²	54.9	50%	0.503	29%	0.292	S	S	.	.			trans	-74.3	80.8	166.6	-54.1	168.2	0	0	0	108.5	P345 L348	I339-P345 VanDerWaalsContact CD1-O 3.26Å; I339-P345 WeakPolarHBondContact CD1-O 3.43Å; I339-L348 HydrophobicContact CG1-CD2 3.97Å
340	L	72.5	Confident	79.7	Confident	70 Å²	70	55.1 Å²	55.1	37%	0.366	29%	0.293	S	S	.	.			trans	-81	-19.5	179.3	-59.4	179.1	0	0	0	113.2	D338 L349 R351	D338-L340 HydrophobicContact CB-CD2 3.97Å; D338-L340 HydrophobicContact CB-CG 4.29Å; D338-L340 PolarHBondContact O-N 2.84Å; L340-L349 HydrophobicContact CB-CB 4.07Å; L340-L349 HydrophobicContact CB-CD2 4.12Å; L340-L349 HydrophobicContact CD1-CB 3.87Å; L340-L349 HydrophobicContact CG-CB 4.08Å; L340-R351 HydrophobicContact CD1-CG 3.95Å; L340-R351 HydrophobicContact CD2-CG 4.07Å
341	D	72.5	Confident	79.6	Confident	39 Å²	39	61 Å²	61	21%	0.209	32%	0.315	C	S	.	.			trans	-117.3	106.4	-178.8	-178.5	-5.3	0	0	0	110.5	L343 R344 L349	D341-L343 PolarHBondContact O-N 3.06Å; D341-L343 VanDerWaalsContact O-N 3.09Å; D341-L343 WeakPolarHBondContact OD1-CB 3.42Å; D341-L343 PolarHBondContact OD1-N 2.8Å; D341-R344 HydrophobicContact CB-CB 4.38Å; D341-R344 CarbonylContact O-C 3.38Å; D341-R344 PolarHBondContact O-N 3.47Å; D341-R344 IonicContact OD2-CZ 2.65Å; D341-R344 IonicContact OD2-NE 2.72Å; D341-R344 PolarHBondContact OD2-NE 3.33Å; D341-R344 IonicContact OD2-NH2 2.64Å; D341-R344 PolarHBondContact OD2-NH2 2.88Å; D341-L349 HydrophobicContact CB-CD1 4.21Å; D341-L349 HydrophobicContact CB-CD2 4.15Å
342	P	72.6	Confident	79.7	Confident	115 Å²	115	61.4 Å²	61.4	75%	0.747	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-16.2	178.8	-25.1	35.3	0	0	0	115.1	R344	P342-R344 VanDerWaalsContact C-N 3.34Å
343	L	74.7	Confident	80	Confident	156 Å²	156	65.5 Å²	65.5	82%	0.817	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-11.6	175.1	-56.9	176.5	0	0	0	112.6	D341 P345	D341-L343 PolarHBondContact O-N 3.06Å; D341-L343 VanDerWaalsContact O-N 3.09Å; D341-L343 WeakPolarHBondContact OD1-CB 3.42Å; D341-L343 PolarHBondContact OD1-N 2.8Å; L343-P345 VanDerWaalsContact C-CD 3.43Å
344	R	76.4	Confident	79.9	Confident	84 Å²	84	67 Å²	67	32%	0.317	35%	0.345	S	S	.	.			trans	-128	57.1	-178.3	-62.4	-170.5	-73.5	154.6	2.1	111.7	D341 P342 T346 R347 D359	D341-R344 HydrophobicContact CB-CB 4.38Å; D341-R344 CarbonylContact O-C 3.38Å; D341-R344 PolarHBondContact O-N 3.47Å; D341-R344 IonicContact OD2-CZ 2.65Å; D341-R344 IonicContact OD2-NE 2.72Å; D341-R344 PolarHBondContact OD2-NE 3.33Å; D341-R344 IonicContact OD2-NH2 2.64Å; D341-R344 PolarHBondContact OD2-NH2 2.88Å; P342-R344 VanDerWaalsContact C-N 3.34Å; R344-T346 VanDerWaalsContact C-N 3.26Å; R344-T346 PolarHBondContact O-N 2.86Å; R344-T346 VanDerWaalsContact O-N 3.09Å; R344-R347 HydrophobicContact CB-CB 4.17Å; R344-R347 PolarHBondContact O-N 2.83Å; R344-D359 IonicContact CZ-OD1 2.6Å; R344-D359 IonicContact CZ-OD2 2.75Å; R344-D359 VanDerWaalsContact NH1-CG 3.32Å; R344-D359 IonicContact NH1-OD1 2.59Å; R344-D359 PolarHBondContact NH1-OD1 2.91Å; R344-D359 VanDerWaalsContact NH1-OD1 3.14Å; R344-D359 IonicContact NH1-OD2 3.73Å; R344-D359 PolarHBondContact NH1-OD2 3.41Å; R344-D359 IonicContact NH2-OD1 2.68Å; R344-D359 PolarHBondContact NH2-OD1 3.28Å; R344-D359 IonicContact NH2-OD2 3.17Å
345	P	73.3	Confident	80.2	Confident	80 Å²	80	69.5 Å²	69.5	52%	0.519	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-17.3	-167.2	27.2	-37	0	0	0	115.9	I339 L343	I339-P345 VanDerWaalsContact CD1-O 3.26Å; I339-P345 WeakPolarHBondContact CD1-O 3.43Å; L343-P345 VanDerWaalsContact C-CD 3.43Å
346	T	68.5	Low	80.7	Confident	83 Å²	83	63.7 Å²	63.7	51%	0.509	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-3.5	174.4	65.1	0	0	0	0	113.8	E159 R344	E159-T346 WeakPolarHBondContact OE1-CB 3.21Å; E159-T346 PolarHBondContact OE1-OG1 3.43Å; R344-T346 VanDerWaalsContact C-N 3.26Å; R344-T346 PolarHBondContact O-N 2.86Å; R344-T346 VanDerWaalsContact O-N 3.09Å
347	R	75.7	Confident	81.1	Confident	80 Å²	80	63.5 Å²	63.5	30%	0.302	33%	0.332	S	S	.	.			trans	-99.3	128.9	179	-152.1	175.9	-163.2	180	10.1	110.6	Q160 R344 L349 D359	Q160-R347 HydrophobicContact CB-CG 4.47Å; R344-R347 HydrophobicContact CB-CB 4.17Å; R344-R347 PolarHBondContact O-N 2.83Å; R347-L349 HydrophobicContact CB-CD1 4.27Å; R347-D359 IonicContact CZ-OD2 3.15Å; R347-D359 IonicContact NE-OD2 2.73Å; R347-D359 IonicContact NH1-OD2 3.21Å; R347-D359 PolarHBondContact NH1-OD2 2.84Å
348	L	81.9	Confident	81.3	Confident	44 Å²	44	64.2 Å²	64.2	23%	0.23	34%	0.341	C	S	.	.			trans	-97.9	103.7	174.4	-63.5	174.6	0	0	0	108.8	F30 Q160 F162 C337 I339	F30-L348 HydrophobicContact CE2-CD1 4.1Å; F30-L348 HydrophobicContact CZ-CD1 3.66Å; Q160-L348 PolarHBondContact NE2-O 3.34Å; Q160-L348 PolarHBondContact OE1-O 2.92Å; F162-L348 HydrophobicContact CE1-CD1 4.44Å; F162-L348 HydrophobicContact CZ-CD1 4.48Å; C337-L348 HydrophobicContact CB-CB 4.2Å; I339-L348 HydrophobicContact CG1-CD2 3.97Å
349	L	83.7	Confident	81.6	Confident	18 Å²	18	63.2 Å²	63.2	9%	0.094	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	137.9	179.7	-72.1	76.5	0	0	0	110.2	C337 D338 L340 D341 R347 D359	C337-L349 CarbonylContact C-O 3.44Å; C337-L349 WeakPolarHBondContact CA-O 3.28Å; D338-L349 PolarHBondContact N-O 3.18Å; D338-L349 PolarHBondContact O-N 2.89Å; L340-L349 HydrophobicContact CB-CB 4.07Å; L340-L349 HydrophobicContact CB-CD2 4.12Å; L340-L349 HydrophobicContact CD1-CB 3.87Å; L340-L349 HydrophobicContact CG-CB 4.08Å; D341-L349 HydrophobicContact CB-CD1 4.21Å; D341-L349 HydrophobicContact CB-CD2 4.15Å; R347-L349 HydrophobicContact CB-CD1 4.27Å; L349-D359 WeakPolarHBondContact CD2-OD1 3.24Å
350	C	89.5	Confident	82.2	Confident	6 Å²	6	60.5 Å²	60.5	4%	0.041	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	136.9	174.3	-62.1	0	0	0	0	112.1	V329 C330 A334 C352 D359 C361	V329-C350 PolarHBondContact O-SG 3.41Å; V329-C350 VanDerWaalsContact O-SG 3.34Å; C330-C350 WeakPolarHBondContact CA-SG 3.25Å; C330-C350 HydrophobicContact CB-CB 3.74Å; C330-C350 WeakPolarHBondContact CB-SG 3.25Å; C330-C350 WeakPolarHBondContact SG-CB 3.16Å; C330-C350 CovalentContact SG-SG 2.03Å; C330-C350 PolarHBondContact SG-SG 3.25Å; A334-C350 HydrophobicContact CB-CB 3.86Å; C350-C352 PolarHBondContact O-N 3.03Å; C350-C352 VanDerWaalsContact O-N 3.09Å; C350-D359 PolarHBondContact N-O 3.19Å; C350-D359 VanDerWaalsContact N-O 3.09Å; C350-C361 WeakPolarHBondContact CB-SG 3.26Å
351	R	87.5	Confident	83.1	Confident	128 Å²	128	57.2 Å²	57.2	48%	0.483	30%	0.304	S	S	.	.			trans	-79.2	83.8	167.4	-73.7	-168.5	-171.8	-94.3	-4.8	110.1	A334 T336 D338 L340	A334-R351 WeakPolarHBondContact CA-O 3.24Å; A334-R351 WeakPolarHBondContact CB-O 3.45Å; T336-R351 PolarHBondContact O-N 2.87Å; T336-R351 WeakPolarHBondContact OG1-CD 3.29Å; D338-R351 IonicContact OD2-CZ 2.84Å; D338-R351 IonicContact OD2-NE 2.93Å; D338-R351 PolarHBondContact OD2-NE 3.46Å; D338-R351 IonicContact OD2-NH2 3.34Å; D338-R351 PolarHBondContact OD2-NH2 3.15Å; L340-R351 HydrophobicContact CD1-CG 3.95Å; L340-R351 HydrophobicContact CD2-CG 4.07Å
352	C	88.9	Confident	83.9	Confident	39 Å²	39	58.8 Å²	58.8	26%	0.264	31%	0.31	S	S	.	.			trans	-67.8	132.8	-172.8	-56.4	0	0	0	0	114	C350 T356 C361	C350-C352 PolarHBondContact O-N 3.03Å; C350-C352 VanDerWaalsContact O-N 3.09Å; C352-T356 WeakPolarHBondContact CB-O 3.26Å; C352-C361 WeakPolarHBondContact CA-SG 3.49Å; C352-C361 HydrophobicContact CB-CB 3.87Å; C352-C361 WeakPolarHBondContact CB-SG 3.41Å; C352-C361 WeakPolarHBondContact SG-CA 3.43Å; C352-C361 WeakPolarHBondContact SG-CB 3.36Å; C352-C361 PolarHBondContact SG-N 3.21Å; C352-C361 CovalentContact SG-SG 2.04Å; C352-C361 PolarHBondContact SG-SG 3.02Å
353	E	87.4	Confident	84.8	Confident	93 Å²	93	58.2 Å²	58.2	44%	0.435	30%	0.297	S	S	.	.			trans	-116.1	-163.1	173	-63.2	-174.7	-140.4	0	0	109.3	L25 H333 N355 T356	L25-E353 HydrophobicContact CD1-CB 3.9Å; L25-E353 HydrophobicContact CD1-CG 4.19Å; H333-E353 PolarHBondContact O-N 2.94Å; E353-N355 PolarHBondContact O-N 2.68Å; E353-T356 PolarHBondContact O-N 3.15Å; E353-T356 PolarHBondContact O-OG1 2.97Å
354	H	88.4	Confident	85.7	Confident	32 Å²	32	51.4 Å²	51.4	15%	0.148	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.7	28	179.2	-51.8	148.3	0	0	0	114.6	H333 T356 I381 E383 C384	H333-H354 AromaticContact CG-ND1 3.76Å; H333-H354 WeakPolarHBondContact ND1-CB 3.27Å; H333-H354 AromaticContact ND1-CG 3.59Å; H333-H354 AromaticContact ND1-ND1 2.94Å; H333-H354 PolarHBondContact ND1-ND1 3.48Å; H354-T356 HydrophobicContact CB-CG2 4.49Å; H354-T356 PolarHBondContact O-N 3.45Å; H354-I381 HydrophobicContact CB-CG2 4.45Å; H354-E383 HydrophobicContact CB-CB 4.38Å; H354-E383 HydrophobicContact CB-CG 4.3Å; H354-C384 PolarHBondContact O-N 3.48Å
355	N	90.6	Very high	86.4	Confident	51 Å²	51	48.4 Å²	48.4	27%	0.273	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.6	29.4	-173.2	-39.4	-53.8	0	0	0	114.3	E353 C365 F368 E383 C384	E353-N355 PolarHBondContact O-N 2.68Å; N355-C365 WeakPolarHBondContact O-CB 3.41Å; N355-C365 PolarHBondContact O-N 2.85Å; N355-C365 PolarHBondContact O-SG 3.22Å; N355-C365 VanDerWaalsContact O-SG 3.41Å; N355-F368 HydrophobicContact CB-CB 4.14Å; N355-F368 HydrophobicContact CB-CD1 3.37Å; N355-F368 HydrophobicContact CB-CD2 4.36Å; N355-F368 HydrophobicContact CB-CE1 3.75Å; N355-F368 HydrophobicContact CB-CG 3.71Å; N355-F368 HydrophobicContact CB-CZ 4.39Å; N355-F368 VanDerWaalsContact CG-CE1 3.48Å; N355-E383 WeakPolarHBondContact ND2-CG 3.43Å; N355-E383 PolarHBondContact ND2-OE1 3.08Å; N355-C384 HydrophobicContact CB-CB 4.08Å; N355-C384 WeakPolarHBondContact CB-O 3.36Å; N355-C384 PolarHBondContact ND2-O 2.86Å; N355-C384 WeakPolarHBondContact O-CB 3.46Å
356	T	91.2	Very high	87.1	Confident	4 Å²	4	49.9 Å²	49.9	3%	0.025	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	152.3	173.3	62.3	0	0	0	0	111.9	H333 C352 E353 H354 C361 Q363 C365	H333-T356 HydrophobicContact CB-CG2 4.21Å; H333-T356 WeakPolarHBondContact CB-OG1 3.22Å; C352-T356 WeakPolarHBondContact CB-O 3.26Å; E353-T356 PolarHBondContact O-N 3.15Å; E353-T356 PolarHBondContact O-OG1 2.97Å; H354-T356 HydrophobicContact CB-CG2 4.49Å; H354-T356 PolarHBondContact O-N 3.45Å; T356-C361 WeakPolarHBondContact OG1-CB 3.27Å; T356-Q363 CarbonylContact C-O 3.59Å; T356-Q363 VanDerWaalsContact CA-O 3.3Å; T356-Q363 WeakPolarHBondContact CA-O 3.49Å; T356-Q363 WeakPolarHBondContact CB-O 3.37Å; T356-C365 PolarHBondContact O-SG 3.18Å
357	C	89.2	Confident	87.9	Confident	43 Å²	43	46.7 Å²	46.7	29%	0.291	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	169	-176.6	-86.8	0	0	0	0	109.9	C361 E362 Q363 C365	C357-C361 CarbonylContact O-C 3.45Å; C357-C361 WeakPolarHBondContact O-CA 3.46Å; C357-E362 PolarHBondContact O-N 2.93Å; C357-Q363 HydrophobicContact CB-CG 4.41Å; C357-Q363 PolarHBondContact N-O 2.92Å; C357-Q363 WeakPolarHBondContact O-CG 3.39Å; C357-Q363 PolarHBondContact O-N 2.89Å; C357-C365 HydrophobicContact CB-CB 4.02Å; C357-C365 WeakPolarHBondContact CB-SG 3.34Å; C357-C365 WeakPolarHBondContact SG-CA 3.46Å; C357-C365 WeakPolarHBondContact SG-CB 3.47Å; C357-C365 CovalentContact SG-SG 2.05Å; C357-C365 PolarHBondContact SG-SG 2.94Å
358	G	86.2	Confident	88.6	Confident	29 Å²	29	45.7 Å²	45.7	30%	0.299	25%	0.246	S	C	.	.	S	Bend	trans	109.7	175.4	-175.5	0	0	0	0	0	112.6	Q360 E362	G358-Q360 VanDerWaalsContact C-N 3.3Å; G358-E362 VanDerWaalsContact CA-OE1 3.28Å; G358-E362 WeakPolarHBondContact CA-OE1 3.34Å; G358-E362 WeakPolarHBondContact CA-OE2 3.5Å
359	D	86.9	Confident	89.1	Confident	36 Å²	36	46 Å²	46	19%	0.193	25%	0.246	C	C	.	.	S	Bend	trans	-75	-24.1	179.9	-76	-29.3	0	0	0	111.9	R344 R347 L349 C350 E362	R344-D359 IonicContact CZ-OD1 2.6Å; R344-D359 IonicContact CZ-OD2 2.75Å; R344-D359 VanDerWaalsContact NH1-CG 3.32Å; R344-D359 IonicContact NH1-OD1 2.59Å; R344-D359 PolarHBondContact NH1-OD1 2.91Å; R344-D359 VanDerWaalsContact NH1-OD1 3.14Å; R344-D359 IonicContact NH1-OD2 3.73Å; R344-D359 PolarHBondContact NH1-OD2 3.41Å; R344-D359 IonicContact NH2-OD1 2.68Å; R344-D359 PolarHBondContact NH2-OD1 3.28Å; R344-D359 IonicContact NH2-OD2 3.17Å; R347-D359 IonicContact CZ-OD2 3.15Å; R347-D359 IonicContact NE-OD2 2.73Å; R347-D359 IonicContact NH1-OD2 3.21Å; R347-D359 PolarHBondContact NH1-OD2 2.84Å; L349-D359 WeakPolarHBondContact CD2-OD1 3.24Å; C350-D359 PolarHBondContact N-O 3.19Å; C350-D359 VanDerWaalsContact N-O 3.09Å; D359-E362 PolarHBondContact N-OE1 2.88Å; D359-E362 PolarHBondContact N-OE2 3.24Å
360	Q	89.4	Confident	89.4	Confident	41 Å²	41	45.1 Å²	45.1	19%	0.192	24%	0.242	C	C	.	.	S	Bend	trans	-121.5	11.3	-176.9	-68	-174.1	-37.8	0	0	112.8	V329 C330 G358 E362	V329-Q360 WeakPolarHBondContact O-CA 3.49Å; V329-Q360 WeakPolarHBondContact O-CB 3.28Å; V329-Q360 WeakPolarHBondContact O-CG 3.15Å; C330-Q360 CarbonylContact C-O 3.02Å; C330-Q360 WeakPolarHBondContact CA-O 3Å; G358-Q360 VanDerWaalsContact C-N 3.3Å; Q360-E362 VanDerWaalsContact C-N 3.28Å; Q360-E362 VanDerWaalsContact C-OE2 3.26Å; Q360-E362 VanDerWaalsContact CA-OE2 3.27Å; Q360-E362 WeakPolarHBondContact CA-OE2 3.48Å; Q360-E362 WeakPolarHBondContact CB-OE2 3.33Å; Q360-E362 PolarHBondContact N-OE2 3.11Å; Q360-E362 PolarHBondContact O-N 3.48Å
361	C	91.2	Very high	89.4	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.257	C	S	.	.	S	Bend	trans	61.3	33.6	-173.8	-44.6	0	0	0	0	113.7	H333 C350 C352 T356 C357 Q363 W373	H333-C361 HydrophobicContact CB-CB 3.87Å; C350-C361 WeakPolarHBondContact CB-SG 3.26Å; C352-C361 WeakPolarHBondContact CA-SG 3.49Å; C352-C361 HydrophobicContact CB-CB 3.87Å; C352-C361 WeakPolarHBondContact CB-SG 3.41Å; C352-C361 WeakPolarHBondContact SG-CA 3.43Å; C352-C361 WeakPolarHBondContact SG-CB 3.36Å; C352-C361 PolarHBondContact SG-N 3.21Å; C352-C361 CovalentContact SG-SG 2.04Å; C352-C361 PolarHBondContact SG-SG 3.02Å; T356-C361 WeakPolarHBondContact OG1-CB 3.27Å; C357-C361 CarbonylContact O-C 3.45Å; C357-C361 WeakPolarHBondContact O-CA 3.46Å; C361-Q363 PolarHBondContact O-N 3.27Å; C361-W373 WeakPolarHBondContact O-CZ2 3.07Å; C361-W373 PolarHBondContact O-NE1 2.84Å
362	E	88.1	Confident	89.4	Confident	72 Å²	72	49 Å²	49	34%	0.336	26%	0.258	S	S	.	.			trans	-82.3	-2.2	-169.3	70.6	-79.9	-175.4	0	0	115.6	C357 G358 D359 Q360 W373	C357-E362 PolarHBondContact O-N 2.93Å; G358-E362 VanDerWaalsContact CA-OE1 3.28Å; G358-E362 WeakPolarHBondContact CA-OE1 3.34Å; G358-E362 WeakPolarHBondContact CA-OE2 3.5Å; D359-E362 PolarHBondContact N-OE1 2.88Å; D359-E362 PolarHBondContact N-OE2 3.24Å; Q360-E362 VanDerWaalsContact C-N 3.28Å; Q360-E362 VanDerWaalsContact C-OE2 3.26Å; Q360-E362 VanDerWaalsContact CA-OE2 3.27Å; Q360-E362 WeakPolarHBondContact CA-OE2 3.48Å; Q360-E362 WeakPolarHBondContact CB-OE2 3.33Å; Q360-E362 PolarHBondContact N-OE2 3.11Å; Q360-E362 PolarHBondContact O-N 3.48Å; E362-W373 VanDerWaalsContact C-CE2 3.45Å
363	Q	91.2	Very high	89.6	Confident	103 Å²	103	50 Å²	50	48%	0.481	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	162	-178.7	53.5	-178.8	-25.4	0	0	111.6	T356 C357 C361	T356-Q363 CarbonylContact C-O 3.59Å; T356-Q363 VanDerWaalsContact CA-O 3.3Å; T356-Q363 WeakPolarHBondContact CA-O 3.49Å; T356-Q363 WeakPolarHBondContact CB-O 3.37Å; C357-Q363 HydrophobicContact CB-CG 4.41Å; C357-Q363 PolarHBondContact N-O 2.92Å; C357-Q363 WeakPolarHBondContact O-CG 3.39Å; C357-Q363 PolarHBondContact O-N 2.89Å; C361-Q363 PolarHBondContact O-N 3.27Å
364	C	93.7	Very high	89.5	Confident	13 Å²	13	51.3 Å²	51.3	9%	0.088	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	147.4	168.3	-65.4	0	0	0	0	110.7	F368 M369 C384	C364-F368 HydrophobicContact CB-CB 4.48Å; C364-F368 VanDerWaalsContact CB-O 3.26Å; C364-F368 WeakPolarHBondContact CB-O 3.5Å; C364-F368 PolarHBondContact SG-O 3.34Å; C364-M369 HydrophobicContact CB-CG 4.25Å; C364-C384 WeakPolarHBondContact CA-SG 3.3Å; C364-C384 HydrophobicContact CB-CB 3.59Å; C364-C384 WeakPolarHBondContact CB-SG 3.42Å; C364-C384 WeakPolarHBondContact SG-CB 3.46Å; C364-C384 CovalentContact SG-SG 2.03Å; C364-C384 PolarHBondContact SG-SG 2.89Å
365	C	91.5	Very high	89.4	Confident	22 Å²	22	50.7 Å²	50.7	15%	0.149	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-66.3	155.5	174.3	-66.6	0	0	0	0	112.4	N355 T356 C357 G367 F368	N355-C365 WeakPolarHBondContact O-CB 3.41Å; N355-C365 PolarHBondContact O-N 2.85Å; N355-C365 PolarHBondContact O-SG 3.22Å; N355-C365 VanDerWaalsContact O-SG 3.41Å; T356-C365 PolarHBondContact O-SG 3.18Å; C357-C365 HydrophobicContact CB-CB 4.02Å; C357-C365 WeakPolarHBondContact CB-SG 3.34Å; C357-C365 WeakPolarHBondContact SG-CA 3.46Å; C357-C365 WeakPolarHBondContact SG-CB 3.47Å; C357-C365 CovalentContact SG-SG 2.05Å; C357-C365 PolarHBondContact SG-SG 2.94Å; C365-G367 PolarHBondContact O-N 3.23Å; C365-F368 HydrophobicContact CB-CD2 4.04Å; C365-F368 WeakPolarHBondContact O-CB 3.5Å; C365-F368 PolarHBondContact O-N 3.09Å
366	P	87.5	Confident	88.8	Confident	111 Å²	111	48.6 Å²	48.6	72%	0.721	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50	128.6	172.9	-29	36.6	0	0	0	112.3
367	G	85.9	Confident	88.1	Confident	16 Å²	16	51.4 Å²	51.4	17%	0.165	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	89	-16.4	-173.7	0	0	0	0	0	115.5	C365 P386 C387	C365-G367 PolarHBondContact O-N 3.23Å; G367-P386 WeakPolarHBondContact O-CA 3.45Å; G367-C387 PolarHBondContact O-N 2.67Å
368	F	91.6	Very high	86.7	Confident	59 Å²	59	55 Å²	55	26%	0.259	27%	0.268	S	S	.	.			trans	-100.9	35.4	-176.6	-65.7	-98.2	0	0	0	113.8	N355 C364 C365 C384 E385 P386	N355-F368 HydrophobicContact CB-CB 4.14Å; N355-F368 HydrophobicContact CB-CD1 3.37Å; N355-F368 HydrophobicContact CB-CD2 4.36Å; N355-F368 HydrophobicContact CB-CE1 3.75Å; N355-F368 HydrophobicContact CB-CG 3.71Å; N355-F368 HydrophobicContact CB-CZ 4.39Å; N355-F368 VanDerWaalsContact CG-CE1 3.48Å; C364-F368 HydrophobicContact CB-CB 4.48Å; C364-F368 VanDerWaalsContact CB-O 3.26Å; C364-F368 WeakPolarHBondContact CB-O 3.5Å; C364-F368 PolarHBondContact SG-O 3.34Å; C365-F368 HydrophobicContact CB-CD2 4.04Å; C365-F368 WeakPolarHBondContact O-CB 3.5Å; C365-F368 PolarHBondContact O-N 3.09Å; F368-C384 HydrophobicContact CB-CB 3.98Å; F368-C384 WeakPolarHBondContact CD1-O 3.44Å; F368-E385 CarbonylContact C-O 3.57Å; F368-E385 VanDerWaalsContact CA-O 3.3Å; F368-E385 WeakPolarHBondContact CA-O 3.26Å; F368-P386 HydrophobicContact CD1-CB 3.88Å; F368-P386 HydrophobicContact CD1-CG 4.04Å; F368-P386 HydrophobicContact CE1-CB 3.88Å; F368-P386 HydrophobicContact CE1-CG 3.85Å; F368-P386 HydrophobicContact CZ-CB 4.49Å
369	M	90.7	Very high	85.6	Confident	49 Å²	49	56.4 Å²	56.4	24%	0.241	28%	0.282	C	S	.	.			trans	-103.3	24.3	-173.1	-73.2	171.4	-82.3	0	0	113.9	C364 K371 C387 C396 Y398	C364-M369 HydrophobicContact CB-CG 4.25Å; M369-K371 PolarHBondContact O-N 3.4Å; M369-C387 VanDerWaalsContact C-SG 3.51Å; M369-C396 WeakPolarHBondContact CE-O 3.39Å; M369-Y398 WeakPolarHBondContact O-CB 3.39Å
370	Q	91.8	Very high	84.7	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.295	C	S	.	.	S	Bend	trans	-63.2	-31.1	176.8	-173	58.1	27.2	0	0	111.7	E385 C387 S408 L409 K416 G417 G418 G419	Q370-E385 HydrophobicContact CB-CB 4.06Å; Q370-E385 HydrophobicContact CB-CG 4.22Å; Q370-E385 WeakPolarHBondContact CB-O 3.02Å; Q370-E385 HydrophobicContact CG-CG 4.46Å; Q370-E385 PolarHBondContact N-O 3.2Å; Q370-E385 VanDerWaalsContact N-O 3.1Å; Q370-C387 PolarHBondContact N-SG 2.94Å; Q370-C387 VanDerWaalsContact N-SG 3.43Å; Q370-S408 PolarHBondContact NE2-OG 3.02Å; Q370-S408 PolarHBondContact OE1-OG 3.06Å; Q370-L409 PolarHBondContact NE2-O 3.38Å; Q370-K416 PolarHBondContact NE2-O 2.84Å; Q370-G417 CarbonylContact O-C 3.27Å; Q370-G417 WeakPolarHBondContact O-CA 3.16Å; Q370-G418 PolarHBondContact O-N 3.46Å; Q370-G419 PolarHBondContact O-N 3.07Å
371	K	87.8	Confident	83.8	Confident	82 Å²	82	59.5 Å²	59.5	36%	0.357	30%	0.297	S	S	.	.	S	Bend	trans	-128.5	154.6	-179.6	-71.9	165.3	178.1	161.5	0	110.1	M369 W373 E385	M369-K371 PolarHBondContact O-N 3.4Å; K371-W373 PolarHBondContact O-N 3.44Å; K371-E385 HydrophobicContact CD-CB 4.4Å; K371-E385 WeakPolarHBondContact CE-OE2 3.49Å; K371-E385 IonicContact NZ-OE2 2.75Å; K371-E385 PolarHBondContact NZ-OE2 3.13Å
372	R	88.3	Confident	83.3	Confident	135 Å²	135	62.3 Å²	62.3	51%	0.509	31%	0.309	S	S	.	.			trans	-63.2	129.2	173.2	-162.6	-178.9	-58.7	-163.5	-0.5	110.2	Y398	R372-Y398 HydrophobicContact CB-CD1 4.49Å; R372-Y398 HydrophobicContact CB-CE1 3.9Å; R372-Y398 HydrophobicContact CB-CE2 3.96Å; R372-Y398 HydrophobicContact CG-CD1 4.48Å; R372-Y398 HydrophobicContact CG-CE1 3.93Å; R372-Y398 PolarHBondContact NE-OH 2.96Å; R372-Y398 PolarHBondContact NH2-OH 3.21Å
373	W	92.2	Very high	83.1	Confident	59 Å²	59	64 Å²	64	22%	0.223	32%	0.317	C	S	.	.			trans	-52.3	141.2	168.8	177.3	92	0	0	0	111.7	H331 H333 C361 E362 K371 P375	H331-W373 HydrophobicContact CB-CH2 4.24Å; H331-W373 HydrophobicContact CB-CZ2 3.77Å; H331-W373 AromaticContact CE1-CH2 3.77Å; H331-W373 AromaticContact CG-CH2 3.74Å; H331-W373 AromaticContact CG-CZ2 3.71Å; H331-W373 AromaticContact ND1-CH2 3.53Å; H331-W373 AromaticContact ND1-CZ2 3.97Å; H333-W373 AromaticContact NE2-CE2 3.74Å; H333-W373 AromaticContact NE2-CZ2 3.88Å; H333-W373 AromaticContact NE2-NE1 3.6Å; C361-W373 WeakPolarHBondContact O-CZ2 3.07Å; C361-W373 PolarHBondContact O-NE1 2.84Å; E362-W373 VanDerWaalsContact C-CE2 3.45Å; K371-W373 PolarHBondContact O-N 3.44Å; W373-P375 HydrophobicContact CH2-CB 4.48Å
374	R	87	Confident	83.1	Confident	120 Å²	120	59.2 Å²	59.2	45%	0.453	30%	0.295	S	S	.	.			trans	-149.1	150.8	174.3	-57	179.7	-167.4	-169.7	0.2	109.7	H333 F382	H333-R374 PolarHBondContact CE1-O 3.22Å; H333-R374 VanDerWaalsContact CE1-O 3.25Å; H333-R374 PolarHBondContact NE2-O 2.98Å; R374-F382 HydrophobicContact CB-CB 3.95Å; R374-F382 HydrophobicContact CB-CD1 4.2Å; R374-F382 HydrophobicContact CB-CD2 4.08Å; R374-F382 HydrophobicContact CB-CG 3.83Å; R374-F382 HydrophobicContact CG-CD1 4.41Å
375	P	85.2	Confident	82.9	Confident	20 Å²	20	59.3 Å²	59.3	13%	0.13	29%	0.294	C	S	.	.			trans	-66.8	149.9	170.1	29.2	-35.1	0	0	0	111.5	H331 H333 W373 R377 F382	H331-P375 HydrophobicContact CB-CB 4.08Å; H331-P375 WeakPolarHBondContact O-CA 3.44Å; H333-P375 WeakPolarHBondContact NE2-CA 3.39Å; W373-P375 HydrophobicContact CH2-CB 4.48Å; P375-R377 PolarHBondContact O-N 2.91Å; P375-F382 VanDerWaalsContact O-CD2 3.25Å; P375-F382 WeakPolarHBondContact O-CD2 3.42Å
376	V	78.7	Confident	82.9	Confident	6 Å²	6	60.4 Å²	60.4	4%	0.036	30%	0.301	C	S	.	.			trans	-61	134.6	176.2	-176.5	0	0	0	0	110.4	V24 H331 G332 H333 I381	V24-V376 HydrophobicContact CB-CG1 4.26Å; V24-V376 HydrophobicContact CG1-CB 4.09Å; V24-V376 HydrophobicContact CG1-CG1 3.86Å; V24-V376 HydrophobicContact CG2-CG1 4Å; H331-V376 PolarHBondContact O-N 3.44Å; G332-V376 VanDerWaalsContact C-CG2 3.41Å; G332-V376 WeakPolarHBondContact O-CG2 3.21Å; H333-V376 VanDerWaalsContact ND1-CG2 3.35Å; H333-V376 WeakPolarHBondContact ND1-CG2 3.31Å; V376-I381 WeakPolarHBondContact CG2-O 3.31Å
377	R	76.1	Confident	83.1	Confident	64 Å²	64	56 Å²	56	24%	0.242	27%	0.272	C	S	.	.	B	Isolated β-bridge	trans	-117.2	160.4	170.3	-61.2	-170.5	167.4	-172.8	-5.4	109.9	D258 P375 G379 Q380 F382	D258-R377 IonicContact OD1-CZ 3.74Å; D258-R377 IonicContact OD1-NH2 2.77Å; D258-R377 PolarHBondContact OD1-NH2 3.22Å; D258-R377 IonicContact OD2-CZ 3.5Å; D258-R377 IonicContact OD2-NH2 2.57Å; D258-R377 PolarHBondContact OD2-NH2 2.84Å; P375-R377 PolarHBondContact O-N 2.91Å; R377-G379 PolarHBondContact O-N 3.39Å; R377-Q380 HydrophobicContact CB-CB 4.28Å; R377-Q380 PolarHBondContact N-O 3.07Å; R377-Q380 CarbonylContact O-C 3.55Å; R377-Q380 PolarHBondContact O-N 2.71Å; R377-Q380 VanDerWaalsContact O-O 3.06Å; R377-F382 HydrophobicContact CB-CE2 4.09Å; R377-F382 HydrophobicContact CG-CE2 3.99Å
378	E	60.7	Low	83.3	Confident	117 Å²	117	56.6 Å²	56.6	55%	0.547	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	120	-177.3	-168.7	162.1	-149.5	0	0	110.4	H256 Q380	H256-E378 PolarHBondContact CE1-N 2.78Å; E378-Q380 VanDerWaalsContact C-N 3.33Å
379	G	62.6	Low	83.4	Confident	59 Å²	59	54.1 Å²	54.1	61%	0.608	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.2	4.6	-170.5	0	0	0	0	0	116.1	R377	R377-G379 PolarHBondContact O-N 3.39Å
380	Q	66.8	Low	83.4	Confident	97 Å²	97	52.7 Å²	52.7	45%	0.453	25%	0.254	S	S	.	.	B	Isolated β-bridge	trans	-139.8	95.4	-177.6	-62	-176	-12	0	0	111.7	R377 E378 F382	R377-Q380 HydrophobicContact CB-CB 4.28Å; R377-Q380 PolarHBondContact N-O 3.07Å; R377-Q380 CarbonylContact O-C 3.55Å; R377-Q380 PolarHBondContact O-N 2.71Å; R377-Q380 VanDerWaalsContact O-O 3.06Å; E378-Q380 VanDerWaalsContact C-N 3.33Å; Q380-F382 VanDerWaalsContact C-N 3.35Å; Q380-F382 HydrophobicContact CB-CD2 4.07Å; Q380-F382 HydrophobicContact CB-CE2 3.6Å; Q380-F382 HydrophobicContact CB-CZ 3.92Å; Q380-F382 VanDerWaalsContact O-CD2 3.28Å; Q380-F382 WeakPolarHBondContact O-CD2 3.25Å; Q380-F382 PolarHBondContact O-N 3.02Å
381	I	70.4	Confident	83.1	Confident	45 Å²	45	55.5 Å²	55.5	23%	0.231	28%	0.284	C	S	.	.			trans	-62.9	-36.1	-177.1	-56.8	178.8	0	0	0	112.8	H333 H354 V376 E383	H333-I381 PolarHBondContact CE1-O 3.12Å; H354-I381 HydrophobicContact CB-CG2 4.45Å; V376-I381 WeakPolarHBondContact CG2-O 3.31Å; I381-E383 HydrophobicContact CG2-CB 4.1Å; I381-E383 PolarHBondContact O-N 3.01Å
382	F	82.2	Confident	83.3	Confident	60 Å²	60	52 Å²	52	26%	0.263	27%	0.268	S	S	.	.			trans	50.6	40.1	-171.8	-62.1	-66.2	0	0	0	114.1	H333 R374 P375 R377 Q380 C384	H333-F382 VanDerWaalsContact CE1-C 3.44Å; H333-F382 PolarHBondContact CE1-O 2.79Å; R374-F382 HydrophobicContact CB-CB 3.95Å; R374-F382 HydrophobicContact CB-CD1 4.2Å; R374-F382 HydrophobicContact CB-CD2 4.08Å; R374-F382 HydrophobicContact CB-CG 3.83Å; R374-F382 HydrophobicContact CG-CD1 4.41Å; P375-F382 VanDerWaalsContact O-CD2 3.25Å; P375-F382 WeakPolarHBondContact O-CD2 3.42Å; R377-F382 HydrophobicContact CB-CE2 4.09Å; R377-F382 HydrophobicContact CG-CE2 3.99Å; Q380-F382 VanDerWaalsContact C-N 3.35Å; Q380-F382 HydrophobicContact CB-CD2 4.07Å; Q380-F382 HydrophobicContact CB-CE2 3.6Å; Q380-F382 HydrophobicContact CB-CZ 3.92Å; Q380-F382 VanDerWaalsContact O-CD2 3.28Å; Q380-F382 WeakPolarHBondContact O-CD2 3.25Å; Q380-F382 PolarHBondContact O-N 3.02Å; F382-C384 PolarHBondContact O-N 2.7Å
383	E	83.5	Confident	83.4	Confident	107 Å²	107	46.7 Å²	46.7	50%	0.5	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-53.2	133.1	172.1	-176	178.2	-177.5	0	0	111.2	H354 N355 I381 E385	H354-E383 HydrophobicContact CB-CB 4.38Å; H354-E383 HydrophobicContact CB-CG 4.3Å; N355-E383 WeakPolarHBondContact ND2-CG 3.43Å; N355-E383 PolarHBondContact ND2-OE1 3.08Å; I381-E383 HydrophobicContact CG2-CB 4.1Å; I381-E383 PolarHBondContact O-N 3.01Å; E383-E385 PolarHBondContact O-N 2.84Å
384	C	91.3	Very high	83	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.014	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-70.3	123.5	174.8	-73.3	0	0	0	0	109.3	H354 N355 C364 F368 F382	H354-C384 PolarHBondContact O-N 3.48Å; N355-C384 HydrophobicContact CB-CB 4.08Å; N355-C384 WeakPolarHBondContact CB-O 3.36Å; N355-C384 PolarHBondContact ND2-O 2.86Å; N355-C384 WeakPolarHBondContact O-CB 3.46Å; C364-C384 WeakPolarHBondContact CA-SG 3.3Å; C364-C384 HydrophobicContact CB-CB 3.59Å; C364-C384 WeakPolarHBondContact CB-SG 3.42Å; C364-C384 WeakPolarHBondContact SG-CB 3.46Å; C364-C384 CovalentContact SG-SG 2.03Å; C364-C384 PolarHBondContact SG-SG 2.89Å; F368-C384 HydrophobicContact CB-CB 3.98Å; F368-C384 WeakPolarHBondContact CD1-O 3.44Å; F382-C384 PolarHBondContact O-N 2.7Å
385	E	89.7	Confident	83	Confident	15 Å²	15	49.1 Å²	49.1	7%	0.07	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-98.9	135.9	-172.5	-177.3	-171.9	149.8	0	0	111.4	F368 Q370 K371 E383 D410 I411	F368-E385 CarbonylContact C-O 3.57Å; F368-E385 VanDerWaalsContact CA-O 3.3Å; F368-E385 WeakPolarHBondContact CA-O 3.26Å; Q370-E385 HydrophobicContact CB-CB 4.06Å; Q370-E385 HydrophobicContact CB-CG 4.22Å; Q370-E385 WeakPolarHBondContact CB-O 3.02Å; Q370-E385 HydrophobicContact CG-CG 4.46Å; Q370-E385 PolarHBondContact N-O 3.2Å; Q370-E385 VanDerWaalsContact N-O 3.1Å; K371-E385 HydrophobicContact CD-CB 4.4Å; K371-E385 WeakPolarHBondContact CE-OE2 3.49Å; K371-E385 IonicContact NZ-OE2 2.75Å; K371-E385 PolarHBondContact NZ-OE2 3.13Å; E383-E385 PolarHBondContact O-N 2.84Å; E385-D410 VanDerWaalsContact OE1-CB 3.32Å; E385-D410 WeakPolarHBondContact OE1-CB 3.14Å; E385-I411 HydrophobicContact CG-CD1 4.12Å; E385-I411 HydrophobicContact CG-CG1 4.26Å; E385-I411 HydrophobicContact CG-CG2 4.18Å; E385-I411 WeakPolarHBondContact OE1-CG1 3.46Å; E385-I411 PolarHBondContact OE1-N 2.75Å
386	P	91.1	Very high	83.2	Confident	46 Å²	46	48.7 Å²	48.7	30%	0.299	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-63	137.7	176.2	20	-23.4	0	0	0	112.5	G367 F368 N388 I411	G367-P386 WeakPolarHBondContact O-CA 3.45Å; F368-P386 HydrophobicContact CD1-CB 3.88Å; F368-P386 HydrophobicContact CD1-CG 4.04Å; F368-P386 HydrophobicContact CE1-CB 3.88Å; F368-P386 HydrophobicContact CE1-CG 3.85Å; F368-P386 HydrophobicContact CZ-CB 4.49Å; P386-N388 PolarHBondContact O-N 2.93Å; P386-I411 HydrophobicContact CG-CG2 4.1Å; P386-I411 WeakPolarHBondContact O-CG2 3.44Å
387	C	91	Very high	83.8	Confident	18 Å²	18	53.7 Å²	53.7	12%	0.122	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-66.9	131.5	178.4	-63	0	0	0	0	111.7	G367 M369 Q370 C389 C396	G367-C387 PolarHBondContact O-N 2.67Å; M369-C387 VanDerWaalsContact C-SG 3.51Å; Q370-C387 PolarHBondContact N-SG 2.94Å; Q370-C387 VanDerWaalsContact N-SG 3.43Å; C387-C389 PolarHBondContact O-N 3.44Å; C387-C389 VanDerWaalsContact O-N 3.14Å; C387-C396 HydrophobicContact CB-CB 3.48Å; C387-C396 VanDerWaalsContact CB-CB 3.48Å; C387-C396 WeakPolarHBondContact CB-SG 3.02Å; C387-C396 WeakPolarHBondContact SG-CB 3.25Å; C387-C396 CovalentContact SG-SG 2.03Å; C387-C396 PolarHBondContact SG-SG 2.03Å
388	N	91.1	Very high	84.6	Confident	29 Å²	29	52.6 Å²	52.6	16%	0.155	30%	0.297	C	S	.	.			trans	-81.2	96.8	175.8	-171.2	-8.2	0	0	0	110.4	P386 F390 L409 D410 N432	P386-N388 PolarHBondContact O-N 2.93Å; N388-F390 PolarHBondContact OD1-N 3.29Å; N388-L409 WeakPolarHBondContact CB-O 3.05Å; N388-D410 PolarHBondContact ND2-O 2.77Å; N388-N432 WeakPolarHBondContact O-CA 3.34Å; N388-N432 WeakPolarHBondContact O-CB 3.28Å; N388-N432 PolarHBondContact O-ND2 3.32Å
389	C	93.6	Very high	86	Confident	7 Å²	7	49.9 Å²	49.9	5%	0.047	29%	0.286	C	S	.	.			trans	-104.5	18.2	177.1	-56.5	0	0	0	0	113.6	C387 G391 H392 S393 C421 N432	C387-C389 PolarHBondContact O-N 3.44Å; C387-C389 VanDerWaalsContact O-N 3.14Å; C389-G391 PolarHBondContact O-N 2.04Å; C389-H392 PolarHBondContact O-CD2 2.59Å; C389-H392 PolarHBondContact O-N 3Å; C389-S393 WeakPolarHBondContact CB-O 3.4Å; C389-C421 WeakPolarHBondContact CA-SG 3.3Å; C389-C421 HydrophobicContact CB-CB 3.88Å; C389-C421 WeakPolarHBondContact CB-SG 3.04Å; C389-C421 WeakPolarHBondContact SG-CB 2.99Å; C389-C421 CovalentContact SG-SG 2.03Å; C389-C421 PolarHBondContact SG-SG 3.44Å; C389-N432 CarbonylContact C-O 3.48Å; C389-N432 VanDerWaalsContact C-O 3.23Å; C389-N432 VanDerWaalsContact CA-O 3.32Å; C389-N432 WeakPolarHBondContact CA-O 3.42Å
390	F	90.1	Very high	87.2	Confident	18 Å²	18	50.5 Å²	50.5	8%	0.079	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	46.7	26.8	-174.4	-66.9	-70.8	0	0	0	115	N388 H392 L409 N432 E434 R448 E449	N388-F390 PolarHBondContact OD1-N 3.29Å; F390-H392 VanDerWaalsContact C-N 3.27Å; F390-H392 PolarHBondContact O-N 3.49Å; F390-L409 HydrophobicContact CE2-CD1 3.84Å; F390-L409 HydrophobicContact CZ-CD1 3.89Å; F390-N432 HydrophobicContact CD2-CB 4.19Å; F390-N432 WeakPolarHBondContact CD2-O 3.34Å; F390-N432 HydrophobicContact CE2-CB 3.98Å; F390-E434 HydrophobicContact CD2-CB 3.94Å; F390-E434 HydrophobicContact CE2-CB 3.69Å; F390-R448 HydrophobicContact CB-CB 4.37Å; F390-R448 HydrophobicContact CD1-CB 3.61Å; F390-R448 HydrophobicContact CD2-CB 4.35Å; F390-R448 HydrophobicContact CE1-CB 3.94Å; F390-R448 HydrophobicContact CE1-CG 4.46Å; F390-R448 HydrophobicContact CG-CB 3.85Å; F390-R448 HydrophobicContact CZ-CB 4.47Å; F390-E449 HydrophobicContact CD1-CG 4.02Å; F390-E449 VanDerWaalsContact CD1-OE1 3.26Å; F390-E449 WeakPolarHBondContact CD1-OE1 3.48Å; F390-E449 WeakPolarHBondContact CE1-OE1 3.3Å; F390-E449 WeakPolarHBondContact O-CA 3.29Å
391	G	86.6	Confident	88.2	Confident	60 Å²	60	52 Å²	52	62%	0.619	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.9	8.9	-176	0	0	0	0	0	115.3	C389	C389-G391 PolarHBondContact O-N 2.04Å
392	H	92.1	Very high	89.2	Confident	8 Å²	8	50.5 Å²	50.5	4%	0.037	28%	0.279	C	S	.	.	S	Bend	trans	-92.7	-5.8	175.1	-43.8	-70.8	0	0	0	114	C389 F390 G425 H426 T428 C433 R448 S450	C389-H392 PolarHBondContact O-CD2 2.59Å; C389-H392 PolarHBondContact O-N 3Å; F390-H392 VanDerWaalsContact C-N 3.27Å; F390-H392 PolarHBondContact O-N 3.49Å; H392-G425 PolarHBondContact O-N 2.87Å; H392-H426 AromaticContact CG-ND1 3.83Å; H392-H426 WeakPolarHBondContact ND1-CB 3.31Å; H392-H426 AromaticContact ND1-CG 3.57Å; H392-H426 AromaticContact ND1-ND1 3.15Å; H392-H426 PolarHBondContact ND1-ND1 3.19Å; H392-H426 VanDerWaalsContact ND1-ND1 3.15Å; H392-T428 VanDerWaalsContact CB-OG1 3.32Å; H392-T428 WeakPolarHBondContact CB-OG1 3.45Å; H392-C433 HydrophobicContact CB-CB 3.72Å; H392-C433 PolarHBondContact CD2-O 2.97Å; H392-C433 VanDerWaalsContact CD2-O 3.25Å; H392-R448 PolarHBondContact CE1-O 3.41Å; H392-R448 PolarHBondContact NE2-O 3.49Å; H392-S450 PolarHBondContact CE1-O 2.98Å
393	S	89.3	Confident	89.4	Confident	24 Å²	24	49.6 Å²	49.6	17%	0.168	28%	0.277	C	S	.	.			trans	-154.3	157.3	169	-171.6	0	0	0	0	111.5	C389 E395 K422	C389-S393 WeakPolarHBondContact CB-O 3.4Å; S393-E395 PolarHBondContact OG-N 3.45Å; S393-E395 PolarHBondContact OG-O 3.33Å; S393-K422 WeakPolarHBondContact CB-O 3.18Å; S393-K422 PolarHBondContact OG-O 2.05Å
394	T	83.8	Confident	89.5	Confident	130 Å²	130	48.6 Å²	48.6	80%	0.798	29%	0.287	S	S	*	.	S	Bend	trans	-109.7	0.9	167.3	52.8	0	0	0	0	112.3
395	E	86.6	Confident	89.3	Confident	99 Å²	99	52.5 Å²	52.5	46%	0.463	31%	0.308	S	S	.	.			trans	-114.1	135.2	-176.7	-65.3	176.8	167.9	0	0	110.4	S393 C421 K422 N423	S393-E395 PolarHBondContact OG-N 3.45Å; S393-E395 PolarHBondContact OG-O 3.33Å; E395-C421 WeakPolarHBondContact O-CA 3.24Å; E395-K422 HydrophobicContact CB-CB 4.14Å; E395-K422 PolarHBondContact O-N 3.28Å; E395-N423 PolarHBondContact OE2-ND2 3.47Å
396	C	90.9	Very high	89.1	Confident	12 Å²	12	57.8 Å²	57.8	8%	0.081	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	170.4	173.9	63.4	0	0	0	0	111.1	M369 C387 V420	M369-C396 WeakPolarHBondContact CE-O 3.39Å; C387-C396 HydrophobicContact CB-CB 3.48Å; C387-C396 VanDerWaalsContact CB-CB 3.48Å; C387-C396 WeakPolarHBondContact CB-SG 3.02Å; C387-C396 WeakPolarHBondContact SG-CB 3.25Å; C387-C396 CovalentContact SG-SG 2.03Å; C387-C396 PolarHBondContact SG-SG 2.03Å; C396-V420 CarbonylContact C-O 3.5Å; C396-V420 WeakPolarHBondContact CA-O 3.07Å; C396-V420 WeakPolarHBondContact CB-O 3.26Å
397	E	90.8	Very high	89	Confident	110 Å²	110	59.8 Å²	59.8	51%	0.514	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	149.6	173.5	-174.7	176.4	-156.8	0	0	108.9	V420 K422	E397-V420 PolarHBondContact N-O 2.93Å; E397-V420 PolarHBondContact O-N 3.35Å; E397-K422 WeakPolarHBondContact OE2-CE 3.09Å; E397-K422 IonicContact OE2-NZ 3.42Å; E397-K422 PolarHBondContact OE2-NZ 3.4Å
398	Y	92.1	Very high	89.1	Confident	41 Å²	41	58.9 Å²	58.9	16%	0.161	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	113.5	173.5	171.3	-98.9	0	0	0	110.6	M369 R372 P400 D403	M369-Y398 WeakPolarHBondContact O-CB 3.39Å; R372-Y398 HydrophobicContact CB-CD1 4.49Å; R372-Y398 HydrophobicContact CB-CE1 3.9Å; R372-Y398 HydrophobicContact CB-CE2 3.96Å; R372-Y398 HydrophobicContact CG-CD1 4.48Å; R372-Y398 HydrophobicContact CG-CE1 3.93Å; R372-Y398 PolarHBondContact NE-OH 2.96Å; R372-Y398 PolarHBondContact NH2-OH 3.21Å; Y398-P400 HydrophobicContact CD1-CG 4.42Å; Y398-P400 HydrophobicContact CE1-CB 4.33Å; Y398-P400 HydrophobicContact CE1-CG 3.92Å; Y398-D403 HydrophobicContact CE2-CB 3.76Å; Y398-D403 VanDerWaalsContact CE2-OD2 3.31Å; Y398-D403 WeakPolarHBondContact CE2-OD2 3.21Å; Y398-D403 PolarHBondContact OH-OD2 2.9Å
399	D	91.2	Very high	89.1	Confident	60 Å²	60	57.8 Å²	57.8	32%	0.321	32%	0.324	S	S	.	.			trans	-99.7	117.6	175	-178	-45.3	0	0	0	110.5	E401 V402 D403 G418 V420	D399-E401 VanDerWaalsContact C-N 3.32Å; D399-E401 PolarHBondContact O-N 3.28Å; D399-E401 WeakPolarHBondContact OD1-CA 3.34Å; D399-E401 WeakPolarHBondContact OD1-CB 3.33Å; D399-E401 PolarHBondContact OD1-N 3.43Å; D399-V402 HydrophobicContact CB-CB 3.91Å; D399-V402 HydrophobicContact CB-CG2 3.87Å; D399-V402 PolarHBondContact O-N 3.04Å; D399-V402 PolarHBondContact OD1-N 2.9Å; D399-D403 PolarHBondContact O-N 2.77Å; D399-D403 VanDerWaalsContact O-N 3.09Å; D399-G418 PolarHBondContact N-O 2.04Å; D399-G418 WeakPolarHBondContact O-CA 3.05Å; D399-V420 HydrophobicContact CB-CG2 3.58Å
400	P	88	Confident	88.8	Confident	72 Å²	72	57.6 Å²	57.6	47%	0.468	32%	0.323	S	S	.	.	H	α-helix	trans	-65.3	-27.9	179.8	-21.4	32.4	0	0	0	114.9	Y398 A404	Y398-P400 HydrophobicContact CD1-CG 4.42Å; Y398-P400 HydrophobicContact CE1-CB 4.33Å; Y398-P400 HydrophobicContact CE1-CG 3.92Å; P400-A404 VanDerWaalsContact O-CB 3.26Å; P400-A404 WeakPolarHBondContact O-CB 3Å; P400-A404 PolarHBondContact O-N 3.3Å
401	E	87.5	Confident	88.5	Confident	129 Å²	129	60.7 Å²	60.7	60%	0.603	34%	0.34	S	S	*	.	H	α-helix	trans	-77.2	-36.4	178.8	-161.8	-161.8	128.4	0	0	110.6	D399 N405 K407	D399-E401 VanDerWaalsContact C-N 3.32Å; D399-E401 PolarHBondContact O-N 3.28Å; D399-E401 WeakPolarHBondContact OD1-CA 3.34Å; D399-E401 WeakPolarHBondContact OD1-CB 3.33Å; D399-E401 PolarHBondContact OD1-N 3.43Å; E401-N405 WeakPolarHBondContact CG-ND2 3.47Å; E401-N405 WeakPolarHBondContact O-CB 3.04Å; E401-N405 PolarHBondContact O-N 3.31Å; E401-N405 PolarHBondContact O-ND2 3.44Å; E401-K407 IonicContact OE1-NZ 3.15Å
402	V	89.9	Confident	88.4	Confident	13 Å²	13	64.3 Å²	64.3	8%	0.079	34%	0.34	C	S	.	.	H	α-helix	trans	-65.3	-40	172.3	171.8	0	0	0	0	111.1	D399 Q406 K407 V420 I431	D399-V402 HydrophobicContact CB-CB 3.91Å; D399-V402 HydrophobicContact CB-CG2 3.87Å; D399-V402 PolarHBondContact O-N 3.04Å; D399-V402 PolarHBondContact OD1-N 2.9Å; V402-Q406 PolarHBondContact O-N 3.21Å; V402-Q406 VanDerWaalsContact O-N 3.09Å; V402-K407 HydrophobicContact CG1-CB 3.93Å; V402-K407 PolarHBondContact O-N 2.03Å; V402-V420 HydrophobicContact CB-CG2 4.19Å; V402-V420 HydrophobicContact CG1-CG2 4.18Å; V402-V420 HydrophobicContact CG2-CG2 3.73Å; V402-I431 HydrophobicContact CG1-CD1 4.35Å; V402-I431 HydrophobicContact CG1-CG2 3.93Å; V402-I431 HydrophobicContact CG2-CD1 4.35Å
403	D	88.3	Confident	87.8	Confident	41 Å²	41	66.2 Å²	66.2	22%	0.219	36%	0.362	C	S	.	.	H	α-helix	trans	-65.4	-50	174.5	-165	24.2	0	0	0	111.7	Y398 D399 N405 Q406 G417	Y398-D403 HydrophobicContact CE2-CB 3.76Å; Y398-D403 VanDerWaalsContact CE2-OD2 3.31Å; Y398-D403 WeakPolarHBondContact CE2-OD2 3.21Å; Y398-D403 PolarHBondContact OH-OD2 2.9Å; D399-D403 PolarHBondContact O-N 2.77Å; D399-D403 VanDerWaalsContact O-N 3.09Å; D403-N405 VanDerWaalsContact C-N 3.28Å; D403-N405 PolarHBondContact O-N 2.97Å; D403-Q406 PolarHBondContact O-N 3.28Å; D403-G417 WeakPolarHBondContact CA-O 3.21Å; D403-G417 WeakPolarHBondContact OD1-CA 3.43Å
404	A	84.1	Confident	87.5	Confident	86 Å²	86	69.4 Å²	69.4	71%	0.711	37%	0.374	S	S	*	.	H	α-helix	trans	-61.4	-33.9	-180	0	0	0	0	0	113.2	P400	P400-A404 VanDerWaalsContact O-CB 3.26Å; P400-A404 WeakPolarHBondContact O-CB 3Å; P400-A404 PolarHBondContact O-N 3.3Å
405	N	87.2	Confident	87.7	Confident	84 Å²	84	69.1 Å²	69.1	45%	0.449	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-0.7	175.3	-72.9	-75.4	0	0	0	114.2	E401 D403 K407	E401-N405 WeakPolarHBondContact CG-ND2 3.47Å; E401-N405 WeakPolarHBondContact O-CB 3.04Å; E401-N405 PolarHBondContact O-N 3.31Å; E401-N405 PolarHBondContact O-ND2 3.44Å; D403-N405 VanDerWaalsContact C-N 3.28Å; D403-N405 PolarHBondContact O-N 2.97Å; N405-K407 HydrophobicContact CB-CD 3.58Å; N405-K407 VanDerWaalsContact CB-CE 3.43Å; N405-K407 HydrophobicContact CB-CG 3.67Å; N405-K407 VanDerWaalsContact CG-NZ 3.34Å; N405-K407 PolarHBondContact ND2-NZ 2.04Å; N405-K407 PolarHBondContact O-N 3.11Å
406	Q	86.3	Confident	87.4	Confident	127 Å²	127	68.9 Å²	68.9	59%	0.593	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	51.7	-174.1	-62.3	-177.6	-5.3	0	0	112.7	V402 D403 Y415	V402-Q406 PolarHBondContact O-N 3.21Å; V402-Q406 VanDerWaalsContact O-N 3.09Å; D403-Q406 PolarHBondContact O-N 3.28Å; Q406-Y415 WeakPolarHBondContact O-CB 3.4Å
407	K	89.2	Confident	87.1	Confident	87 Å²	87	68.5 Å²	68.5	38%	0.378	36%	0.355	S	S	.	.			trans	-98.9	-17.3	-174.2	-74.4	168.7	179.2	156	0	114.9	E401 V402 N405 I431	E401-K407 IonicContact OE1-NZ 3.15Å; V402-K407 HydrophobicContact CG1-CB 3.93Å; V402-K407 PolarHBondContact O-N 2.03Å; N405-K407 HydrophobicContact CB-CD 3.58Å; N405-K407 VanDerWaalsContact CB-CE 3.43Å; N405-K407 HydrophobicContact CB-CG 3.67Å; N405-K407 VanDerWaalsContact CG-NZ 3.34Å; N405-K407 PolarHBondContact ND2-NZ 2.04Å; N405-K407 PolarHBondContact O-N 3.11Å; K407-I431 HydrophobicContact CB-CD1 3.65Å
408	S	92.5	Very high	87	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	33%	0.331	C	S	.	.	S	Bend	trans	-95.9	144.5	176.3	-174.5	0	0	0	0	112.4	Q370 Y415 K416 G417 G419 N432	Q370-S408 PolarHBondContact NE2-OG 3.02Å; Q370-S408 PolarHBondContact OE1-OG 3.06Å; S408-Y415 CarbonylContact O-C 3.49Å; S408-Y415 VanDerWaalsContact O-CA 3.29Å; S408-Y415 WeakPolarHBondContact O-CA 3.14Å; S408-K416 CarbonylContact O-C 3.27Å; S408-K416 PolarHBondContact O-N 3.01Å; S408-G417 WeakPolarHBondContact CB-O 3.14Å; S408-G419 VanDerWaalsContact CB-O 3.26Å; S408-G419 WeakPolarHBondContact CB-O 3.33Å; S408-G419 PolarHBondContact OG-O 2.87Å; S408-N432 WeakPolarHBondContact CA-OD1 3.47Å; S408-N432 PolarHBondContact OG-ND2 3.31Å
409	L	90.7	Very high	87	Confident	5 Å²	5	61.3 Å²	61.3	3%	0.026	32%	0.323	C	S	.	.	B	Isolated β-bridge	trans	-81.6	133.6	171.9	-69.8	158.8	0	0	0	111.6	Q370 N388 F390 Q414 Y415 N432	Q370-L409 PolarHBondContact NE2-O 3.38Å; N388-L409 WeakPolarHBondContact CB-O 3.05Å; F390-L409 HydrophobicContact CE2-CD1 3.84Å; F390-L409 HydrophobicContact CZ-CD1 3.89Å; L409-Q414 CarbonylContact C-O 3.54Å; L409-Q414 WeakPolarHBondContact CA-O 3.43Å; L409-Y415 HydrophobicContact CD1-CE1 4.04Å; L409-Y415 HydrophobicContact CD2-CD1 3.78Å; L409-Y415 HydrophobicContact CD2-CD2 3.82Å; L409-Y415 HydrophobicContact CD2-CE1 3.75Å; L409-Y415 HydrophobicContact CD2-CE2 3.8Å; L409-Y415 HydrophobicContact CD2-CG 3.82Å; L409-Y415 HydrophobicContact CG-CD1 3.8Å; L409-Y415 HydrophobicContact CG-CE1 3.56Å; L409-Y415 HydrophobicContact CG-CE2 4.48Å; L409-Y415 HydrophobicContact CG-CG 4.36Å; L409-N432 HydrophobicContact CD1-CB 4.42Å; L409-N432 PolarHBondContact N-ND2 2.91Å; L409-N432 PolarHBondContact N-OD1 3.3Å; L409-N432 PolarHBondContact O-ND2 3.39Å
410	D	86.8	Confident	87.1	Confident	4 Å²	4	59.6 Å²	59.6	2%	0.021	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-80.3	173.6	171.7	79.8	5.1	0	0	0	111.5	E385 N388 H412 G413 Q414 K416	E385-D410 VanDerWaalsContact OE1-CB 3.32Å; E385-D410 WeakPolarHBondContact OE1-CB 3.14Å; N388-D410 PolarHBondContact ND2-O 2.77Å; D410-H412 PolarHBondContact O-N 2.74Å; D410-H412 VanDerWaalsContact O-N 3.13Å; D410-H412 VanDerWaalsContact OD1-CA 3.24Å; D410-H412 WeakPolarHBondContact OD1-CA 3.08Å; D410-H412 WeakPolarHBondContact OD1-CB 3.5Å; D410-H412 PolarHBondContact OD1-N 2.9Å; D410-G413 PolarHBondContact O-N 2.98Å; D410-G413 PolarHBondContact OD1-N 2.82Å; D410-Q414 PolarHBondContact N-O 3.2Å; D410-Q414 PolarHBondContact OD1-N 2.04Å; D410-K416 HydrophobicContact CB-CB 4.37Å
411	I	84.4	Confident	87.4	Confident	83 Å²	83	56.6 Å²	56.6	43%	0.426	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-8.2	179.4	69.7	-179.4	0	0	0	113.8	E385 P386	E385-I411 HydrophobicContact CG-CD1 4.12Å; E385-I411 HydrophobicContact CG-CG1 4.26Å; E385-I411 HydrophobicContact CG-CG2 4.18Å; E385-I411 WeakPolarHBondContact OE1-CG1 3.46Å; E385-I411 PolarHBondContact OE1-N 2.75Å; P386-I411 HydrophobicContact CG-CG2 4.1Å; P386-I411 WeakPolarHBondContact O-CG2 3.44Å
412	H	84	Confident	87.6	Confident	135 Å²	135	54 Å²	54	63%	0.625	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	4.3	174.9	-51.7	-53.1	0	0	0	112.4	D410 Q414	D410-H412 PolarHBondContact O-N 2.74Å; D410-H412 VanDerWaalsContact O-N 3.13Å; D410-H412 VanDerWaalsContact OD1-CA 3.24Å; D410-H412 WeakPolarHBondContact OD1-CA 3.08Å; D410-H412 WeakPolarHBondContact OD1-CB 3.5Å; D410-H412 PolarHBondContact OD1-N 2.9Å; H412-Q414 HydrophobicContact CB-CG 4.44Å
413	G	79.5	Confident	87.5	Confident	49 Å²	49	59.6 Å²	59.6	51%	0.505	31%	0.312	S	S	.	.	S	Bend	trans	75.8	19.1	179.4	0	0	0	0	0	114.5	D410	D410-G413 PolarHBondContact O-N 2.98Å; D410-G413 PolarHBondContact OD1-N 2.82Å
414	Q	84.6	Confident	87.6	Confident	90 Å²	90	58.6 Å²	58.6	42%	0.421	31%	0.307	S	S	.	.			trans	-97.9	140.4	175.2	-47.6	-179.4	27.3	0	0	109.6	L409 D410 H412 K416	L409-Q414 CarbonylContact C-O 3.54Å; L409-Q414 WeakPolarHBondContact CA-O 3.43Å; D410-Q414 PolarHBondContact N-O 3.2Å; D410-Q414 PolarHBondContact OD1-N 2.04Å; H412-Q414 HydrophobicContact CB-CG 4.44Å; Q414-K416 HydrophobicContact CB-CD 4.26Å; Q414-K416 HydrophobicContact CB-CG 4.36Å; Q414-K416 PolarHBondContact O-N 3.2Å
415	Y	86.4	Confident	87.7	Confident	124 Å²	124	55.8 Å²	55.8	49%	0.486	29%	0.287	S	S	.	.	B	Isolated β-bridge	trans	-72.2	92	174.6	-78.3	-75.2	0	0	0	110.4	Q406 S408 L409	Q406-Y415 WeakPolarHBondContact O-CB 3.4Å; S408-Y415 CarbonylContact O-C 3.49Å; S408-Y415 VanDerWaalsContact O-CA 3.29Å; S408-Y415 WeakPolarHBondContact O-CA 3.14Å; L409-Y415 HydrophobicContact CD1-CE1 4.04Å; L409-Y415 HydrophobicContact CD2-CD1 3.78Å; L409-Y415 HydrophobicContact CD2-CD2 3.82Å; L409-Y415 HydrophobicContact CD2-CE1 3.75Å; L409-Y415 HydrophobicContact CD2-CE2 3.8Å; L409-Y415 HydrophobicContact CD2-CG 3.82Å; L409-Y415 HydrophobicContact CG-CD1 3.8Å; L409-Y415 HydrophobicContact CG-CE1 3.56Å; L409-Y415 HydrophobicContact CG-CE2 4.48Å; L409-Y415 HydrophobicContact CG-CG 4.36Å
416	K	80.3	Confident	87.9	Confident	94 Å²	94	55.1 Å²	55.1	41%	0.409	28%	0.281	S	S	.	.			trans	-154.5	137.3	-175.6	-70.8	-178.7	177.4	165.1	0	110.3	Q370 S408 D410 Q414	Q370-K416 PolarHBondContact NE2-O 2.84Å; S408-K416 CarbonylContact O-C 3.27Å; S408-K416 PolarHBondContact O-N 3.01Å; D410-K416 HydrophobicContact CB-CB 4.37Å; Q414-K416 HydrophobicContact CB-CD 4.26Å; Q414-K416 HydrophobicContact CB-CG 4.36Å; Q414-K416 PolarHBondContact O-N 3.2Å
417	G	84.6	Confident	88	Confident	4 Å²	4	52.5 Å²	52.5	4%	0.041	27%	0.271	C	S	.	.	S	Bend	trans	96	171.3	180	0	0	0	0	0	113.5	Q370 D403 S408	Q370-G417 CarbonylContact O-C 3.27Å; Q370-G417 WeakPolarHBondContact O-CA 3.16Å; D403-G417 WeakPolarHBondContact CA-O 3.21Å; D403-G417 WeakPolarHBondContact OD1-CA 3.43Å; S408-G417 WeakPolarHBondContact CB-O 3.14Å
418	G	89.7	Confident	88	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.253	C	S	.	.			trans	-109.4	6.5	-175.8	0	0	0	0	0	114.8	Q370 D399 V420	Q370-G418 PolarHBondContact O-N 3.46Å; D399-G418 PolarHBondContact N-O 2.04Å; D399-G418 WeakPolarHBondContact O-CA 3.05Å; G418-V420 PolarHBondContact O-N 3.11Å; G418-V420 VanDerWaalsContact O-N 3.12Å
419	G	91.7	Very high	87.9	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	113.4	-175.3	0	0	0	0	0	112.4	Q370 S408	Q370-G419 PolarHBondContact O-N 3.07Å; S408-G419 VanDerWaalsContact CB-O 3.26Å; S408-G419 WeakPolarHBondContact CB-O 3.33Å; S408-G419 PolarHBondContact OG-O 2.87Å
420	V	93.9	Very high	87.9	Confident	25 Å²	25	52.3 Å²	52.3	15%	0.152	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	114.5	174.1	179.3	0	0	0	0	108.8	C396 E397 D399 V402 G418 I431	C396-V420 CarbonylContact C-O 3.5Å; C396-V420 WeakPolarHBondContact CA-O 3.07Å; C396-V420 WeakPolarHBondContact CB-O 3.26Å; E397-V420 PolarHBondContact N-O 2.93Å; E397-V420 PolarHBondContact O-N 3.35Å; D399-V420 HydrophobicContact CB-CG2 3.58Å; V402-V420 HydrophobicContact CB-CG2 4.19Å; V402-V420 HydrophobicContact CG1-CG2 4.18Å; V402-V420 HydrophobicContact CG2-CG2 3.73Å; G418-V420 PolarHBondContact O-N 3.11Å; G418-V420 VanDerWaalsContact O-N 3.12Å; V420-I431 HydrophobicContact CG2-CG2 4.28Å
421	C	94.4	Very high	88.1	Confident	9 Å²	9	54.1 Å²	54.1	6%	0.061	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	132.6	177.7	-60	0	0	0	0	111.2	C389 E395 I431 C433	C389-C421 WeakPolarHBondContact CA-SG 3.3Å; C389-C421 HydrophobicContact CB-CB 3.88Å; C389-C421 WeakPolarHBondContact CB-SG 3.04Å; C389-C421 WeakPolarHBondContact SG-CB 2.99Å; C389-C421 CovalentContact SG-SG 2.03Å; C389-C421 PolarHBondContact SG-SG 3.44Å; E395-C421 WeakPolarHBondContact O-CA 3.24Å; C421-I431 WeakPolarHBondContact CB-O 3.05Å; C421-I431 PolarHBondContact N-O 2.03Å; C421-I431 PolarHBondContact SG-O 3Å; C421-C433 VanDerWaalsContact CB-SG 3.51Å
422	K	91.8	Very high	88.5	Confident	73 Å²	73	50.2 Å²	50.2	32%	0.317	27%	0.272	S	S	.	.			trans	-96.1	159.3	173.5	-53.4	-57.1	-179.4	175.5	0	109.4	S393 E395 E397 C424	S393-K422 WeakPolarHBondContact CB-O 3.18Å; S393-K422 PolarHBondContact OG-O 2.05Å; E395-K422 HydrophobicContact CB-CB 4.14Å; E395-K422 PolarHBondContact O-N 3.28Å; E397-K422 WeakPolarHBondContact OE2-CE 3.09Å; E397-K422 IonicContact OE2-NZ 3.42Å; E397-K422 PolarHBondContact OE2-NZ 3.4Å; K422-C424 VanDerWaalsContact C-N 3.3Å; K422-C424 PolarHBondContact O-N 2.83Å; K422-C424 VanDerWaalsContact O-N 3.12Å
423	N	87.7	Confident	88.9	Confident	132 Å²	132	43.8 Å²	43.8	71%	0.706	24%	0.243	S	C	*	.	S	Bend	trans	54.5	35	167.5	-62.8	-34.4	0	0	0	116.1	E395 G425	E395-N423 PolarHBondContact OE2-ND2 3.47Å; N423-G425 PolarHBondContact O-N 2.74Å
424	C	90.7	Very high	89.3	Confident	19 Å²	19	42.9 Å²	42.9	13%	0.128	23%	0.225	C	C	.	.			trans	-50	113.2	179.8	-64.3	0	0	0	0	113.6	K422 T428 C433 K437	K422-C424 VanDerWaalsContact C-N 3.3Å; K422-C424 PolarHBondContact O-N 2.83Å; K422-C424 VanDerWaalsContact O-N 3.12Å; C424-T428 WeakPolarHBondContact CB-O 3.34Å; C424-C433 VanDerWaalsContact CA-SG 3.58Å; C424-C433 HydrophobicContact CB-CB 3.76Å; C424-C433 WeakPolarHBondContact CB-SG 3.34Å; C424-C433 VanDerWaalsContact SG-CA 3.52Å; C424-C433 WeakPolarHBondContact SG-CB 3.44Å; C424-C433 CovalentContact SG-SG 2.04Å; C424-C433 PolarHBondContact SG-SG 2.87Å; C424-K437 PolarHBondContact O-NZ 2.71Å
425	G	86.5	Confident	89.5	Confident	27 Å²	27	41.3 Å²	41.3	28%	0.278	22%	0.222	S	C	.	.			trans	-78.8	-164.8	174.8	0	0	0	0	0	113.4	H392 N423 N427 T428	H392-G425 PolarHBondContact O-N 2.87Å; N423-G425 PolarHBondContact O-N 2.74Å; G425-N427 PolarHBondContact O-N 2.73Å; G425-T428 PolarHBondContact O-N 2.87Å; G425-T428 PolarHBondContact O-OG1 3.35Å
426	H	89.6	Confident	89.6	Confident	71 Å²	71	36 Å²	36	33%	0.329	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.3	27.3	169.8	-52	127.4	0	0	0	115.3	H392 T428 L451	H392-H426 AromaticContact CG-ND1 3.83Å; H392-H426 WeakPolarHBondContact ND1-CB 3.31Å; H392-H426 AromaticContact ND1-CG 3.57Å; H392-H426 AromaticContact ND1-ND1 3.15Å; H392-H426 PolarHBondContact ND1-ND1 3.19Å; H392-H426 VanDerWaalsContact ND1-ND1 3.15Å; H426-T428 HydrophobicContact CB-CG2 4.43Å; H426-T428 PolarHBondContact O-N 2.86Å; H426-L451 WeakPolarHBondContact CB-O 3.23Å; H426-L451 PolarHBondContact CD2-O 3.21Å; H426-L451 VanDerWaalsContact CD2-O 3.28Å; H426-L451 VanDerWaalsContact CE1-CD2 3.44Å; H426-L451 WeakPolarHBondContact CE1-CD2 3.5Å
427	N	88.4	Confident	89.8	Confident	71 Å²	71	35.3 Å²	35.3	38%	0.38	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	25.7	-173.4	-54.8	-48.2	0	0	0	115.2	G425 K437 F440 C454	G425-N427 PolarHBondContact O-N 2.73Å; N427-K437 WeakPolarHBondContact O-CG 3.37Å; N427-K437 PolarHBondContact O-N 3.32Å; N427-F440 HydrophobicContact CB-CD1 3.7Å; N427-F440 HydrophobicContact CB-CD2 4.27Å; N427-F440 HydrophobicContact CB-CE1 3.69Å; N427-F440 HydrophobicContact CB-CE2 4.25Å; N427-F440 HydrophobicContact CB-CG 4.02Å; N427-F440 HydrophobicContact CB-CZ 3.98Å; N427-F440 VanDerWaalsContact CG-CE1 3.42Å; N427-F440 WeakPolarHBondContact ND2-CE1 2.97Å; N427-C454 HydrophobicContact CB-CB 4.38Å
428	T	91	Very high	89.5	Confident	0 Å²	0	41 Å²	41	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	157.2	178.5	61	0	0	0	0	113.4	H392 C424 G425 H426 C433 T435 K437	H392-T428 VanDerWaalsContact CB-OG1 3.32Å; H392-T428 WeakPolarHBondContact CB-OG1 3.45Å; C424-T428 WeakPolarHBondContact CB-O 3.34Å; G425-T428 PolarHBondContact O-N 2.87Å; G425-T428 PolarHBondContact O-OG1 3.35Å; H426-T428 HydrophobicContact CB-CG2 4.43Å; H426-T428 PolarHBondContact O-N 2.86Å; T428-C433 VanDerWaalsContact CB-O 3.28Å; T428-C433 WeakPolarHBondContact CB-O 3.24Å; T428-C433 WeakPolarHBondContact OG1-CB 3.07Å; T428-T435 CarbonylContact C-O 3.59Å; T428-T435 WeakPolarHBondContact CA-O 3.01Å; T428-T435 WeakPolarHBondContact CB-O 3.48Å; T428-K437 WeakPolarHBondContact O-CE 3.3Å
429	T	90.4	Very high	89	Confident	59 Å²	59	42.7 Å²	42.7	36%	0.362	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	-179	177.9	-165.7	0	0	0	0	109.9	C433 E434 T435 K437	T429-C433 CarbonylContact O-C 3.42Å; T429-C433 VanDerWaalsContact O-C 3.29Å; T429-C433 WeakPolarHBondContact O-CA 3.43Å; T429-E434 PolarHBondContact O-N 3.5Å; T429-E434 VanDerWaalsContact O-N 3.12Å; T429-T435 VanDerWaalsContact C-OG1 3.23Å; T429-T435 VanDerWaalsContact CG2-OG1 3.28Å; T429-T435 WeakPolarHBondContact CG2-OG1 3.24Å; T429-T435 PolarHBondContact N-O 3.06Å; T429-T435 PolarHBondContact O-N 3.31Å; T429-T435 PolarHBondContact O-OG1 3.38Å; T429-K437 HydrophobicContact CG2-CG 4.18Å
430	G	89	Confident	88.8	Confident	29 Å²	29	44.9 Å²	44.9	30%	0.299	26%	0.263	S	S	.	.	S	Bend	trans	96.1	178.7	-170.8	0	0	0	0	0	112.3	N432 C433 E434	G430-N432 VanDerWaalsContact C-N 3.32Å; G430-N432 PolarHBondContact O-N 2.85Å; G430-C433 PolarHBondContact O-N 3.29Å; G430-E434 VanDerWaalsContact C-OE2 3.24Å; G430-E434 WeakPolarHBondContact CA-OE1 3.33Å; G430-E434 WeakPolarHBondContact CA-OE2 3.39Å
431	I	91.8	Very high	88.5	Confident	42 Å²	42	45 Å²	45	22%	0.215	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-34.8	-169.1	-68.9	171.1	0	0	0	111.8	V402 K407 V420 C421 E434	V402-I431 HydrophobicContact CG1-CD1 4.35Å; V402-I431 HydrophobicContact CG1-CG2 3.93Å; V402-I431 HydrophobicContact CG2-CD1 4.35Å; K407-I431 HydrophobicContact CB-CD1 3.65Å; V420-I431 HydrophobicContact CG2-CG2 4.28Å; C421-I431 WeakPolarHBondContact CB-O 3.05Å; C421-I431 PolarHBondContact N-O 2.03Å; C421-I431 PolarHBondContact SG-O 3Å; I431-E434 PolarHBondContact N-OE2 3.11Å
432	N	93.2	Very high	88.1	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.005	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111	14.1	-179	-64.1	106.1	0	0	0	111.6	N388 C389 F390 S408 L409 G430 E434	N388-N432 WeakPolarHBondContact O-CA 3.34Å; N388-N432 WeakPolarHBondContact O-CB 3.28Å; N388-N432 PolarHBondContact O-ND2 3.32Å; C389-N432 CarbonylContact C-O 3.48Å; C389-N432 VanDerWaalsContact C-O 3.23Å; C389-N432 VanDerWaalsContact CA-O 3.32Å; C389-N432 WeakPolarHBondContact CA-O 3.42Å; F390-N432 HydrophobicContact CD2-CB 4.19Å; F390-N432 WeakPolarHBondContact CD2-O 3.34Å; F390-N432 HydrophobicContact CE2-CB 3.98Å; S408-N432 WeakPolarHBondContact CA-OD1 3.47Å; S408-N432 PolarHBondContact OG-ND2 3.31Å; L409-N432 HydrophobicContact CD1-CB 4.42Å; L409-N432 PolarHBondContact N-ND2 2.91Å; L409-N432 PolarHBondContact N-OD1 3.3Å; L409-N432 PolarHBondContact O-ND2 3.39Å; G430-N432 VanDerWaalsContact C-N 3.32Å; G430-N432 PolarHBondContact O-N 2.85Å; N432-E434 WeakPolarHBondContact CA-OE2 3.07Å; N432-E434 HydrophobicContact CB-CB 4.22Å; N432-E434 PolarHBondContact N-OE2 3.27Å; N432-E434 PolarHBondContact O-N 3Å
433	C	92.6	Very high	87.5	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	26%	0.262	C	S	.	.	S	Bend	trans	57.1	33.6	-166.2	-49.5	0	0	0	0	112.6	H392 C421 C424 T428 T429 G430	H392-C433 HydrophobicContact CB-CB 3.72Å; H392-C433 PolarHBondContact CD2-O 2.97Å; H392-C433 VanDerWaalsContact CD2-O 3.25Å; C421-C433 VanDerWaalsContact CB-SG 3.51Å; C424-C433 VanDerWaalsContact CA-SG 3.58Å; C424-C433 HydrophobicContact CB-CB 3.76Å; C424-C433 WeakPolarHBondContact CB-SG 3.34Å; C424-C433 VanDerWaalsContact SG-CA 3.52Å; C424-C433 WeakPolarHBondContact SG-CB 3.44Å; C424-C433 CovalentContact SG-SG 2.04Å; C424-C433 PolarHBondContact SG-SG 2.87Å; T428-C433 VanDerWaalsContact CB-O 3.28Å; T428-C433 WeakPolarHBondContact CB-O 3.24Å; T428-C433 WeakPolarHBondContact OG1-CB 3.07Å; T429-C433 CarbonylContact O-C 3.42Å; T429-C433 VanDerWaalsContact O-C 3.29Å; T429-C433 WeakPolarHBondContact O-CA 3.43Å; G430-C433 PolarHBondContact O-N 3.29Å
434	E	88	Confident	86.9	Confident	31 Å²	31	43.4 Å²	43.4	15%	0.145	27%	0.269	C	S	.	.			trans	-89.9	-15.6	-168.7	77.8	-63.2	158.5	0	0	115.2	F390 T429 G430 I431 N432 R442	F390-E434 HydrophobicContact CD2-CB 3.94Å; F390-E434 HydrophobicContact CE2-CB 3.69Å; T429-E434 PolarHBondContact O-N 3.5Å; T429-E434 VanDerWaalsContact O-N 3.12Å; G430-E434 VanDerWaalsContact C-OE2 3.24Å; G430-E434 WeakPolarHBondContact CA-OE1 3.33Å; G430-E434 WeakPolarHBondContact CA-OE2 3.39Å; I431-E434 PolarHBondContact N-OE2 3.11Å; N432-E434 WeakPolarHBondContact CA-OE2 3.07Å; N432-E434 HydrophobicContact CB-CB 4.22Å; N432-E434 PolarHBondContact N-OE2 3.27Å; N432-E434 PolarHBondContact O-N 3Å; E434-R442 VanDerWaalsContact O-CZ 3.29Å; E434-R442 PolarHBondContact O-NH1 3.45Å; E434-R442 PolarHBondContact O-NH2 3.48Å
435	T	88.3	Confident	86	Confident	57 Å²	57	46.3 Å²	46.3	35%	0.35	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	169.3	178.7	62.7	0	0	0	0	111.6	T428 T429	T428-T435 CarbonylContact C-O 3.59Å; T428-T435 WeakPolarHBondContact CA-O 3.01Å; T428-T435 WeakPolarHBondContact CB-O 3.48Å; T429-T435 VanDerWaalsContact C-OG1 3.23Å; T429-T435 VanDerWaalsContact CG2-OG1 3.28Å; T429-T435 WeakPolarHBondContact CG2-OG1 3.24Å; T429-T435 PolarHBondContact N-O 3.06Å; T429-T435 PolarHBondContact O-N 3.31Å; T429-T435 PolarHBondContact O-OG1 3.38Å
436	C	87.9	Confident	85.5	Confident	12 Å²	12	50 Å²	50	8%	0.081	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	145.3	175.4	-59.6	0	0	0	0	111.2	F440 F441 C454	C436-F440 HydrophobicContact CB-CB 3.97Å; C436-F440 VanDerWaalsContact CB-O 3.27Å; C436-F440 WeakPolarHBondContact CB-O 3.32Å; C436-F441 VanDerWaalsContact SG-C 3.56Å; C436-C454 WeakPolarHBondContact CA-SG 3.49Å; C436-C454 HydrophobicContact CB-CB 3.72Å; C436-C454 WeakPolarHBondContact CB-SG 3.12Å; C436-C454 WeakPolarHBondContact SG-CB 3.11Å; C436-C454 CovalentContact SG-SG 2.04Å; C436-C454 PolarHBondContact SG-SG 3.43Å
437	K	84.6	Confident	85.1	Confident	79 Å²	79	53.6 Å²	53.6	34%	0.343	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-62.2	148	170.4	-67.8	178.2	-163.4	-175.8	0	109.6	C424 N427 T428 T429 G439 F440	C424-K437 PolarHBondContact O-NZ 2.71Å; N427-K437 WeakPolarHBondContact O-CG 3.37Å; N427-K437 PolarHBondContact O-N 3.32Å; T428-K437 WeakPolarHBondContact O-CE 3.3Å; T429-K437 HydrophobicContact CG2-CG 4.18Å; K437-G439 PolarHBondContact O-N 2.73Å; K437-F440 HydrophobicContact CB-CD2 4.43Å; K437-F440 WeakPolarHBondContact O-CB 3.28Å; K437-F440 PolarHBondContact O-N 2.9Å
438	P	78.9	Confident	84.8	Confident	124 Å²	124	54.7 Å²	54.7	81%	0.805	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.2	138.4	176.6	-28.7	35.9	0	0	0	112.4
439	G	78.2	Confident	84.5	Confident	36 Å²	36	59.7 Å²	59.7	37%	0.371	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.6	-1.1	-170.4	0	0	0	0	0	114.9	K437 P456 C457	K437-G439 PolarHBondContact O-N 2.73Å; G439-P456 WeakPolarHBondContact O-CA 3.47Å; G439-C457 PolarHBondContact O-N 2.71Å
440	F	88.1	Confident	84.1	Confident	45 Å²	45	58.2 Å²	58.2	20%	0.197	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	147.8	173.9	-62.2	-107.2	0	0	0	111.3	N427 C436 K437 C454 I455 P456	N427-F440 HydrophobicContact CB-CD1 3.7Å; N427-F440 HydrophobicContact CB-CD2 4.27Å; N427-F440 HydrophobicContact CB-CE1 3.69Å; N427-F440 HydrophobicContact CB-CE2 4.25Å; N427-F440 HydrophobicContact CB-CG 4.02Å; N427-F440 HydrophobicContact CB-CZ 3.98Å; N427-F440 VanDerWaalsContact CG-CE1 3.42Å; N427-F440 WeakPolarHBondContact ND2-CE1 2.97Å; C436-F440 HydrophobicContact CB-CB 3.97Å; C436-F440 VanDerWaalsContact CB-O 3.27Å; C436-F440 WeakPolarHBondContact CB-O 3.32Å; K437-F440 HydrophobicContact CB-CD2 4.43Å; K437-F440 WeakPolarHBondContact O-CB 3.28Å; K437-F440 PolarHBondContact O-N 2.9Å; F440-C454 HydrophobicContact CB-CB 4.16Å; F440-I455 CarbonylContact C-O 3.39Å; F440-I455 WeakPolarHBondContact CA-O 3.3Å; F440-I455 WeakPolarHBondContact CB-O 3.34Å; F440-I455 VanDerWaalsContact CD1-C 3.47Å; F440-P456 HydrophobicContact CD1-CG 4.08Å; F440-P456 HydrophobicContact CE1-CB 4.46Å; F440-P456 HydrophobicContact CE1-CG 3.71Å; F440-P456 HydrophobicContact CZ-CG 4.41Å
441	F	86.7	Confident	83.6	Confident	28 Å²	28	62.7 Å²	62.7	12%	0.123	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	162.2	175.2	78	-76.9	0	0	0	111.6	C436 P443 C454 I455	C436-F441 VanDerWaalsContact SG-C 3.56Å; F441-P443 HydrophobicContact CD2-CG 4.47Å; F441-P443 HydrophobicContact CE2-CB 4.27Å; F441-P443 HydrophobicContact CE2-CG 3.95Å; F441-P443 HydrophobicContact CZ-CG 4.27Å; F441-P443 WeakPolarHBondContact O-CD 3.26Å; F441-C454 WeakPolarHBondContact O-CA 3.32Å; F441-I455 HydrophobicContact CD1-CG1 4.08Å; F441-I455 HydrophobicContact CE1-CD1 3.92Å; F441-I455 HydrophobicContact CE1-CG1 3.65Å; F441-I455 HydrophobicContact CZ-CD1 3.86Å; F441-I455 HydrophobicContact CZ-CG1 3.98Å; F441-I455 PolarHBondContact N-O 2.83Å; F441-I455 PolarHBondContact O-N 2.85Å
442	R	86.4	Confident	83.2	Confident	46 Å²	46	64 Å²	64	17%	0.174	36%	0.362	C	S	.	.			trans	-100.5	110.6	175.1	177.9	172	-67.7	129.4	-6.5	109.7	E434 A444 R446 A453 L470	E434-R442 VanDerWaalsContact O-CZ 3.29Å; E434-R442 PolarHBondContact O-NH1 3.45Å; E434-R442 PolarHBondContact O-NH2 3.48Å; R442-A444 PolarHBondContact O-N 2.9Å; R442-R446 HydrophobicContact CG-CB 4.18Å; R442-A453 WeakPolarHBondContact CA-O 2.99Å; R442-A453 WeakPolarHBondContact CB-O 3.49Å; R442-A453 WeakPolarHBondContact CG-O 3.4Å; R442-L470 PolarHBondContact N-O 3.38Å
443	P	80.5	Confident	82.6	Confident	33 Å²	33	63.9 Å²	63.9	21%	0.214	36%	0.362	C	S	.	.			trans	-61.5	136.6	178.5	-24	34.6	0	0	0	112.1	F441 G445 R446 I455	F441-P443 HydrophobicContact CD2-CG 4.47Å; F441-P443 HydrophobicContact CE2-CB 4.27Å; F441-P443 HydrophobicContact CE2-CG 3.95Å; F441-P443 HydrophobicContact CZ-CG 4.27Å; F441-P443 WeakPolarHBondContact O-CD 3.26Å; P443-G445 PolarHBondContact O-N 2.82Å; P443-R446 HydrophobicContact CB-CG 4.29Å; P443-R446 HydrophobicContact CG-CG 4.37Å; P443-R446 WeakPolarHBondContact O-CB 3.44Å; P443-R446 PolarHBondContact O-N 2.92Å; P443-I455 HydrophobicContact CG-CD1 3.49Å; P443-I455 VanDerWaalsContact CG-CD1 3.49Å; P443-I455 HydrophobicContact CG-CG1 3.69Å
444	A	73.4	Confident	82.4	Confident	102 Å²	102	64.1 Å²	64.1	84%	0.843	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	113	178.8	0	0	0	0	0	112.1	R442	R442-A444 PolarHBondContact O-N 2.9Å
445	G	73.4	Confident	82.3	Confident	79 Å²	79	65.3 Å²	65.3	81%	0.814	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	104.2	-6.9	-178.1	0	0	0	0	0	115.8	P443	P443-G445 PolarHBondContact O-N 2.82Å
446	R	76.3	Confident	82.1	Confident	105 Å²	105	66.1 Å²	66.1	40%	0.396	38%	0.376	S	S	.	.			trans	-70.4	129.9	163.3	-78.9	-68.4	-173.9	160.9	11.2	109.9	R442 P443 S450 D452	R442-R446 HydrophobicContact CG-CB 4.18Å; P443-R446 HydrophobicContact CB-CG 4.29Å; P443-R446 HydrophobicContact CG-CG 4.37Å; P443-R446 WeakPolarHBondContact O-CB 3.44Å; P443-R446 PolarHBondContact O-N 2.92Å; R446-S450 PolarHBondContact NH1-OG 3.38Å; R446-S450 VanDerWaalsContact NH1-OG 3.12Å; R446-D452 VanDerWaalsContact CZ-CG 3.44Å; R446-D452 IonicContact CZ-OD1 3.94Å; R446-D452 IonicContact CZ-OD2 2.64Å; R446-D452 IonicContact NH1-OD1 2.75Å; R446-D452 PolarHBondContact NH1-OD1 3.11Å; R446-D452 IonicContact NH1-OD2 3.45Å; R446-D452 PolarHBondContact NH1-OD2 2.81Å; R446-D452 IonicContact NH2-OD1 3.75Å; R446-D452 IonicContact NH2-OD2 3.95Å; R446-D452 PolarHBondContact NH2-OD2 2.96Å
447	Q	80.2	Confident	81.8	Confident	147 Å²	147	66.6 Å²	66.6	69%	0.687	38%	0.38	S	S	*	.			trans	-73.7	160.5	171.9	-63.7	-164.3	-33.2	0	0	110.2	E449 S450 A453	Q447-E449 VanDerWaalsContact C-N 3.33Å; Q447-E449 WeakPolarHBondContact CB-OE2 3.18Å; Q447-S450 WeakPolarHBondContact O-CB 3.41Å; Q447-A453 WeakPolarHBondContact O-CB 3.48Å
448	R	82.8	Confident	81.7	Confident	93 Å²	93	70.5 Å²	70.5	35%	0.351	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-40.7	-174.4	-67.4	-175.9	176.7	-166.9	-2.2	110.1	F390 H392 S450 A453	F390-R448 HydrophobicContact CB-CB 4.37Å; F390-R448 HydrophobicContact CD1-CB 3.61Å; F390-R448 HydrophobicContact CD2-CB 4.35Å; F390-R448 HydrophobicContact CE1-CB 3.94Å; F390-R448 HydrophobicContact CE1-CG 4.46Å; F390-R448 HydrophobicContact CG-CB 3.85Å; F390-R448 HydrophobicContact CZ-CB 4.47Å; H392-R448 PolarHBondContact CE1-O 3.41Å; H392-R448 PolarHBondContact NE2-O 3.49Å; R448-S450 PolarHBondContact O-N 2.77Å; R448-A453 VanDerWaalsContact O-CB 3.28Å; R448-A453 WeakPolarHBondContact O-CB 3.1Å
449	E	84.1	Confident	81.8	Confident	105 Å²	105	65.3 Å²	65.3	49%	0.491	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	0.9	-177.4	-54.5	73.6	-167	0	0	114.7	F390 Q447	F390-E449 HydrophobicContact CD1-CG 4.02Å; F390-E449 VanDerWaalsContact CD1-OE1 3.26Å; F390-E449 WeakPolarHBondContact CD1-OE1 3.48Å; F390-E449 WeakPolarHBondContact CE1-OE1 3.3Å; F390-E449 WeakPolarHBondContact O-CA 3.29Å; Q447-E449 VanDerWaalsContact C-N 3.33Å; Q447-E449 WeakPolarHBondContact CB-OE2 3.18Å
450	S	82.3	Confident	81.4	Confident	28 Å²	28	71.5 Å²	71.5	20%	0.196	39%	0.39	C	S	.	.			trans	-81.2	131.4	-175.9	-148.3	0	0	0	0	110.2	H392 R446 Q447 R448 D452 A453	H392-S450 PolarHBondContact CE1-O 2.98Å; R446-S450 PolarHBondContact NH1-OG 3.38Å; R446-S450 VanDerWaalsContact NH1-OG 3.12Å; Q447-S450 WeakPolarHBondContact O-CB 3.41Å; R448-S450 PolarHBondContact O-N 2.77Å; S450-D452 WeakPolarHBondContact CB-OD1 3.46Å; S450-D452 PolarHBondContact O-N 2.85Å; S450-D452 PolarHBondContact OG-OD1 2.84Å; S450-A453 WeakPolarHBondContact O-CB 3.18Å; S450-A453 PolarHBondContact O-N 3.33Å
451	L	78.8	Confident	80.6	Confident	124 Å²	124	71.1 Å²	71.1	65%	0.649	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-14.5	177	-53.4	177.1	0	0	0	113.6	H426	H426-L451 WeakPolarHBondContact CB-O 3.23Å; H426-L451 PolarHBondContact CD2-O 3.21Å; H426-L451 VanDerWaalsContact CD2-O 3.28Å; H426-L451 VanDerWaalsContact CE1-CD2 3.44Å; H426-L451 WeakPolarHBondContact CE1-CD2 3.5Å
452	D	82.1	Confident	79.9	Confident	68 Å²	68	75 Å²	75	36%	0.364	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.3	31.6	-179.5	57.1	-7.2	0	0	0	111.3	R446 S450 C454	R446-D452 VanDerWaalsContact CZ-CG 3.44Å; R446-D452 IonicContact CZ-OD1 3.94Å; R446-D452 IonicContact CZ-OD2 2.64Å; R446-D452 IonicContact NH1-OD1 2.75Å; R446-D452 PolarHBondContact NH1-OD1 3.11Å; R446-D452 IonicContact NH1-OD2 3.45Å; R446-D452 PolarHBondContact NH1-OD2 2.81Å; R446-D452 IonicContact NH2-OD1 3.75Å; R446-D452 IonicContact NH2-OD2 3.95Å; R446-D452 PolarHBondContact NH2-OD2 2.96Å; S450-D452 WeakPolarHBondContact CB-OD1 3.46Å; S450-D452 PolarHBondContact O-N 2.85Å; S450-D452 PolarHBondContact OG-OD1 2.84Å; D452-C454 PolarHBondContact O-N 3.46Å
453	A	82.1	Confident	79.7	Confident	0 Å²	0	76.3 Å²	76.3	0%	0	43%	0.428	C	S	.	.	S	Bend	trans	-65	-17.6	177.9	0	0	0	0	0	114	R442 Q447 R448 S450	R442-A453 WeakPolarHBondContact CA-O 2.99Å; R442-A453 WeakPolarHBondContact CB-O 3.49Å; R442-A453 WeakPolarHBondContact CG-O 3.4Å; Q447-A453 WeakPolarHBondContact O-CB 3.48Å; R448-A453 VanDerWaalsContact O-CB 3.28Å; R448-A453 WeakPolarHBondContact O-CB 3.1Å; S450-A453 WeakPolarHBondContact O-CB 3.18Å; S450-A453 PolarHBondContact O-N 3.33Å
454	C	88.3	Confident	79.8	Confident	5 Å²	5	78 Å²	78	3%	0.034	43%	0.432	C	S	.	.			trans	-128.5	118.9	179.6	-68.7	0	0	0	0	109.9	N427 C436 F440 F441 D452	N427-C454 HydrophobicContact CB-CB 4.38Å; C436-C454 WeakPolarHBondContact CA-SG 3.49Å; C436-C454 HydrophobicContact CB-CB 3.72Å; C436-C454 WeakPolarHBondContact CB-SG 3.12Å; C436-C454 WeakPolarHBondContact SG-CB 3.11Å; C436-C454 CovalentContact SG-SG 2.04Å; C436-C454 PolarHBondContact SG-SG 3.43Å; F440-C454 HydrophobicContact CB-CB 4.16Å; F441-C454 WeakPolarHBondContact O-CA 3.32Å; D452-C454 PolarHBondContact O-N 3.46Å
455	I	85.1	Confident	79.9	Confident	55 Å²	55	77.4 Å²	77.4	28%	0.282	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	154	179.5	69.2	169.5	0	0	0	110.8	F440 F441 P443	F440-I455 CarbonylContact C-O 3.39Å; F440-I455 WeakPolarHBondContact CA-O 3.3Å; F440-I455 WeakPolarHBondContact CB-O 3.34Å; F440-I455 VanDerWaalsContact CD1-C 3.47Å; F441-I455 HydrophobicContact CD1-CG1 4.08Å; F441-I455 HydrophobicContact CE1-CD1 3.92Å; F441-I455 HydrophobicContact CE1-CG1 3.65Å; F441-I455 HydrophobicContact CZ-CD1 3.86Å; F441-I455 HydrophobicContact CZ-CG1 3.98Å; F441-I455 PolarHBondContact N-O 2.83Å; F441-I455 PolarHBondContact O-N 2.85Å; P443-I455 HydrophobicContact CG-CD1 3.49Å; P443-I455 VanDerWaalsContact CG-CD1 3.49Å; P443-I455 HydrophobicContact CG-CG1 3.69Å
456	P	84	Confident	79.8	Confident	75 Å²	75	75.8 Å²	75.8	49%	0.487	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	145.3	-178.6	-23.5	33.3	0	0	0	113.6	G439 F440	G439-P456 WeakPolarHBondContact O-CA 3.47Å; F440-P456 HydrophobicContact CD1-CG 4.08Å; F440-P456 HydrophobicContact CE1-CB 4.46Å; F440-P456 HydrophobicContact CE1-CG 3.71Å; F440-P456 HydrophobicContact CZ-CG 4.41Å
457	C	82.5	Confident	79.6	Confident	22 Å²	22	72.8 Å²	72.8	15%	0.149	39%	0.393	C	S	.	.			trans	-60.2	139.3	164.9	-66.1	0	0	0	0	110.6	G439 C468	G439-C457 PolarHBondContact O-N 2.71Å; C457-C468 HydrophobicContact CB-CB 3.77Å; C457-C468 WeakPolarHBondContact CB-SG 3.37Å; C457-C468 WeakPolarHBondContact SG-CB 3.41Å; C457-C468 PolarHBondContact SG-N 3.03Å; C457-C468 VanDerWaalsContact SG-N 3.45Å; C457-C468 CovalentContact SG-SG 2.04Å; C457-C468 PolarHBondContact SG-SG 3.13Å
458	Q	82.5	Confident	79.7	Confident	160 Å²	160	66.3 Å²	66.3	75%	0.748	36%	0.364	S	S	*	.			trans	-107.2	71.2	-180	-67.7	-174.7	-11.3	0	0	110.5
459	C	79.1	Confident	79.4	Confident	16 Å²	16	64.5 Å²	64.5	11%	0.108	36%	0.361	C	S	.	.			trans	-116.6	42.7	-167.2	-58.3	0	0	0	0	113.3	S461 F464 C475	C459-S461 PolarHBondContact O-N 2.97Å; C459-F464 HydrophobicContact CB-CB 4.33Å; C459-F464 HydrophobicContact CB-CD2 4.41Å; C459-C475 WeakPolarHBondContact CA-SG 3.44Å; C459-C475 HydrophobicContact CB-CB 3.83Å; C459-C475 WeakPolarHBondContact CB-SG 3.48Å; C459-C475 WeakPolarHBondContact SG-CB 3.45Å; C459-C475 CovalentContact SG-SG 2.03Å; C459-C475 PolarHBondContact SG-SG 3.29Å
460	D	69.8	Low	78.7	Confident	165 Å²	165	64.4 Å²	64.4	88%	0.882	36%	0.364	S	S	*	.			trans	-71.9	32.2	-170.9	-52.5	-34.1	0	0	0	115
461	S	71.8	Confident	78	Confident	38 Å²	38	70.8 Å²	70.8	27%	0.266	39%	0.39	S	S	.	.	S	Bend	trans	-134	134.6	-172.8	150.5	0	0	0	0	111.5	C459 F463 F464	C459-S461 PolarHBondContact O-N 2.97Å; S461-F463 PolarHBondContact O-N 2.71Å; S461-F463 WeakPolarHBondContact OG-CD2 3.49Å; S461-F463 PolarHBondContact OG-N 2.72Å; S461-F464 PolarHBondContact O-N 3.11Å
462	P	72.5	Confident	77.9	Confident	108 Å²	108	69.2 Å²	69.2	70%	0.701	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-2.9	-174.6	31.5	-37.9	0	0	0	114.6	F464	P462-F464 VanDerWaalsContact C-N 3.31Å
463	F	81.6	Confident	77.5	Confident	75 Å²	75	66.9 Å²	66.9	33%	0.329	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-12.5	171	-56.3	-66	0	0	0	112.9	S461 C477 A478 F481 C486 F496 P497	S461-F463 PolarHBondContact O-N 2.71Å; S461-F463 WeakPolarHBondContact OG-CD2 3.49Å; S461-F463 PolarHBondContact OG-N 2.72Å; F463-C477 WeakPolarHBondContact O-CA 3.44Å; F463-A478 PolarHBondContact O-N 2.84Å; F463-F481 HydrophobicContact CB-CD2 4.4Å; F463-F481 HydrophobicContact CB-CE2 4.47Å; F463-F481 HydrophobicContact CD1-CD1 4.26Å; F463-F481 HydrophobicContact CD1-CD2 4.3Å; F463-F481 AromaticContact CD1-CE1 3.84Å; F463-F481 HydrophobicContact CD1-CE1 3.84Å; F463-F481 AromaticContact CD1-CE2 3.89Å; F463-F481 HydrophobicContact CD1-CE2 3.89Å; F463-F481 HydrophobicContact CD1-CG 4.48Å; F463-F481 AromaticContact CD1-CZ 3.65Å; F463-F481 HydrophobicContact CD1-CZ 3.65Å; F463-F481 HydrophobicContact CE1-CE1 4.17Å; F463-F481 HydrophobicContact CE1-CZ 4.12Å; F463-C486 HydrophobicContact CB-CB 4.04Å; F463-F496 HydrophobicContact CE1-CZ 4.41Å; F463-P497 HydrophobicContact CE1-CB 4.14Å
464	F	82.8	Confident	77.2	Confident	68 Å²	68	72.8 Å²	72.8	30%	0.298	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	156.9	179.8	-52.2	-54.1	0	0	0	112	C459 S461 P462 G466 C475 H476	C459-F464 HydrophobicContact CB-CB 4.33Å; C459-F464 HydrophobicContact CB-CD2 4.41Å; S461-F464 PolarHBondContact O-N 3.11Å; P462-F464 VanDerWaalsContact C-N 3.31Å; F464-G466 VanDerWaalsContact C-N 3.3Å; F464-G466 PolarHBondContact O-N 3.09Å; F464-C475 HydrophobicContact CB-CB 3.9Å; F464-C475 HydrophobicContact CD1-CB 3.54Å; F464-C475 HydrophobicContact CD2-CB 3.74Å; F464-C475 HydrophobicContact CE1-CB 3.94Å; F464-C475 HydrophobicContact CE2-CB 4.12Å; F464-C475 HydrophobicContact CG-CB 3.44Å; F464-C475 VanDerWaalsContact CG-CB 3.44Å; F464-C475 HydrophobicContact CZ-CB 4.22Å; F464-H476 CarbonylContact C-O 2.97Å; F464-H476 WeakPolarHBondContact CA-O 3.42Å; F464-H476 WeakPolarHBondContact CB-O 3.41Å
465	D	75.5	Confident	76.9	Confident	89 Å²	89	73.3 Å²	73.3	48%	0.476	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	3.3	178.3	69.5	4	0	0	0	114.4	S467 H476 A478	D465-S467 VanDerWaalsContact C-N 3.27Å; D465-S467 VanDerWaalsContact CG-OG 3.31Å; D465-S467 PolarHBondContact O-N 3Å; D465-S467 WeakPolarHBondContact OD1-CA 3.5Å; D465-S467 VanDerWaalsContact OD1-CB 3.25Å; D465-S467 WeakPolarHBondContact OD1-CB 3.46Å; D465-S467 PolarHBondContact OD1-N 2.97Å; D465-S467 PolarHBondContact OD1-OG 2.98Å; D465-S467 PolarHBondContact OD2-OG 3.12Å; D465-H476 PolarHBondContact N-O 3.19Å; D465-A478 HydrophobicContact CB-CB 4.48Å
466	G	70.8	Confident	76.7	Confident	45 Å²	45	74.4 Å²	74.4	46%	0.464	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	83.3	-6.8	-176	0	0	0	0	0	114.7	F464	F464-G466 VanDerWaalsContact C-N 3.3Å; F464-G466 PolarHBondContact O-N 3.09Å
467	S	72.5	Confident	76.7	Confident	42 Å²	42	71.9 Å²	71.9	29%	0.294	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	163.8	172.7	84.8	0	0	0	0	111.9	D465 C475 H476	D465-S467 VanDerWaalsContact C-N 3.27Å; D465-S467 VanDerWaalsContact CG-OG 3.31Å; D465-S467 PolarHBondContact O-N 3Å; D465-S467 WeakPolarHBondContact OD1-CA 3.5Å; D465-S467 VanDerWaalsContact OD1-CB 3.25Å; D465-S467 WeakPolarHBondContact OD1-CB 3.46Å; D465-S467 PolarHBondContact OD1-N 2.97Å; D465-S467 PolarHBondContact OD1-OG 2.98Å; D465-S467 PolarHBondContact OD2-OG 3.12Å; S467-C475 WeakPolarHBondContact O-CA 3.47Å; S467-H476 PolarHBondContact O-N 3.15Å; S467-H476 VanDerWaalsContact O-N 3.12Å
468	C	82.6	Confident	76.4	Confident	11 Å²	11	71.5 Å²	71.5	7%	0.074	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	155.7	175.6	73.9	0	0	0	0	112.9	C457 L470 R474	C457-C468 HydrophobicContact CB-CB 3.77Å; C457-C468 WeakPolarHBondContact CB-SG 3.37Å; C457-C468 WeakPolarHBondContact SG-CB 3.41Å; C457-C468 PolarHBondContact SG-N 3.03Å; C457-C468 VanDerWaalsContact SG-N 3.45Å; C457-C468 CovalentContact SG-SG 2.04Å; C457-C468 PolarHBondContact SG-SG 3.13Å; C468-L470 PolarHBondContact O-N 2.67Å; C468-R474 CarbonylContact C-O 3.59Å; C468-R474 VanDerWaalsContact CA-O 3.23Å; C468-R474 WeakPolarHBondContact CA-O 3.49Å; C468-R474 WeakPolarHBondContact CB-O 3.48Å
469	D	75.8	Confident	76.1	Confident	55 Å²	55	69.9 Å²	69.9	29%	0.294	38%	0.381	S	S	.	.			trans	-51.5	122.2	172.7	-87.3	-14.2	0	0	0	111.7	E471 T472 G473 R474 H476	D469-E471 PolarHBondContact O-N 2.96Å; D469-T472 HydrophobicContact CB-CG2 4.23Å; D469-T472 WeakPolarHBondContact CB-OG1 3.3Å; D469-T472 PolarHBondContact O-N 2.62Å; D469-T472 PolarHBondContact OD2-OG1 2.87Å; D469-G473 PolarHBondContact O-N 2.92Å; D469-R474 HydrophobicContact CB-CB 4.34Å; D469-R474 PolarHBondContact N-O 2.92Å; D469-H476 IonicContact OD1-CD2 3.41Å; D469-H476 IonicContact OD1-CE1 2.68Å; D469-H476 IonicContact OD1-NE2 3.67Å; D469-H476 PolarHBondContact OD1-NE2 2.03Å
470	L	70.5	Confident	75.9	Confident	104 Å²	104	71.9 Å²	71.9	55%	0.545	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-23.8	-176.2	-63.7	173.1	0	0	0	114.7	R442 C468	R442-L470 PolarHBondContact N-O 3.38Å; C468-L470 PolarHBondContact O-N 2.67Å
471	E	67.3	Low	76.6	Confident	162 Å²	162	64.4 Å²	64.4	76%	0.757	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.4	-28.9	177.8	-60.7	-163.4	148.6	0	0	114.5	D469	D469-E471 PolarHBondContact O-N 2.96Å
472	T	76.4	Confident	77	Confident	91 Å²	91	67.1 Å²	67.1	56%	0.558	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.6	-21.5	-171.6	83.7	0	0	0	0	113.5	D469 R474	D469-T472 HydrophobicContact CB-CG2 4.23Å; D469-T472 WeakPolarHBondContact CB-OG1 3.3Å; D469-T472 PolarHBondContact O-N 2.62Å; D469-T472 PolarHBondContact OD2-OG1 2.87Å; T472-R474 PolarHBondContact O-N 2.95Å; T472-R474 WeakPolarHBondContact OG1-CB 3.41Å; T472-R474 PolarHBondContact OG1-N 3.24Å
473	G	74.3	Confident	77	Confident	19 Å²	19	66 Å²	66	20%	0.196	35%	0.349	C	S	.	.			trans	70.8	5.1	-170.7	0	0	0	0	0	114.2	D469 C475	D469-G473 PolarHBondContact O-N 2.92Å; G473-C475 PolarHBondContact O-N 2.64Å
474	R	76.8	Confident	76.2	Confident	123 Å²	123	66.2 Å²	66.2	46%	0.464	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-65.9	120.3	176	-175	-175.8	-171.3	123.1	13.9	109.8	C468 D469 T472 H476 P484 D485	C468-R474 CarbonylContact C-O 3.59Å; C468-R474 VanDerWaalsContact CA-O 3.23Å; C468-R474 WeakPolarHBondContact CA-O 3.49Å; C468-R474 WeakPolarHBondContact CB-O 3.48Å; D469-R474 HydrophobicContact CB-CB 4.34Å; D469-R474 PolarHBondContact N-O 2.92Å; T472-R474 PolarHBondContact O-N 2.95Å; T472-R474 WeakPolarHBondContact OG1-CB 3.41Å; T472-R474 PolarHBondContact OG1-N 3.24Å; R474-H476 PolarHBondContact O-CD2 3.27Å; R474-P484 PolarHBondContact NH2-O 3.16Å; R474-D485 IonicContact NH2-OD1 3.73Å; R474-D485 PolarHBondContact NH2-OD1 2.65Å; R474-D485 VanDerWaalsContact NH2-OD1 3.1Å
475	C	81.7	Confident	76	Confident	16 Å²	16	68.2 Å²	68.2	11%	0.108	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	139.9	174.2	-56.1	0	0	0	0	111.5	C459 F464 S467 G473	C459-C475 WeakPolarHBondContact CA-SG 3.44Å; C459-C475 HydrophobicContact CB-CB 3.83Å; C459-C475 WeakPolarHBondContact CB-SG 3.48Å; C459-C475 WeakPolarHBondContact SG-CB 3.45Å; C459-C475 CovalentContact SG-SG 2.03Å; C459-C475 PolarHBondContact SG-SG 3.29Å; F464-C475 HydrophobicContact CB-CB 3.9Å; F464-C475 HydrophobicContact CD1-CB 3.54Å; F464-C475 HydrophobicContact CD2-CB 3.74Å; F464-C475 HydrophobicContact CE1-CB 3.94Å; F464-C475 HydrophobicContact CE2-CB 4.12Å; F464-C475 HydrophobicContact CG-CB 3.44Å; F464-C475 VanDerWaalsContact CG-CB 3.44Å; F464-C475 HydrophobicContact CZ-CB 4.22Å; S467-C475 WeakPolarHBondContact O-CA 3.47Å; G473-C475 PolarHBondContact O-N 2.64Å
476	H	81	Confident	76.2	Confident	78 Å²	78	64.2 Å²	64.2	36%	0.361	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	140.2	177.4	-71.6	-160.9	0	0	0	109.9	F464 D465 S467 D469 R474	F464-H476 CarbonylContact C-O 2.97Å; F464-H476 WeakPolarHBondContact CA-O 3.42Å; F464-H476 WeakPolarHBondContact CB-O 3.41Å; D465-H476 PolarHBondContact N-O 3.19Å; S467-H476 PolarHBondContact O-N 3.15Å; S467-H476 VanDerWaalsContact O-N 3.12Å; D469-H476 IonicContact OD1-CD2 3.41Å; D469-H476 IonicContact OD1-CE1 2.68Å; D469-H476 IonicContact OD1-NE2 3.67Å; D469-H476 PolarHBondContact OD1-NE2 2.03Å; R474-H476 PolarHBondContact O-CD2 3.27Å
477	C	83.5	Confident	76.8	Confident	23 Å²	23	67.2 Å²	67.2	16%	0.155	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	137.5	176.3	-59.4	0	0	0	0	110.1	F463 F481 C486	F463-C477 WeakPolarHBondContact O-CA 3.44Å; C477-F481 HydrophobicContact CB-CB 4.32Å; C477-C486 WeakPolarHBondContact CA-SG 3.38Å; C477-C486 HydrophobicContact CB-CB 3.89Å; C477-C486 WeakPolarHBondContact CB-SG 3.12Å; C477-C486 VanDerWaalsContact SG-CA 3.54Å; C477-C486 WeakPolarHBondContact SG-CB 3.3Å; C477-C486 CovalentContact SG-SG 2.04Å; C477-C486 PolarHBondContact SG-SG 2.83Å
478	A	75.9	Confident	77.2	Confident	13 Å²	13	66.9 Å²	66.9	11%	0.107	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-61.3	141.4	168.4	0	0	0	0	0	110.2	F463 D465 Q480 F481	F463-A478 PolarHBondContact O-N 2.84Å; D465-A478 HydrophobicContact CB-CB 4.48Å; A478-Q480 PolarHBondContact O-N 2.72Å; A478-F481 HydrophobicContact CB-CD2 4.06Å; A478-F481 HydrophobicContact CB-CE2 4.37Å; A478-F481 PolarHBondContact O-N 3.38Å
479	K	76.8	Confident	77	Confident	127 Å²	127	67.5 Å²	67.5	55%	0.552	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-41.1	-40.7	-165.7	-171.8	-165.2	176.8	-151.5	0	115.2	F481 S490 Y493 E501	K479-F481 VanDerWaalsContact C-N 3.29Å; K479-F481 PolarHBondContact O-N 3.49Å; K479-S490 PolarHBondContact O-OG 3.18Å; K479-Y493 WeakPolarHBondContact CD-OH 3.18Å; K479-Y493 WeakPolarHBondContact CE-OH 3.48Å; K479-Y493 PolarHBondContact NZ-OH 2.88Å; K479-E501 IonicContact NZ-OE1 3.75Å; K479-E501 PolarHBondContact NZ-OE1 2.79Å; K479-E501 VanDerWaalsContact NZ-OE1 3.15Å
480	Q	74.1	Confident	77	Confident	57 Å²	57	65.9 Å²	65.9	27%	0.266	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-18.8	-177.2	68	-82.7	11.1	0	0	114.5	A478 C489 S490 Y493 C499	A478-Q480 PolarHBondContact O-N 2.72Å; Q480-C489 WeakPolarHBondContact O-CA 3.49Å; Q480-S490 PolarHBondContact O-N 3.02Å; Q480-Y493 HydrophobicContact CB-CD1 3.84Å; Q480-Y493 HydrophobicContact CB-CE1 3.91Å; Q480-Y493 HydrophobicContact CB-CG 4.32Å; Q480-C499 HydrophobicContact CB-CB 3.61Å; Q480-C499 WeakPolarHBondContact CB-O 3.46Å; Q480-C499 HydrophobicContact CG-CB 3.68Å; Q480-C499 WeakPolarHBondContact O-CB 3.47Å
481	F	85.2	Confident	77	Confident	9 Å²	9	71.6 Å²	71.6	4%	0.039	37%	0.369	C	S	.	.	B	Isolated β-bridge	trans	-98.2	141.5	178.6	-56.3	-66	0	0	0	112.5	F463 C477 A478 K479 P483 C486 A488 S490 F496 P497 C499	F463-F481 HydrophobicContact CB-CD2 4.4Å; F463-F481 HydrophobicContact CB-CE2 4.47Å; F463-F481 HydrophobicContact CD1-CD1 4.26Å; F463-F481 HydrophobicContact CD1-CD2 4.3Å; F463-F481 AromaticContact CD1-CE1 3.84Å; F463-F481 HydrophobicContact CD1-CE1 3.84Å; F463-F481 AromaticContact CD1-CE2 3.89Å; F463-F481 HydrophobicContact CD1-CE2 3.89Å; F463-F481 HydrophobicContact CD1-CG 4.48Å; F463-F481 AromaticContact CD1-CZ 3.65Å; F463-F481 HydrophobicContact CD1-CZ 3.65Å; F463-F481 HydrophobicContact CE1-CE1 4.17Å; F463-F481 HydrophobicContact CE1-CZ 4.12Å; C477-F481 HydrophobicContact CB-CB 4.32Å; A478-F481 HydrophobicContact CB-CD2 4.06Å; A478-F481 HydrophobicContact CB-CE2 4.37Å; A478-F481 PolarHBondContact O-N 3.38Å; K479-F481 VanDerWaalsContact C-N 3.29Å; K479-F481 PolarHBondContact O-N 3.49Å; F481-P483 WeakPolarHBondContact O-CD 3.39Å; F481-C486 HydrophobicContact CB-CB 3.94Å; F481-A488 CarbonylContact C-O 3.49Å; F481-A488 WeakPolarHBondContact CA-O 3.13Å; F481-S490 PolarHBondContact O-OG 3.35Å; F481-F496 HydrophobicContact CD1-CD2 4.22Å; F481-F496 AromaticContact CD1-CE2 3.98Å; F481-F496 HydrophobicContact CD1-CE2 3.98Å; F481-F496 HydrophobicContact CE1-CD2 4.22Å; F481-F496 HydrophobicContact CE1-CE2 4.05Å; F481-P497 WeakPolarHBondContact CE1-O 3.36Å; F481-P497 WeakPolarHBondContact CZ-O 3.48Å; F481-C499 HydrophobicContact CD1-CB 4.43Å; F481-C499 HydrophobicContact CE1-CB 4.24Å
482	Q	79.8	Confident	76.7	Confident	94 Å²	94	65.3 Å²	65.3	44%	0.439	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-81.7	127.5	-175.2	-158.5	-168.6	-70.6	0	0	111.6	C486 A488	Q482-C486 WeakPolarHBondContact O-CA 3.04Å; Q482-C486 PolarHBondContact O-N 2.59Å; Q482-C486 VanDerWaalsContact O-N 3.11Å; Q482-A488 HydrophobicContact CB-CB 4.25Å; Q482-A488 PolarHBondContact N-O 2.81Å
483	P	71.4	Confident	76.4	Confident	86 Å²	86	62.9 Å²	62.9	56%	0.558	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	154.8	167.7	-21.2	33.9	0	0	0	111.9	F481	F481-P483 WeakPolarHBondContact O-CD 3.39Å
484	P	65.5	Low	76.3	Confident	78 Å²	78	66.5 Å²	66.5	51%	0.506	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	cis	-89.7	-20.7	9.4	33.7	-33.8	0	0	0	115	R474	R474-P484 PolarHBondContact NH2-O 3.16Å
485	D	77.9	Confident	76	Confident	110 Å²	110	65.1 Å²	65.1	59%	0.588	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.3	5.6	-163.5	-57.2	-34.4	0	0	0	113.8	R474 D487	R474-D485 IonicContact NH2-OD1 3.73Å; R474-D485 PolarHBondContact NH2-OD1 2.65Å; R474-D485 VanDerWaalsContact NH2-OD1 3.1Å; D485-D487 VanDerWaalsContact C-N 3.28Å; D485-D487 PolarHBondContact O-N 3.12Å
486	C	81.5	Confident	75.3	Confident	6 Å²	6	69.1 Å²	69.1	4%	0.041	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.1	26.6	173.8	-34.8	0	0	0	0	114.9	F463 C477 F481 Q482	F463-C486 HydrophobicContact CB-CB 4.04Å; C477-C486 WeakPolarHBondContact CA-SG 3.38Å; C477-C486 HydrophobicContact CB-CB 3.89Å; C477-C486 WeakPolarHBondContact CB-SG 3.12Å; C477-C486 VanDerWaalsContact SG-CA 3.54Å; C477-C486 WeakPolarHBondContact SG-CB 3.3Å; C477-C486 CovalentContact SG-SG 2.04Å; C477-C486 PolarHBondContact SG-SG 2.83Å; F481-C486 HydrophobicContact CB-CB 3.94Å; Q482-C486 WeakPolarHBondContact O-CA 3.04Å; Q482-C486 PolarHBondContact O-N 2.59Å; Q482-C486 VanDerWaalsContact O-N 3.11Å
487	D	82.9	Confident	74.7	Confident	107 Å²	107	69.4 Å²	69.4	57%	0.572	36%	0.364	S	S	*	.			trans	-103	-0.8	-168.5	70.5	-36.6	0	0	0	115.2	D485 F496	D485-D487 VanDerWaalsContact C-N 3.28Å; D485-D487 PolarHBondContact O-N 3.12Å; D487-F496 VanDerWaalsContact O-CE2 3.29Å; D487-F496 WeakPolarHBondContact O-CE2 3.4Å; D487-F496 WeakPolarHBondContact O-CZ 3.19Å
488	A	81.2	Confident	74.1	Confident	35 Å²	35	70.7 Å²	70.7	29%	0.289	38%	0.381	S	S	.	.	S	Bend	trans	-137.2	166.2	175.9	0	0	0	0	0	110.9	F481 Q482	F481-A488 CarbonylContact C-O 3.49Å; F481-A488 WeakPolarHBondContact CA-O 3.13Å; Q482-A488 HydrophobicContact CB-CB 4.25Å; Q482-A488 PolarHBondContact N-O 2.81Å
489	C	78.2	Confident	74	Confident	24 Å²	24	70.3 Å²	70.3	16%	0.162	38%	0.378	C	S	.	.	B	Isolated β-bridge	trans	-82.9	138.7	172.1	-56.6	0	0	0	0	111.4	Q480 F496 C499	Q480-C489 WeakPolarHBondContact O-CA 3.49Å; C489-F496 VanDerWaalsContact SG-CA 3.54Å; C489-F496 PolarHBondContact SG-N 3.03Å; C489-C499 WeakPolarHBondContact CA-SG 3.48Å; C489-C499 HydrophobicContact CB-CB 3.79Å; C489-C499 WeakPolarHBondContact CB-SG 3.44Å; C489-C499 WeakPolarHBondContact SG-CA 3.42Å; C489-C499 WeakPolarHBondContact SG-CB 3.12Å; C489-C499 CovalentContact SG-SG 2.05Å; C489-C499 PolarHBondContact SG-SG 2.96Å
490	S	75.3	Confident	73.5	Confident	22 Å²	22	68.4 Å²	68.4	15%	0.154	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-59.6	155.8	175	-71.5	0	0	0	0	112.2	K479 Q480 F481 G492 Y493	K479-S490 PolarHBondContact O-OG 3.18Å; Q480-S490 PolarHBondContact O-N 3.02Å; F481-S490 PolarHBondContact O-OG 3.35Å; S490-G492 PolarHBondContact O-N 2.79Å; S490-Y493 WeakPolarHBondContact O-CB 3.34Å; S490-Y493 PolarHBondContact O-N 3.45Å
491	Y	69.8	Low	72.8	Confident	223 Å²	223	71.3 Å²	71.3	88%	0.875	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	128.3	174.3	178.4	-92.9	0	0	0	110.2
492	G	62.1	Low	71.8	Confident	31 Å²	31	73.9 Å²	73.9	32%	0.32	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.4	0.7	-168.2	0	0	0	0	0	114.3	S490 E501 C502	S490-G492 PolarHBondContact O-N 2.79Å; G492-E501 CarbonylContact O-C 3.37Å; G492-C502 WeakPolarHBondContact O-CB 3.17Å; G492-C502 PolarHBondContact O-N 3.35Å
493	Y	70.3	Confident	71	Confident	40 Å²	40	71.9 Å²	71.9	16%	0.157	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	157.2	175.1	-60.7	-95.2	0	0	0	112.7	K479 Q480 S490 C499 E500 E501	K479-Y493 WeakPolarHBondContact CD-OH 3.18Å; K479-Y493 WeakPolarHBondContact CE-OH 3.48Å; K479-Y493 PolarHBondContact NZ-OH 2.88Å; Q480-Y493 HydrophobicContact CB-CD1 3.84Å; Q480-Y493 HydrophobicContact CB-CE1 3.91Å; Q480-Y493 HydrophobicContact CB-CG 4.32Å; S490-Y493 WeakPolarHBondContact O-CB 3.34Å; S490-Y493 PolarHBondContact O-N 3.45Å; Y493-C499 VanDerWaalsContact CD1-O 3.28Å; Y493-C499 WeakPolarHBondContact CD1-O 3.28Å; Y493-E500 CarbonylContact C-O 3.56Å; Y493-E500 WeakPolarHBondContact CA-O 3.46Å; Y493-E501 HydrophobicContact CD1-CB 3.82Å; Y493-E501 HydrophobicContact CD1-CG 4.03Å; Y493-E501 HydrophobicContact CE1-CB 3.62Å; Y493-E501 HydrophobicContact CE1-CG 3.57Å; Y493-E501 PolarHBondContact OH-OE1 3.04Å
494	Y	71.4	Confident	71	Confident	94 Å²	94	68.8 Å²	68.8	37%	0.369	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	172	-178.9	72	-82.6	0	0	0	112.2	C499 E500 C502	Y494-C499 CarbonylContact O-C 3.45Å; Y494-C499 WeakPolarHBondContact O-CA 2.99Å; Y494-E500 HydrophobicContact CD1-CB 4.12Å; Y494-E500 WeakPolarHBondContact CD1-O 3.48Å; Y494-E500 HydrophobicContact CE1-CB 3.66Å; Y494-E500 HydrophobicContact CE2-CB 4.08Å; Y494-E500 WeakPolarHBondContact CE2-OE2 3.48Å; Y494-E500 VanDerWaalsContact CZ-OE2 3.23Å; Y494-E500 PolarHBondContact N-O 2.89Å; Y494-E500 PolarHBondContact O-N 3.22Å; Y494-E500 PolarHBondContact OH-OE2 3.21Å; Y494-C502 HydrophobicContact CD1-CB 4.04Å
495	N	70.2	Confident	71.4	Confident	94 Å²	94	68 Å²	68	50%	0.503	37%	0.371	S	S	.	.	S	Bend	trans	61.2	60.7	-177.5	-73.3	-6.1	0	0	0	116.1	G498 C499 E500	N495-G498 CarbonylContact O-C 3.52Å; N495-G498 WeakPolarHBondContact O-CA 3.31Å; N495-G498 PolarHBondContact O-N 3.41Å; N495-C499 PolarHBondContact O-N 2.79Å; N495-E500 WeakPolarHBondContact CB-OE1 3.12Å; N495-E500 PolarHBondContact ND2-OE1 3.15Å
496	F	67.8	Low	71	Confident	101 Å²	101	68.7 Å²	68.7	44%	0.443	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	137.5	167.1	-175	-92.2	0	0	0	110.9	F463 F481 D487 C489	F463-F496 HydrophobicContact CE1-CZ 4.41Å; F481-F496 HydrophobicContact CD1-CD2 4.22Å; F481-F496 AromaticContact CD1-CE2 3.98Å; F481-F496 HydrophobicContact CD1-CE2 3.98Å; F481-F496 HydrophobicContact CE1-CD2 4.22Å; F481-F496 HydrophobicContact CE1-CE2 4.05Å; D487-F496 VanDerWaalsContact O-CE2 3.29Å; D487-F496 WeakPolarHBondContact O-CE2 3.4Å; D487-F496 WeakPolarHBondContact O-CZ 3.19Å; C489-F496 VanDerWaalsContact SG-CA 3.54Å; C489-F496 PolarHBondContact SG-N 3.03Å
497	P	67.4	Low	70.5	Confident	83 Å²	83	72.1 Å²	72.1	54%	0.539	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	cis	-91.6	11.1	6.1	37.5	-37.3	0	0	0	115.6	F463 F481	F463-P497 HydrophobicContact CE1-CB 4.14Å; F481-P497 WeakPolarHBondContact CE1-O 3.36Å; F481-P497 WeakPolarHBondContact CZ-O 3.48Å
498	G	70.9	Confident	69.8	Low	50 Å²	50	67 Å²	67	52%	0.515	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-38.1	175.4	0	0	0	0	0	113.6	N495	N495-G498 CarbonylContact O-C 3.52Å; N495-G498 WeakPolarHBondContact O-CA 3.31Å; N495-G498 PolarHBondContact O-N 3.41Å
499	C	74.8	Confident	69.4	Low	6 Å²	6	65.7 Å²	65.7	4%	0.041	36%	0.357	C	S	.	.			trans	51.1	69.1	-179.9	-62	0	0	0	0	113.6	Q480 F481 C489 Y493 Y494 N495	Q480-C499 HydrophobicContact CB-CB 3.61Å; Q480-C499 WeakPolarHBondContact CB-O 3.46Å; Q480-C499 HydrophobicContact CG-CB 3.68Å; Q480-C499 WeakPolarHBondContact O-CB 3.47Å; F481-C499 HydrophobicContact CD1-CB 4.43Å; F481-C499 HydrophobicContact CE1-CB 4.24Å; C489-C499 WeakPolarHBondContact CA-SG 3.48Å; C489-C499 HydrophobicContact CB-CB 3.79Å; C489-C499 WeakPolarHBondContact CB-SG 3.44Å; C489-C499 WeakPolarHBondContact SG-CA 3.42Å; C489-C499 WeakPolarHBondContact SG-CB 3.12Å; C489-C499 CovalentContact SG-SG 2.05Å; C489-C499 PolarHBondContact SG-SG 2.96Å; Y493-C499 VanDerWaalsContact CD1-O 3.28Å; Y493-C499 WeakPolarHBondContact CD1-O 3.28Å; Y494-C499 CarbonylContact O-C 3.45Å; Y494-C499 WeakPolarHBondContact O-CA 2.99Å; N495-C499 PolarHBondContact O-N 2.79Å
500	E	65.8	Low	69.2	Low	86 Å²	86	71.5 Å²	71.5	40%	0.402	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	142.1	176.5	-64.2	163.3	-129.9	0	0	111.6	Y493 Y494 N495	Y493-E500 CarbonylContact C-O 3.56Å; Y493-E500 WeakPolarHBondContact CA-O 3.46Å; Y494-E500 HydrophobicContact CD1-CB 4.12Å; Y494-E500 WeakPolarHBondContact CD1-O 3.48Å; Y494-E500 HydrophobicContact CE1-CB 3.66Å; Y494-E500 HydrophobicContact CE2-CB 4.08Å; Y494-E500 WeakPolarHBondContact CE2-OE2 3.48Å; Y494-E500 VanDerWaalsContact CZ-OE2 3.23Å; Y494-E500 PolarHBondContact N-O 2.89Å; Y494-E500 PolarHBondContact O-N 3.22Å; Y494-E500 PolarHBondContact OH-OE2 3.21Å; N495-E500 WeakPolarHBondContact CB-OE1 3.12Å; N495-E500 PolarHBondContact ND2-OE1 3.15Å
501	E	58.7	Low	68.7	Low	119 Å²	119	72 Å²	72	56%	0.556	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.9	134.4	-175.2	-154.3	162.5	-135.4	0	0	112.1	K479 G492 Y493	K479-E501 IonicContact NZ-OE1 3.75Å; K479-E501 PolarHBondContact NZ-OE1 2.79Å; K479-E501 VanDerWaalsContact NZ-OE1 3.15Å; G492-E501 CarbonylContact O-C 3.37Å; Y493-E501 HydrophobicContact CD1-CB 3.82Å; Y493-E501 HydrophobicContact CD1-CG 4.03Å; Y493-E501 HydrophobicContact CE1-CB 3.62Å; Y493-E501 HydrophobicContact CE1-CG 3.57Å; Y493-E501 PolarHBondContact OH-OE1 3.04Å
502	C	64.5	Low	68.2	Low	62 Å²	62	64.9 Å²	64.9	42%	0.419	38%	0.378	S	S	.	.			trans	-96.9	114.8	-174.4	-175.4	0	0	0	0	111.3	G492 Y494	G492-C502 WeakPolarHBondContact O-CB 3.17Å; G492-C502 PolarHBondContact O-N 3.35Å; Y494-C502 HydrophobicContact CD1-CB 4.04Å
503	A	63.4	Low	68	Low	52 Å²	52	65.5 Å²	65.5	43%	0.43	38%	0.376	S	S	.	.			trans	-103.9	-3.5	-158.3	0	0	0	0	0	117.5	H528	A503-H528 WeakPolarHBondContact CB-CE1 3.31Å; A503-H528 WeakPolarHBondContact O-CB 3.49Å
504	C	71.5	Confident	67.6	Low	21 Å²	21	71.6 Å²	71.6	14%	0.142	41%	0.406	C	S	.	.			trans	-71.4	134.5	-173.3	-55.2	0	0	0	0	115.3	L506 P513 C518	C504-L506 PolarHBondContact O-N 3.21Å; C504-P513 VanDerWaalsContact SG-CD 3.55Å; C504-P513 VanDerWaalsContact SG-CG 3.52Å; C504-C518 WeakPolarHBondContact CA-SG 3.47Å; C504-C518 HydrophobicContact CB-CB 3.91Å; C504-C518 WeakPolarHBondContact CB-SG 3.3Å; C504-C518 WeakPolarHBondContact SG-CB 3.5Å; C504-C518 CovalentContact SG-SG 2.03Å; C504-C518 PolarHBondContact SG-SG 2.86Å
505	F	74.6	Confident	67.2	Low	63 Å²	63	70.3 Å²	70.3	28%	0.276	42%	0.421	S	S	.	.			trans	-79.8	102	166.5	173	-100.3	0	0	0	111.4	P507 G508 S509 F524 H528 C529 N530 F539	F505-P507 HydrophobicContact CD1-CB 4.48Å; F505-P507 HydrophobicContact CE1-CB 3.7Å; F505-P507 HydrophobicContact CE1-CG 3.91Å; F505-P507 HydrophobicContact CE2-CG 3.97Å; F505-P507 HydrophobicContact CZ-CB 3.77Å; F505-P507 HydrophobicContact CZ-CG 3.57Å; F505-G508 VanDerWaalsContact CD1-N 3.29Å; F505-G508 VanDerWaalsContact CE1-N 3.31Å; F505-G508 PolarHBondContact O-N 2.85Å; F505-S509 WeakPolarHBondContact O-CB 3.41Å; F505-S509 PolarHBondContact O-N 3.42Å; F505-S509 PolarHBondContact O-OG 3.04Å; F505-F524 HydrophobicContact CE1-CD1 4.49Å; F505-F524 HydrophobicContact CE1-CE1 4.23Å; F505-H528 WeakPolarHBondContact CB-O 3.5Å; F505-H528 PolarHBondContact N-O 2.89Å; F505-C529 WeakPolarHBondContact CD1-O 3.4Å; F505-N530 HydrophobicContact CB-CB 3.57Å; F505-N530 HydrophobicContact CG-CB 4.15Å; F505-F539 HydrophobicContact CD1-CZ 4.13Å; F505-F539 HydrophobicContact CE1-CE1 4.43Å; F505-F539 HydrophobicContact CE1-CE2 4.07Å; F505-F539 AromaticContact CE1-CZ 3.47Å; F505-F539 HydrophobicContact CE1-CZ 3.47Å; F505-F539 VanDerWaalsContact CE1-CZ 3.47Å; F505-F539 HydrophobicContact CE2-CE1 4.4Å; F505-F539 HydrophobicContact CE2-CZ 4.02Å; F505-F539 AromaticContact CZ-CE1 3.95Å; F505-F539 HydrophobicContact CZ-CE1 3.95Å; F505-F539 HydrophobicContact CZ-CE2 4.4Å; F505-F539 AromaticContact CZ-CZ 3.41Å; F505-F539 HydrophobicContact CZ-CZ 3.41Å; F505-F539 VanDerWaalsContact CZ-CZ 3.41Å
506	L	67.9	Low	66.6	Low	123 Å²	123	72.9 Å²	72.9	64%	0.644	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-44.4	-169.2	-62.8	167.7	0	0	0	115	C504 G508 S509	C504-L506 PolarHBondContact O-N 3.21Å; L506-G508 PolarHBondContact O-N 3.13Å; L506-S509 WeakPolarHBondContact CA-OG 3.27Å; L506-S509 PolarHBondContact O-N 3.05Å; L506-S509 PolarHBondContact O-OG 2.81Å
507	P	72.3	Confident	66.5	Low	79 Å²	79	73.3 Å²	73.3	51%	0.513	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-31	-178.8	-20.6	33.2	0	0	0	115	F505 K521	F505-P507 HydrophobicContact CD1-CB 4.48Å; F505-P507 HydrophobicContact CE1-CB 3.7Å; F505-P507 HydrophobicContact CE1-CG 3.91Å; F505-P507 HydrophobicContact CE2-CG 3.97Å; F505-P507 HydrophobicContact CZ-CB 3.77Å; F505-P507 HydrophobicContact CZ-CG 3.57Å; P507-K521 PolarHBondContact O-NZ 3Å
508	G	68.6	Low	66.7	Low	0 Å²	0	69.5 Å²	69.5	0%	0	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-24.6	176.9	0	0	0	0	0	113.1	F505 L506 K521 C529	F505-G508 VanDerWaalsContact CD1-N 3.29Å; F505-G508 VanDerWaalsContact CE1-N 3.31Å; F505-G508 PolarHBondContact O-N 2.85Å; L506-G508 PolarHBondContact O-N 3.13Å; G508-K521 WeakPolarHBondContact O-CG 3.3Å; G508-K521 PolarHBondContact O-N 3.26Å; G508-C529 VanDerWaalsContact C-CB 3.49Å
509	S	71.6	Confident	67	Low	7 Å²	7	69.5 Å²	69.5	5%	0.049	40%	0.4	C	S	.	.	B	Isolated β-bridge	trans	-82.3	164.9	179.7	74.8	0	0	0	0	114.3	F505 L506 P519 K521	F505-S509 WeakPolarHBondContact O-CB 3.41Å; F505-S509 PolarHBondContact O-N 3.42Å; F505-S509 PolarHBondContact O-OG 3.04Å; L506-S509 WeakPolarHBondContact CA-OG 3.27Å; L506-S509 PolarHBondContact O-N 3.05Å; L506-S509 PolarHBondContact O-OG 2.81Å; S509-P519 CarbonylContact C-O 3.48Å; S509-P519 WeakPolarHBondContact CA-O 3.26Å; S509-K521 VanDerWaalsContact O-CE 3.29Å; S509-K521 WeakPolarHBondContact O-CE 3.39Å; S509-K521 PolarHBondContact O-NZ 2.78Å
510	E	74	Confident	67.1	Low	146 Å²	146	71.4 Å²	71.4	68%	0.682	41%	0.413	S	S	*	.	S	Bend	trans	-108.9	-3.9	171.5	-55.8	-162.5	147.7	0	0	113.4	P519 K521	E510-P519 HydrophobicContact CB-CB 4.36Å; E510-P519 HydrophobicContact CB-CG 4.18Å; E510-P519 PolarHBondContact N-O 2.81Å; E510-K521 HydrophobicContact CG-CG 4.06Å
511	G	65.8	Low	67.7	Low	31 Å²	31	71.2 Å²	71.2	32%	0.32	41%	0.411	S	S	.	.	S	Bend	trans	176.2	-178.6	-178.4	0	0	0	0	0	114.5
512	A	58.1	Low	68.6	Low	75 Å²	75	73 Å²	73	62%	0.62	42%	0.422	S	S	*	.	S	Bend	trans	-65.2	161.8	176.3	0	0	0	0	0	112.6	Q514	A512-Q514 PolarHBondContact O-N 3.37Å
513	P	58.6	Low	69.5	Low	44 Å²	44	72.9 Å²	72.9	29%	0.286	42%	0.418	S	S	.	.			trans	-59.9	133.3	-179.9	-10.2	19.6	0	0	0	111.4	C504 G515	C504-P513 VanDerWaalsContact SG-CD 3.55Å; C504-P513 VanDerWaalsContact SG-CG 3.52Å; P513-G515 WeakPolarHBondContact CB-O 3.47Å
514	Q	62.4	Low	70.2	Confident	168 Å²	168	72.2 Å²	72.2	79%	0.785	41%	0.405	S	S	*	.	B	Isolated β-bridge	trans	-104.4	93.7	169.8	-70.2	-169	-2.7	0	0	108.6	A512 E516 Q517	A512-Q514 PolarHBondContact O-N 3.37Å; Q514-E516 PolarHBondContact O-N 3.21Å; Q514-Q517 PolarHBondContact N-O 2.81Å
515	G	62.7	Low	70.3	Confident	66 Å²	66	74.5 Å²	74.5	68%	0.68	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.1	-131.2	-160.3	0	0	0	0	0	109.3	P513 Q517	P513-G515 WeakPolarHBondContact CB-O 3.47Å; G515-Q517 VanDerWaalsContact C-N 3.34Å; G515-Q517 PolarHBondContact O-N 3.32Å
516	E	57.9	Low	70.1	Confident	149 Å²	149	72.5 Å²	72.5	70%	0.696	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-11.9	-176.7	-75.1	-167.6	-125.8	0	0	115.6	Q514 K527	Q514-E516 PolarHBondContact O-N 3.21Å; E516-K527 WeakPolarHBondContact O-CE 3.27Å; E516-K527 WeakPolarHBondContact O-CG 3.49Å; E516-K527 IonicContact OE2-NZ 3.8Å; E516-K527 PolarHBondContact OE2-NZ 2.97Å
517	Q	64.8	Low	70.2	Confident	109 Å²	109	70.8 Å²	70.8	51%	0.509	40%	0.401	S	S	.	.	B	Isolated β-bridge	trans	-114	133	-167.9	-157.1	79.1	21.1	0	0	112.9	Q514 G515	Q514-Q517 PolarHBondContact N-O 2.81Å; G515-Q517 VanDerWaalsContact C-N 3.34Å; G515-Q517 PolarHBondContact O-N 3.32Å
518	C	71.4	Confident	70.4	Confident	4 Å²	4	68.8 Å²	68.8	3%	0.027	39%	0.385	C	S	.	.			trans	-89.4	140.3	167.2	-51	0	0	0	0	110.5	C504 C520 K527 H528	C504-C518 WeakPolarHBondContact CA-SG 3.47Å; C504-C518 HydrophobicContact CB-CB 3.91Å; C504-C518 WeakPolarHBondContact CB-SG 3.3Å; C504-C518 WeakPolarHBondContact SG-CB 3.5Å; C504-C518 CovalentContact SG-SG 2.03Å; C504-C518 PolarHBondContact SG-SG 2.86Å; C518-C520 PolarHBondContact O-SG 3.15Å; C518-C520 VanDerWaalsContact O-SG 3.39Å; C518-K527 WeakPolarHBondContact CB-O 3.3Å; C518-K527 PolarHBondContact N-O 3.3Å; C518-K527 PolarHBondContact SG-O 2.93Å; C518-K527 VanDerWaalsContact SG-O 3.42Å; C518-H528 PolarHBondContact SG-ND1 3.17Å
519	P	78.1	Confident	70.9	Confident	50 Å²	50	68.8 Å²	68.8	33%	0.325	39%	0.385	S	S	.	.			trans	-80.4	131.2	176.2	31.1	-32.9	0	0	0	111.2	S509 E510 C529	S509-P519 CarbonylContact C-O 3.48Å; S509-P519 WeakPolarHBondContact CA-O 3.26Å; E510-P519 HydrophobicContact CB-CB 4.36Å; E510-P519 HydrophobicContact CB-CG 4.18Å; E510-P519 PolarHBondContact N-O 2.81Å; P519-C529 PolarHBondContact O-SG 2.87Å
520	C	77.5	Confident	71.1	Confident	46 Å²	46	71.8 Å²	71.8	31%	0.311	40%	0.4	S	S	.	.	B	Isolated β-bridge	trans	-120.9	148.7	-167.6	-50.5	0	0	0	0	114.8	C518 G526 C529	C518-C520 PolarHBondContact O-SG 3.15Å; C518-C520 VanDerWaalsContact O-SG 3.39Å; C520-G526 PolarHBondContact SG-O 3.07Å; C520-C529 WeakPolarHBondContact CA-SG 3.45Å; C520-C529 HydrophobicContact CB-CB 3.63Å; C520-C529 WeakPolarHBondContact CB-SG 3.34Å; C520-C529 WeakPolarHBondContact SG-CA 3.38Å; C520-C529 WeakPolarHBondContact SG-CB 3.32Å; C520-C529 PolarHBondContact SG-N 2.96Å; C520-C529 CovalentContact SG-SG 2.03Å; C520-C529 PolarHBondContact SG-SG 2.85Å
521	K	77.6	Confident	71	Confident	82 Å²	82	67.7 Å²	67.7	36%	0.357	39%	0.385	S	S	.	.			trans	-75.2	152.2	174.7	-67	163.9	-170.3	163.7	0	111.6	P507 G508 S509 E510 N523 F524	P507-K521 PolarHBondContact O-NZ 3Å; G508-K521 WeakPolarHBondContact O-CG 3.3Å; G508-K521 PolarHBondContact O-N 3.26Å; S509-K521 VanDerWaalsContact O-CE 3.29Å; S509-K521 WeakPolarHBondContact O-CE 3.39Å; S509-K521 PolarHBondContact O-NZ 2.78Å; E510-K521 HydrophobicContact CG-CG 4.06Å; K521-N523 VanDerWaalsContact C-N 3.33Å; K521-N523 PolarHBondContact O-N 3.06Å; K521-N523 VanDerWaalsContact O-N 3.07Å; K521-F524 HydrophobicContact CB-CD2 3.89Å; K521-F524 CarbonylContact O-C 3.48Å; K521-F524 WeakPolarHBondContact O-CA 3.21Å; K521-F524 WeakPolarHBondContact O-CB 3.34Å; K521-F524 PolarHBondContact O-N 3.2Å
522	I	78.2	Confident	71.7	Confident	156 Å²	156	66.5 Å²	66.5	80%	0.8	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-31.7	-168.3	-166.6	169.4	0	0	0	117.2	F524 S533	I522-F524 VanDerWaalsContact C-N 3.32Å; I522-S533 PolarHBondContact O-OG 2.77Å
523	N	81.8	Confident	72.7	Confident	60 Å²	60	64 Å²	64	32%	0.321	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	0.4	176	-71.4	18.3	0	0	0	113.3	K521 C532 S533 C542	K521-N523 VanDerWaalsContact C-N 3.33Å; K521-N523 PolarHBondContact O-N 3.06Å; K521-N523 VanDerWaalsContact O-N 3.07Å; N523-C532 CarbonylContact O-C 3.48Å; N523-C532 WeakPolarHBondContact O-CA 3.17Å; N523-S533 PolarHBondContact O-N 3.04Å; N523-S533 PolarHBondContact O-OG 3.25Å; N523-C542 HydrophobicContact CB-CB 4.22Å
524	F	78.7	Confident	73.4	Confident	37 Å²	37	67.2 Å²	67.2	16%	0.162	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	143.1	-175.2	-64.1	-100.4	0	0	0	110.9	F505 K521 I522 T531 S533 F539	F505-F524 HydrophobicContact CE1-CD1 4.49Å; F505-F524 HydrophobicContact CE1-CE1 4.23Å; K521-F524 HydrophobicContact CB-CD2 3.89Å; K521-F524 CarbonylContact O-C 3.48Å; K521-F524 WeakPolarHBondContact O-CA 3.21Å; K521-F524 WeakPolarHBondContact O-CB 3.34Å; K521-F524 PolarHBondContact O-N 3.2Å; I522-F524 VanDerWaalsContact C-N 3.32Å; F524-T531 CarbonylContact C-O 3.6Å; F524-T531 WeakPolarHBondContact CA-O 3.14Å; F524-S533 PolarHBondContact N-OG 3.32Å; F524-F539 HydrophobicContact CD1-CD2 4.45Å; F524-F539 AromaticContact CD1-CE2 3.84Å; F524-F539 HydrophobicContact CD1-CE2 3.84Å; F524-F539 HydrophobicContact CE1-CD2 4.16Å; F524-F539 AromaticContact CE1-CE2 3.66Å; F524-F539 HydrophobicContact CE1-CE2 3.66Å; F524-F539 HydrophobicContact CE1-CZ 4.42Å
525	N	74.7	Confident	73.9	Confident	69 Å²	69	60.2 Å²	60.2	37%	0.369	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	-178.8	-174.8	-165.1	11.4	0	0	0	111.2	C529 N530 T531	N525-C529 CarbonylContact O-C 3.34Å; N525-C529 WeakPolarHBondContact O-CA 3.38Å; N525-C529 PolarHBondContact O-N 2.82Å; N525-N530 PolarHBondContact O-N 3.04Å; N525-N530 VanDerWaalsContact O-N 3.16Å; N525-T531 PolarHBondContact N-O 3.24Å; N525-T531 PolarHBondContact O-N 2.02Å; N525-T531 PolarHBondContact O-OG1 2.8Å
526	G	68.8	Low	74.7	Confident	22 Å²	22	61.6 Å²	61.6	23%	0.227	32%	0.323	C	S	.	.	S	Bend	trans	91.8	159	-175.5	0	0	0	0	0	112.3	C520 H528 C529	C520-G526 PolarHBondContact SG-O 3.07Å; G526-H528 PolarHBondContact O-N 2.91Å; G526-C529 PolarHBondContact O-N 3.29Å; G526-C529 VanDerWaalsContact O-N 3.07Å
527	K	71.7	Confident	75.7	Confident	86 Å²	86	56.4 Å²	56.4	37%	0.374	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-24	176.7	-165.5	177.3	-177.1	175	0	112.9	E516 C518	E516-K527 WeakPolarHBondContact O-CE 3.27Å; E516-K527 WeakPolarHBondContact O-CG 3.49Å; E516-K527 IonicContact OE2-NZ 3.8Å; E516-K527 PolarHBondContact OE2-NZ 2.97Å; C518-K527 WeakPolarHBondContact CB-O 3.3Å; C518-K527 PolarHBondContact N-O 3.3Å; C518-K527 PolarHBondContact SG-O 2.93Å; C518-K527 VanDerWaalsContact SG-O 3.42Å
528	H	75.2	Confident	76	Confident	38 Å²	38	53.4 Å²	53.4	18%	0.176	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.5	10.7	-173.4	-58.1	-42.5	0	0	0	114.2	A503 F505 C518 G526 N530	A503-H528 WeakPolarHBondContact CB-CE1 3.31Å; A503-H528 WeakPolarHBondContact O-CB 3.49Å; F505-H528 WeakPolarHBondContact CB-O 3.5Å; F505-H528 PolarHBondContact N-O 2.89Å; C518-H528 PolarHBondContact SG-ND1 3.17Å; G526-H528 PolarHBondContact O-N 2.91Å; H528-N530 PolarHBondContact O-N 2.92Å
529	C	80.3	Confident	75.7	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.303	C	S	.	.	S	Bend	trans	61.6	21	177.5	-40.2	0	0	0	0	115	F505 G508 P519 C520 N525 G526	F505-C529 WeakPolarHBondContact CD1-O 3.4Å; G508-C529 VanDerWaalsContact C-CB 3.49Å; P519-C529 PolarHBondContact O-SG 2.87Å; C520-C529 WeakPolarHBondContact CA-SG 3.45Å; C520-C529 HydrophobicContact CB-CB 3.63Å; C520-C529 WeakPolarHBondContact CB-SG 3.34Å; C520-C529 WeakPolarHBondContact SG-CA 3.38Å; C520-C529 WeakPolarHBondContact SG-CB 3.32Å; C520-C529 PolarHBondContact SG-N 2.96Å; C520-C529 CovalentContact SG-SG 2.03Å; C520-C529 PolarHBondContact SG-SG 2.85Å; N525-C529 CarbonylContact O-C 3.34Å; N525-C529 WeakPolarHBondContact O-CA 3.38Å; N525-C529 PolarHBondContact O-N 2.82Å; G526-C529 PolarHBondContact O-N 3.29Å; G526-C529 VanDerWaalsContact O-N 3.07Å
530	N	74	Confident	75.1	Confident	70 Å²	70	58.5 Å²	58.5	37%	0.374	32%	0.315	S	S	.	.			trans	-94.3	1.4	-170.1	61.5	-26.4	0	0	0	114.4	F505 N525 H528	F505-N530 HydrophobicContact CB-CB 3.57Å; F505-N530 HydrophobicContact CG-CB 4.15Å; N525-N530 PolarHBondContact O-N 3.04Å; N525-N530 VanDerWaalsContact O-N 3.16Å; H528-N530 PolarHBondContact O-N 2.92Å
531	T	73.9	Confident	74.8	Confident	59 Å²	59	63.3 Å²	63.3	36%	0.362	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	161.9	178	63.7	0	0	0	0	111.5	F524 N525	F524-T531 CarbonylContact C-O 3.6Å; F524-T531 WeakPolarHBondContact CA-O 3.14Å; N525-T531 PolarHBondContact N-O 3.24Å; N525-T531 PolarHBondContact O-N 2.02Å; N525-T531 PolarHBondContact O-OG1 2.8Å
532	C	79.1	Confident	74.8	Confident	7 Å²	7	59.8 Å²	59.8	5%	0.047	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	150.6	163.9	-69.7	0	0	0	0	110.6	N523 C542	N523-C532 CarbonylContact O-C 3.48Å; N523-C532 WeakPolarHBondContact O-CA 3.17Å; C532-C542 VanDerWaalsContact CA-SG 3.53Å; C532-C542 HydrophobicContact CB-CB 3.83Å; C532-C542 WeakPolarHBondContact CB-SG 3.06Å; C532-C542 VanDerWaalsContact SG-CA 3.54Å; C532-C542 WeakPolarHBondContact SG-CB 3.15Å; C532-C542 CovalentContact SG-SG 2.04Å; C532-C542 PolarHBondContact SG-SG 3.32Å
533	S	79	Confident	74.7	Confident	22 Å²	22	54.8 Å²	54.8	15%	0.154	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-61.3	151.1	166.7	-61.9	0	0	0	0	112	I522 N523 F524 G535 Y536	I522-S533 PolarHBondContact O-OG 2.77Å; N523-S533 PolarHBondContact O-N 3.04Å; N523-S533 PolarHBondContact O-OG 3.25Å; F524-S533 PolarHBondContact N-OG 3.32Å; S533-G535 PolarHBondContact O-N 3.14Å; S533-Y536 WeakPolarHBondContact O-CB 3.17Å; S533-Y536 PolarHBondContact O-N 2.7Å
534	D	72.9	Confident	74.5	Confident	112 Å²	112	55.4 Å²	55.4	60%	0.599	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	135.4	-174.2	-61.9	-44.5	0	0	0	112.6	I556	D534-I556 HydrophobicContact CB-CD1 3.94Å; D534-I556 HydrophobicContact CB-CG1 4.36Å
535	G	73.6	Confident	74.4	Confident	21 Å²	21	55 Å²	55	22%	0.216	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.7	3.7	-175.1	0	0	0	0	0	115.2	S533 A544 C545	S533-G535 PolarHBondContact O-N 3.14Å; G535-A544 WeakPolarHBondContact O-CA 3.08Å; G535-C545 VanDerWaalsContact C-SG 3.55Å; G535-C545 PolarHBondContact O-N 3.02Å; G535-C545 PolarHBondContact O-SG 3.33Å
536	Y	79.3	Confident	74.8	Confident	95 Å²	95	55.8 Å²	55.8	37%	0.373	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	148.5	178.2	-62	-95.8	0	0	0	113.8	S533 C542 A543 A544	S533-Y536 WeakPolarHBondContact O-CB 3.17Å; S533-Y536 PolarHBondContact O-N 2.7Å; Y536-C542 VanDerWaalsContact CD1-O 3.27Å; Y536-C542 WeakPolarHBondContact CD1-O 3.49Å; Y536-A543 CarbonylContact C-O 3.54Å; Y536-A543 VanDerWaalsContact CA-O 3.23Å; Y536-A543 WeakPolarHBondContact CA-O 3.3Å; Y536-A544 HydrophobicContact CD1-CB 4.42Å; Y536-A544 HydrophobicContact CE1-CB 4.37Å
537	H	78.3	Confident	75.2	Confident	39 Å²	39	55.9 Å²	55.9	18%	0.181	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	171.5	-175.3	75.4	83.5	0	0	0	114.9	C542 A543 C557 N558 S559	H537-C542 CarbonylContact O-C 2.83Å; H537-C542 WeakPolarHBondContact O-CA 3.5Å; H537-C542 PolarHBondContact O-N 3.04Å; H537-A543 PolarHBondContact CD2-O 3.19Å; H537-A543 PolarHBondContact N-O 2.9Å; H537-A543 PolarHBondContact O-N 3.02Å; H537-C557 PolarHBondContact CD2-SG 3.22Å; H537-N558 WeakPolarHBondContact CB-O 3.5Å; H537-S559 CarbonylContact C-O 3.3Å; H537-S559 WeakPolarHBondContact CA-O 3.5Å
538	S	71.2	Confident	75.6	Confident	46 Å²	46	53.8 Å²	53.8	32%	0.322	33%	0.329	S	S	.	.	S	Bend	trans	59.9	59.1	-173.4	-52.7	0	0	0	0	112	L541 C542 S559 T560	S538-L541 WeakPolarHBondContact O-CA 3.19Å; S538-L541 WeakPolarHBondContact O-CB 3.01Å; S538-L541 PolarHBondContact O-N 3.24Å; S538-C542 PolarHBondContact O-N 2.88Å; S538-C542 VanDerWaalsContact O-N 3.11Å; S538-S559 PolarHBondContact N-O 2.88Å; S538-T560 PolarHBondContact OG-O 2.77Å; S538-T560 VanDerWaalsContact OG-O 3.04Å
539	F	66.9	Low	75.4	Confident	72 Å²	72	59.7 Å²	59.7	32%	0.316	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.2	139.6	160.6	-175	-91.3	0	0	0	110.6	F505 F524 S559	F505-F539 HydrophobicContact CD1-CZ 4.13Å; F505-F539 HydrophobicContact CE1-CE1 4.43Å; F505-F539 HydrophobicContact CE1-CE2 4.07Å; F505-F539 AromaticContact CE1-CZ 3.47Å; F505-F539 HydrophobicContact CE1-CZ 3.47Å; F505-F539 VanDerWaalsContact CE1-CZ 3.47Å; F505-F539 HydrophobicContact CE2-CE1 4.4Å; F505-F539 HydrophobicContact CE2-CZ 4.02Å; F505-F539 AromaticContact CZ-CE1 3.95Å; F505-F539 HydrophobicContact CZ-CE1 3.95Å; F505-F539 HydrophobicContact CZ-CE2 4.4Å; F505-F539 AromaticContact CZ-CZ 3.41Å; F505-F539 HydrophobicContact CZ-CZ 3.41Å; F505-F539 VanDerWaalsContact CZ-CZ 3.41Å; F524-F539 HydrophobicContact CD1-CD2 4.45Å; F524-F539 AromaticContact CD1-CE2 3.84Å; F524-F539 HydrophobicContact CD1-CE2 3.84Å; F524-F539 HydrophobicContact CE1-CD2 4.16Å; F524-F539 AromaticContact CE1-CE2 3.66Å; F524-F539 HydrophobicContact CE1-CE2 3.66Å; F524-F539 HydrophobicContact CE1-CZ 4.42Å; F539-S559 PolarHBondContact N-O 2.92Å
540	P	63.6	Low	75.3	Confident	90 Å²	90	63 Å²	63	58%	0.584	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	cis	-87.3	11.5	7.2	36.2	-37.6	0	0	0	115.2
541	L	73.1	Confident	75.3	Confident	147 Å²	147	59.7 Å²	59.7	77%	0.77	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-38.8	-177.3	-69.8	167.6	0	0	0	113.9	S538	S538-L541 WeakPolarHBondContact O-CA 3.19Å; S538-L541 WeakPolarHBondContact O-CB 3.01Å; S538-L541 PolarHBondContact O-N 3.24Å
542	C	77.5	Confident	75.5	Confident	7 Å²	7	57 Å²	57	5%	0.047	34%	0.344	C	S	.	.			trans	59	87	178	-53.6	0	0	0	0	114.2	N523 C532 Y536 H537 S538	N523-C542 HydrophobicContact CB-CB 4.22Å; C532-C542 VanDerWaalsContact CA-SG 3.53Å; C532-C542 HydrophobicContact CB-CB 3.83Å; C532-C542 WeakPolarHBondContact CB-SG 3.06Å; C532-C542 VanDerWaalsContact SG-CA 3.54Å; C532-C542 WeakPolarHBondContact SG-CB 3.15Å; C532-C542 CovalentContact SG-SG 2.04Å; C532-C542 PolarHBondContact SG-SG 3.32Å; Y536-C542 VanDerWaalsContact CD1-O 3.27Å; Y536-C542 WeakPolarHBondContact CD1-O 3.49Å; H537-C542 CarbonylContact O-C 2.83Å; H537-C542 WeakPolarHBondContact O-CA 3.5Å; H537-C542 PolarHBondContact O-N 3.04Å; S538-C542 PolarHBondContact O-N 2.88Å; S538-C542 VanDerWaalsContact O-N 3.11Å
543	A	75.4	Confident	75.2	Confident	51 Å²	51	60.9 Å²	60.9	42%	0.421	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	157.1	179.2	0	0	0	0	0	112.9	Y536 H537	Y536-A543 CarbonylContact C-O 3.54Å; Y536-A543 VanDerWaalsContact CA-O 3.23Å; Y536-A543 WeakPolarHBondContact CA-O 3.3Å; H537-A543 PolarHBondContact CD2-O 3.19Å; H537-A543 PolarHBondContact N-O 2.9Å; H537-A543 PolarHBondContact O-N 3.02Å
544	A	76.7	Confident	74.8	Confident	73 Å²	73	62.7 Å²	62.7	60%	0.603	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.9	149.3	-161.7	0	0	0	0	0	117.4	G535 Y536	G535-A544 WeakPolarHBondContact O-CA 3.08Å; Y536-A544 HydrophobicContact CD1-CB 4.42Å; Y536-A544 HydrophobicContact CE1-CB 4.37Å
545	C	77.9	Confident	74.8	Confident	29 Å²	29	62.2 Å²	62.2	20%	0.196	37%	0.373	C	S	.	.			trans	-83.7	163.8	-173.9	-63.8	0	0	0	0	117.3	G535 N555 C557	G535-C545 VanDerWaalsContact C-SG 3.55Å; G535-C545 PolarHBondContact O-N 3.02Å; G535-C545 PolarHBondContact O-SG 3.33Å; C545-N555 WeakPolarHBondContact CB-O 3.28Å; C545-C557 VanDerWaalsContact CA-SG 3.57Å; C545-C557 HydrophobicContact CB-CB 3.6Å; C545-C557 WeakPolarHBondContact CB-SG 3.41Å; C545-C557 VanDerWaalsContact SG-CA 3.54Å; C545-C557 WeakPolarHBondContact SG-CB 3.35Å; C545-C557 PolarHBondContact SG-N 2.85Å; C545-C557 CovalentContact SG-SG 2.03Å; C545-C557 PolarHBondContact SG-SG 2.85Å
546	A	81.5	Confident	74.7	Confident	85 Å²	85	64.1 Å²	64.1	70%	0.702	38%	0.377	S	S	*	.			trans	-145.5	98.6	-179.8	0	0	0	0	0	114.4	C564	A546-C564 VanDerWaalsContact C-SG 3.54Å; A546-C564 PolarHBondContact O-SG 2.82Å
547	C	78.3	Confident	74.6	Confident	25 Å²	25	59.8 Å²	59.8	17%	0.169	36%	0.361	C	S	.	.			trans	-124.8	154.2	-164.6	-58.4	0	0	0	0	115.6	C564	C547-C564 WeakPolarHBondContact CA-SG 3.35Å; C547-C564 HydrophobicContact CB-CB 3.7Å; C547-C564 WeakPolarHBondContact CB-SG 3.45Å; C547-C564 WeakPolarHBondContact SG-CB 3.05Å; C547-C564 CovalentContact SG-SG 2.04Å; C547-C564 PolarHBondContact SG-SG 3.18Å
548	S	78.9	Confident	74.3	Confident	42 Å²	42	61.4 Å²	61.4	29%	0.294	37%	0.371	S	S	.	.			trans	-94.8	108.9	-176.8	-165.2	0	0	0	0	112.3	P550 G551 S552 A574	S548-P550 VanDerWaalsContact C-N 3.35Å; S548-P550 WeakPolarHBondContact O-CD 3.36Å; S548-G551 PolarHBondContact O-N 2.94Å; S548-S552 PolarHBondContact N-OG 2.81Å; S548-S552 VanDerWaalsContact N-OG 3.11Å; S548-S552 WeakPolarHBondContact O-CB 3.29Å; S548-S552 PolarHBondContact O-N 3.35Å; S548-S552 PolarHBondContact O-OG 2.79Å; S548-A574 WeakPolarHBondContact CB-O 3.47Å; S548-A574 PolarHBondContact N-O 2.96Å
549	Q	72.4	Confident	74.1	Confident	161 Å²	161	61.7 Å²	61.7	75%	0.752	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.9	-35.8	-171.9	-66.1	-174.7	-26.1	0	0	117.3	K567	Q549-K567 PolarHBondContact O-NZ 3.05Å
550	P	77.9	Confident	74.3	Confident	71 Å²	71	62.3 Å²	62.3	46%	0.461	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-45.6	176.1	-21	34.1	0	0	0	112.3	S548 K567 Y570	S548-P550 VanDerWaalsContact C-N 3.35Å; S548-P550 WeakPolarHBondContact O-CD 3.36Å; P550-K567 PolarHBondContact O-NZ 2.95Å; P550-Y570 PolarHBondContact O-OH 2.82Å
551	G	74.2	Confident	74.6	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-13	-169.7	0	0	0	0	0	116.5	S548 C566 K567 C575	S548-G551 PolarHBondContact O-N 2.94Å; G551-C566 CarbonylContact O-C 3.54Å; G551-C566 WeakPolarHBondContact O-CA 3.44Å; G551-K567 WeakPolarHBondContact O-CB 3.27Å; G551-K567 PolarHBondContact O-N 3.31Å; G551-C575 WeakPolarHBondContact CA-O 3.24Å; G551-C575 WeakPolarHBondContact O-CB 3.48Å
552	S	78.5	Confident	74.7	Confident	3 Å²	3	56.8 Å²	56.8	2%	0.021	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	143.2	171.8	-51.1	0	0	0	0	111	S548 D554 S565 K567 A574 C575	S548-S552 PolarHBondContact N-OG 2.81Å; S548-S552 VanDerWaalsContact N-OG 3.11Å; S548-S552 WeakPolarHBondContact O-CB 3.29Å; S548-S552 PolarHBondContact O-N 3.35Å; S548-S552 PolarHBondContact O-OG 2.79Å; S552-D554 VanDerWaalsContact C-N 3.29Å; S552-D554 PolarHBondContact O-N 2.81Å; S552-S565 CarbonylContact C-O 3.52Å; S552-S565 VanDerWaalsContact CA-O 3.32Å; S552-S565 WeakPolarHBondContact CA-O 3.42Å; S552-K567 WeakPolarHBondContact O-CE 3.23Å; S552-K567 PolarHBondContact O-NZ 2.85Å; S552-A574 PolarHBondContact OG-O 3.02Å; S552-C575 PolarHBondContact OG-SG 2.8Å; S552-C575 VanDerWaalsContact OG-SG 3.41Å
553	V	72.6	Confident	74.8	Confident	87 Å²	87	60.3 Å²	60.3	53%	0.527	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	-43.5	179.4	176.7	0	0	0	0	110.5	S565 K567	V553-S565 WeakPolarHBondContact CG2-O 3.42Å; V553-S565 PolarHBondContact N-O 3.08Å; V553-K567 HydrophobicContact CG2-CB 4.49Å; V553-K567 HydrophobicContact CG2-CG 4.1Å
554	D	70.3	Confident	75	Confident	60 Å²	60	58 Å²	58	32%	0.321	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	-165	-171.4	48.1	38	0	0	0	109.3	S552 I556	S552-D554 VanDerWaalsContact C-N 3.29Å; S552-D554 PolarHBondContact O-N 2.81Å; D554-I556 VanDerWaalsContact C-N 3.34Å; D554-I556 HydrophobicContact CB-CG1 4.41Å; D554-I556 WeakPolarHBondContact OD1-CA 3.32Å; D554-I556 VanDerWaalsContact OD1-CB 3.31Å; D554-I556 WeakPolarHBondContact OD1-CB 3.36Å; D554-I556 PolarHBondContact OD1-N 2.9Å
555	N	73.7	Confident	75	Confident	103 Å²	103	56.9 Å²	56.9	55%	0.551	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.9	15.3	169.1	-73.9	-9.4	0	0	0	112.5	C545	C545-N555 WeakPolarHBondContact CB-O 3.28Å
556	I	70.8	Confident	75.1	Confident	61 Å²	61	57.1 Å²	57.1	31%	0.313	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	101.3	179.6	-52.5	172.4	0	0	0	107.8	D534 D554 S565	D534-I556 HydrophobicContact CB-CD1 3.94Å; D534-I556 HydrophobicContact CB-CG1 4.36Å; D554-I556 VanDerWaalsContact C-N 3.34Å; D554-I556 HydrophobicContact CB-CG1 4.41Å; D554-I556 WeakPolarHBondContact OD1-CA 3.32Å; D554-I556 VanDerWaalsContact OD1-CB 3.31Å; D554-I556 WeakPolarHBondContact OD1-CB 3.36Å; D554-I556 PolarHBondContact OD1-N 2.9Å; I556-S565 WeakPolarHBondContact O-CB 3.25Å; I556-S565 PolarHBondContact O-OG 3.31Å
557	C	77.3	Confident	74.8	Confident	4 Å²	4	56.4 Å²	56.4	3%	0.027	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	161.4	171.1	71.6	0	0	0	0	111.8	H537 C545 S559 G562	H537-C557 PolarHBondContact CD2-SG 3.22Å; C545-C557 VanDerWaalsContact CA-SG 3.57Å; C545-C557 HydrophobicContact CB-CB 3.6Å; C545-C557 WeakPolarHBondContact CB-SG 3.41Å; C545-C557 VanDerWaalsContact SG-CA 3.54Å; C545-C557 WeakPolarHBondContact SG-CB 3.35Å; C545-C557 PolarHBondContact SG-N 2.85Å; C545-C557 CovalentContact SG-SG 2.03Å; C545-C557 PolarHBondContact SG-SG 2.85Å; C557-S559 PolarHBondContact O-N 3.04Å; C557-G562 WeakPolarHBondContact CB-O 3.35Å
558	N	71.8	Confident	74.3	Confident	73 Å²	73	62.2 Å²	62.2	39%	0.39	35%	0.351	S	S	.	.			trans	-50.3	123.8	172.9	177.1	-76.2	0	0	0	110.4	H537 T560 T561 G562 H563	H537-N558 WeakPolarHBondContact CB-O 3.5Å; N558-T560 PolarHBondContact O-N 2.87Å; N558-T560 WeakPolarHBondContact OD1-CB 3.44Å; N558-T560 PolarHBondContact OD1-N 2.88Å; N558-T561 WeakPolarHBondContact CB-OG1 3.46Å; N558-T561 VanDerWaalsContact CG-OG1 3.29Å; N558-T561 PolarHBondContact O-N 2.94Å; N558-T561 PolarHBondContact OD1-N 3.2Å; N558-T561 PolarHBondContact OD1-OG1 2.88Å; N558-T561 VanDerWaalsContact OD1-OG1 3.11Å; N558-G562 PolarHBondContact O-N 2.97Å; N558-G562 VanDerWaalsContact O-N 3.14Å; N558-H563 HydrophobicContact CB-CB 4.31Å; N558-H563 VanDerWaalsContact CB-O 3.32Å; N558-H563 WeakPolarHBondContact CB-O 3.44Å; N558-H563 PolarHBondContact N-O 3.06Å
559	S	67.3	Low	74.1	Confident	51 Å²	51	62.1 Å²	62.1	36%	0.357	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	7.5	-171.4	53.3	0	0	0	0	115.2	H537 S538 F539 C557	H537-S559 CarbonylContact C-O 3.3Å; H537-S559 WeakPolarHBondContact CA-O 3.5Å; S538-S559 PolarHBondContact N-O 2.88Å; F539-S559 PolarHBondContact N-O 2.92Å; C557-S559 PolarHBondContact O-N 3.04Å
560	T	69.9	Low	74.6	Confident	85 Å²	85	56 Å²	56	52%	0.521	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.1	-48.1	174	-47.2	0	0	0	0	111.7	S538 N558	S538-T560 PolarHBondContact OG-O 2.77Å; S538-T560 VanDerWaalsContact OG-O 3.04Å; N558-T560 PolarHBondContact O-N 2.87Å; N558-T560 WeakPolarHBondContact OD1-CB 3.44Å; N558-T560 PolarHBondContact OD1-N 2.88Å
561	T	71.4	Confident	74.6	Confident	99 Å²	99	54.8 Å²	54.8	61%	0.607	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	-8.3	-166.9	64.3	0	0	0	0	115.2	N558 H563	N558-T561 WeakPolarHBondContact CB-OG1 3.46Å; N558-T561 VanDerWaalsContact CG-OG1 3.29Å; N558-T561 PolarHBondContact O-N 2.94Å; N558-T561 PolarHBondContact OD1-N 3.2Å; N558-T561 PolarHBondContact OD1-OG1 2.88Å; N558-T561 VanDerWaalsContact OD1-OG1 3.11Å; T561-H563 PolarHBondContact O-N 3.07Å; T561-H563 VanDerWaalsContact O-N 3.15Å; T561-H563 VanDerWaalsContact OG1-CB 3.23Å; T561-H563 WeakPolarHBondContact OG1-CB 3.37Å; T561-H563 PolarHBondContact OG1-N 2.9Å
562	G	74.4	Confident	74.6	Confident	22 Å²	22	54.9 Å²	54.9	23%	0.227	31%	0.308	C	S	.	.			trans	71.2	-1.8	-172.5	0	0	0	0	0	114.2	C557 N558 C564	C557-G562 WeakPolarHBondContact CB-O 3.35Å; N558-G562 PolarHBondContact O-N 2.97Å; N558-G562 VanDerWaalsContact O-N 3.14Å; G562-C564 PolarHBondContact O-N 3.48Å
563	H	79.2	Confident	74.4	Confident	82 Å²	82	59.7 Å²	59.7	38%	0.38	34%	0.337	S	S	.	.			trans	-69.8	123.3	-178.5	-169.1	93.5	0	0	0	110.4	N558 T561	N558-H563 HydrophobicContact CB-CB 4.31Å; N558-H563 VanDerWaalsContact CB-O 3.32Å; N558-H563 WeakPolarHBondContact CB-O 3.44Å; N558-H563 PolarHBondContact N-O 3.06Å; T561-H563 PolarHBondContact O-N 3.07Å; T561-H563 VanDerWaalsContact O-N 3.15Å; T561-H563 VanDerWaalsContact OG1-CB 3.23Å; T561-H563 WeakPolarHBondContact OG1-CB 3.37Å; T561-H563 PolarHBondContact OG1-N 2.9Å
564	C	80.9	Confident	74.7	Confident	3 Å²	3	57.2 Å²	57.2	2%	0.02	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	145	-173.5	-71.5	0	0	0	0	112.9	A546 C547 G562 C566	A546-C564 VanDerWaalsContact C-SG 3.54Å; A546-C564 PolarHBondContact O-SG 2.82Å; C547-C564 WeakPolarHBondContact CA-SG 3.35Å; C547-C564 HydrophobicContact CB-CB 3.7Å; C547-C564 WeakPolarHBondContact CB-SG 3.45Å; C547-C564 WeakPolarHBondContact SG-CB 3.05Å; C547-C564 CovalentContact SG-SG 2.04Å; C547-C564 PolarHBondContact SG-SG 3.18Å; G562-C564 PolarHBondContact O-N 3.48Å; C564-C566 VanDerWaalsContact C-N 3.34Å; C564-C566 PolarHBondContact O-N 2.99Å; C564-C566 PolarHBondContact O-SG 3.03Å
565	S	75.2	Confident	75.3	Confident	48 Å²	48	54.4 Å²	54.4	34%	0.336	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	93.7	174.4	-61.9	0	0	0	0	108.9	S552 V553 I556 K567	S552-S565 CarbonylContact C-O 3.52Å; S552-S565 VanDerWaalsContact CA-O 3.32Å; S552-S565 WeakPolarHBondContact CA-O 3.42Å; V553-S565 WeakPolarHBondContact CG2-O 3.42Å; V553-S565 PolarHBondContact N-O 3.08Å; I556-S565 WeakPolarHBondContact O-CB 3.25Å; I556-S565 PolarHBondContact O-OG 3.31Å; S565-K567 PolarHBondContact O-N 3.13Å
566	C	80.7	Confident	75.7	Confident	35 Å²	35	53.6 Å²	53.6	24%	0.236	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	133.3	179.7	-58.6	0	0	0	0	110.3	G551 C564 M568 C575	G551-C566 CarbonylContact O-C 3.54Å; G551-C566 WeakPolarHBondContact O-CA 3.44Å; C564-C566 VanDerWaalsContact C-N 3.34Å; C564-C566 PolarHBondContact O-N 2.99Å; C564-C566 PolarHBondContact O-SG 3.03Å; C566-M568 PolarHBondContact O-N 3.02Å; C566-C575 WeakPolarHBondContact CA-SG 3.48Å; C566-C575 HydrophobicContact CB-CB 3.68Å; C566-C575 WeakPolarHBondContact CB-SG 3.26Å; C566-C575 PolarHBondContact N-SG 2.83Å; C566-C575 VanDerWaalsContact SG-CA 3.53Å; C566-C575 WeakPolarHBondContact SG-CB 3.2Å; C566-C575 CovalentContact SG-SG 2.04Å; C566-C575 PolarHBondContact SG-SG 3.24Å
567	K	74.8	Confident	76.2	Confident	70 Å²	70	57.4 Å²	57.4	30%	0.304	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-49	138.6	164.6	-69.1	-164.2	-178.4	75.8	0	106.9	Q549 P550 G551 S552 V553 S565 N569 Y570	Q549-K567 PolarHBondContact O-NZ 3.05Å; P550-K567 PolarHBondContact O-NZ 2.95Å; G551-K567 WeakPolarHBondContact O-CB 3.27Å; G551-K567 PolarHBondContact O-N 3.31Å; S552-K567 WeakPolarHBondContact O-CE 3.23Å; S552-K567 PolarHBondContact O-NZ 2.85Å; V553-K567 HydrophobicContact CG2-CB 4.49Å; V553-K567 HydrophobicContact CG2-CG 4.1Å; S565-K567 PolarHBondContact O-N 3.13Å; K567-N569 PolarHBondContact O-N 3.36Å; K567-Y570 HydrophobicContact CB-CD2 3.72Å; K567-Y570 HydrophobicContact CB-CE2 3.88Å; K567-Y570 WeakPolarHBondContact O-CB 3.41Å; K567-Y570 WeakPolarHBondContact O-CD2 3.4Å; K567-Y570 PolarHBondContact O-N 2.83Å
568	M	68.6	Low	76.2	Confident	147 Å²	147	58.6 Å²	58.6	72%	0.724	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.6	141	178.1	-154.5	-177.1	178.5	0	0	108.8	C566 Y570	C566-M568 PolarHBondContact O-N 3.02Å; M568-Y570 VanDerWaalsContact C-N 3.31Å; M568-Y570 PolarHBondContact O-N 2.7Å
569	N	74.8	Confident	76.2	Confident	39 Å²	39	56.7 Å²	56.7	21%	0.209	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.8	-14.7	179.9	-34.3	-16.9	0	0	0	115.6	K567 C578 S579 Y582 C588	K567-N569 PolarHBondContact O-N 3.36Å; N569-C578 WeakPolarHBondContact O-CA 3.31Å; N569-S579 PolarHBondContact O-N 2.77Å; N569-Y582 VanDerWaalsContact CA-CD1 3.46Å; N569-Y582 HydrophobicContact CB-CD1 3.18Å; N569-Y582 HydrophobicContact CB-CE1 3.58Å; N569-Y582 HydrophobicContact CB-CG 3.79Å; N569-Y582 WeakPolarHBondContact OD1-CD1 3.45Å; N569-Y582 WeakPolarHBondContact OD1-CE1 3.38Å; N569-C588 HydrophobicContact CB-CB 3.51Å; N569-C588 WeakPolarHBondContact CB-O 3.42Å; N569-C588 PolarHBondContact ND2-O 2.89Å; N569-C588 WeakPolarHBondContact O-CB 3.37Å
570	Y	83.2	Confident	76.3	Confident	32 Å²	32	59.8 Å²	59.8	13%	0.125	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	172.7	173.8	-68.1	-112.8	0	0	0	112.2	P550 K567 M568 R577 S579 Y585 P586 C588	P550-Y570 PolarHBondContact O-OH 2.82Å; K567-Y570 HydrophobicContact CB-CD2 3.72Å; K567-Y570 HydrophobicContact CB-CE2 3.88Å; K567-Y570 WeakPolarHBondContact O-CB 3.41Å; K567-Y570 WeakPolarHBondContact O-CD2 3.4Å; K567-Y570 PolarHBondContact O-N 2.83Å; M568-Y570 VanDerWaalsContact C-N 3.31Å; M568-Y570 PolarHBondContact O-N 2.7Å; Y570-R577 CarbonylContact C-O 3.56Å; Y570-R577 VanDerWaalsContact CA-O 3.23Å; Y570-R577 WeakPolarHBondContact CA-O 3.33Å; Y570-R577 WeakPolarHBondContact CB-O 3.38Å; Y570-S579 PolarHBondContact O-OG 2.63Å; Y570-Y585 HydrophobicContact CD1-CD2 4.29Å; Y570-Y585 AromaticContact CD1-CE2 3.78Å; Y570-Y585 HydrophobicContact CD1-CE2 3.78Å; Y570-Y585 HydrophobicContact CE1-CD2 4.26Å; Y570-Y585 AromaticContact CE1-CE2 3.72Å; Y570-Y585 HydrophobicContact CE1-CE2 3.72Å; Y570-P586 HydrophobicContact CE1-CB 4.1Å; Y570-P586 WeakPolarHBondContact CE2-O 3.33Å; Y570-P586 PolarHBondContact OH-O 3.16Å; Y570-C588 HydrophobicContact CD2-CB 4.42Å
571	N	78	Confident	76.1	Confident	46 Å²	46	57.2 Å²	57.2	25%	0.246	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	170.8	177.4	-171.2	-29.5	0	0	0	108.2	C575 E576 R577 C578 S579	N571-C575 CarbonylContact O-C 3.36Å; N571-C575 VanDerWaalsContact O-C 3.23Å; N571-C575 WeakPolarHBondContact O-CA 3.39Å; N571-E576 PolarHBondContact O-N 2.88Å; N571-R577 VanDerWaalsContact C-CG 3.48Å; N571-R577 HydrophobicContact CB-CG 4.01Å; N571-R577 PolarHBondContact N-O 2.73Å; N571-R577 WeakPolarHBondContact O-CG 3.03Å; N571-R577 PolarHBondContact O-N 3.06Å; N571-R577 VanDerWaalsContact O-O 3.12Å; N571-R577 PolarHBondContact OD1-NE 3.42Å; N571-R577 VanDerWaalsContact OD1-NE 3.17Å; N571-R577 PolarHBondContact OD1-NH2 2.74Å; N571-C578 WeakPolarHBondContact CB-O 3.03Å; N571-S579 WeakPolarHBondContact CB-OG 3.41Å
572	G	72.9	Confident	76.3	Confident	2 Å²	2	54.8 Å²	54.8	2%	0.021	31%	0.307	C	S	.	.	S	Bend	trans	106.5	154.5	-173.8	0	0	0	0	0	111.4	A574 C575 E576	G572-A574 VanDerWaalsContact C-N 3.28Å; G572-A574 PolarHBondContact O-N 2.75Å; G572-C575 PolarHBondContact O-N 2.04Å; G572-C575 VanDerWaalsContact O-N 3.08Å; G572-E576 VanDerWaalsContact C-OE2 3.3Å; G572-E576 WeakPolarHBondContact CA-OE1 3.35Å; G572-E576 WeakPolarHBondContact CA-OE2 3Å
573	T	74.8	Confident	76.4	Confident	105 Å²	105	55.4 Å²	55.4	64%	0.644	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-25.4	-174.6	48	0	0	0	0	113.3	E576	T573-E576 PolarHBondContact N-OE1 2.93Å; T573-E576 PolarHBondContact N-OE2 3.17Å
574	A	79.3	Confident	76.3	Confident	35 Å²	35	55.7 Å²	55.7	29%	0.289	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	10.8	167.8	0	0	0	0	0	111.8	S548 S552 G572 E576	S548-A574 WeakPolarHBondContact CB-O 3.47Å; S548-A574 PolarHBondContact N-O 2.96Å; S552-A574 PolarHBondContact OG-O 3.02Å; G572-A574 VanDerWaalsContact C-N 3.28Å; G572-A574 PolarHBondContact O-N 2.75Å; A574-E576 VanDerWaalsContact C-OE2 3.29Å; A574-E576 WeakPolarHBondContact CA-OE2 3.41Å; A574-E576 PolarHBondContact N-OE2 2.92Å
575	C	82.4	Confident	75.8	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	33%	0.327	C	S	.	.	S	Bend	trans	71.2	42.2	-179.8	-45.3	0	0	0	0	115.6	G551 S552 C566 N571 G572	G551-C575 WeakPolarHBondContact CA-O 3.24Å; G551-C575 WeakPolarHBondContact O-CB 3.48Å; S552-C575 PolarHBondContact OG-SG 2.8Å; S552-C575 VanDerWaalsContact OG-SG 3.41Å; C566-C575 WeakPolarHBondContact CA-SG 3.48Å; C566-C575 HydrophobicContact CB-CB 3.68Å; C566-C575 WeakPolarHBondContact CB-SG 3.26Å; C566-C575 PolarHBondContact N-SG 2.83Å; C566-C575 VanDerWaalsContact SG-CA 3.53Å; C566-C575 WeakPolarHBondContact SG-CB 3.2Å; C566-C575 CovalentContact SG-SG 2.04Å; C566-C575 PolarHBondContact SG-SG 3.24Å; N571-C575 CarbonylContact O-C 3.36Å; N571-C575 VanDerWaalsContact O-C 3.23Å; N571-C575 WeakPolarHBondContact O-CA 3.39Å; G572-C575 PolarHBondContact O-N 2.04Å; G572-C575 VanDerWaalsContact O-N 3.08Å
576	E	81.1	Confident	75.5	Confident	87 Å²	87	61.5 Å²	61.5	41%	0.407	33%	0.331	S	S	.	.			trans	-92.3	3.9	-170.4	68.6	-74.5	165.4	0	0	117.6	N571 G572 T573 A574 Y585	N571-E576 PolarHBondContact O-N 2.88Å; G572-E576 VanDerWaalsContact C-OE2 3.3Å; G572-E576 WeakPolarHBondContact CA-OE1 3.35Å; G572-E576 WeakPolarHBondContact CA-OE2 3Å; T573-E576 PolarHBondContact N-OE1 2.93Å; T573-E576 PolarHBondContact N-OE2 3.17Å; A574-E576 VanDerWaalsContact C-OE2 3.29Å; A574-E576 WeakPolarHBondContact CA-OE2 3.41Å; A574-E576 PolarHBondContact N-OE2 2.92Å; E576-Y585 WeakPolarHBondContact O-CE2 3.49Å; E576-Y585 PolarHBondContact O-OH 2.98Å
577	R	82.8	Confident	75.3	Confident	141 Å²	141	67.4 Å²	67.4	53%	0.532	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	177.6	-179.2	54.3	172.7	-174.1	-172.3	3.5	111.8	Y570 N571	Y570-R577 CarbonylContact C-O 3.56Å; Y570-R577 VanDerWaalsContact CA-O 3.23Å; Y570-R577 WeakPolarHBondContact CA-O 3.33Å; Y570-R577 WeakPolarHBondContact CB-O 3.38Å; N571-R577 VanDerWaalsContact C-CG 3.48Å; N571-R577 HydrophobicContact CB-CG 4.01Å; N571-R577 PolarHBondContact N-O 2.73Å; N571-R577 WeakPolarHBondContact O-CG 3.03Å; N571-R577 PolarHBondContact O-N 3.06Å; N571-R577 VanDerWaalsContact O-O 3.12Å; N571-R577 PolarHBondContact OD1-NE 3.42Å; N571-R577 VanDerWaalsContact OD1-NE 3.17Å; N571-R577 PolarHBondContact OD1-NH2 2.74Å
578	C	76.5	Confident	75.3	Confident	28 Å²	28	64.1 Å²	64.1	19%	0.189	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	155.5	168.4	-61.6	0	0	0	0	112.2	N569 N571 Y585 C588	N569-C578 WeakPolarHBondContact O-CA 3.31Å; N571-C578 WeakPolarHBondContact CB-O 3.03Å; C578-Y585 WeakPolarHBondContact SG-CA 3.29Å; C578-Y585 VanDerWaalsContact SG-CB 3.55Å; C578-Y585 PolarHBondContact SG-N 3.17Å; C578-Y585 VanDerWaalsContact SG-N 3.43Å; C578-C588 WeakPolarHBondContact CA-SG 3.29Å; C578-C588 HydrophobicContact CB-CB 3.97Å; C578-C588 WeakPolarHBondContact CB-SG 3.26Å; C578-C588 WeakPolarHBondContact SG-CA 3.3Å; C578-C588 WeakPolarHBondContact SG-CB 3.42Å; C578-C588 CovalentContact SG-SG 2.05Å; C578-C588 PolarHBondContact SG-SG 2.85Å
579	S	72.1	Confident	75.3	Confident	34 Å²	34	59.7 Å²	59.7	24%	0.238	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-74.1	152.7	168.6	-91.5	0	0	0	0	112.3	N569 Y570 N571 Y582	N569-S579 PolarHBondContact O-N 2.77Å; Y570-S579 PolarHBondContact O-OG 2.63Å; N571-S579 WeakPolarHBondContact CB-OG 3.41Å; S579-Y582 WeakPolarHBondContact O-CB 3.33Å; S579-Y582 PolarHBondContact O-N 3.08Å
580	S	69.2	Low	74.7	Confident	116 Å²	116	62.5 Å²	62.5	81%	0.811	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	137.2	168.3	-52.8	0	0	0	0	110	Y582	S580-Y582 VanDerWaalsContact C-N 3.33Å; S580-Y582 WeakPolarHBondContact O-CD2 3.36Å
581	G	66.1	Low	73.9	Confident	31 Å²	31	61.2 Å²	61.2	32%	0.32	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.1	12.4	-167.7	0	0	0	0	0	114	F590 C591	G581-F590 VanDerWaalsContact O-CD2 3.27Å; G581-F590 WeakPolarHBondContact O-CD2 3.36Å; G581-C591 WeakPolarHBondContact O-CB 3.47Å; G581-C591 PolarHBondContact O-N 2.75Å
582	Y	75.6	Confident	73.3	Confident	47 Å²	47	63.6 Å²	63.6	18%	0.184	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	145.7	170.5	-53.8	-102	0	0	0	109.9	N569 S579 S580 T589 F590	N569-Y582 VanDerWaalsContact CA-CD1 3.46Å; N569-Y582 HydrophobicContact CB-CD1 3.18Å; N569-Y582 HydrophobicContact CB-CE1 3.58Å; N569-Y582 HydrophobicContact CB-CG 3.79Å; N569-Y582 WeakPolarHBondContact OD1-CD1 3.45Å; N569-Y582 WeakPolarHBondContact OD1-CE1 3.38Å; S579-Y582 WeakPolarHBondContact O-CB 3.33Å; S579-Y582 PolarHBondContact O-N 3.08Å; S580-Y582 VanDerWaalsContact C-N 3.33Å; S580-Y582 WeakPolarHBondContact O-CD2 3.36Å; Y582-T589 CarbonylContact C-O 3.4Å; Y582-T589 WeakPolarHBondContact CA-O 3.47Å; Y582-T589 WeakPolarHBondContact CB-O 3.41Å; Y582-F590 HydrophobicContact CD1-CB 3.6Å; Y582-F590 AromaticContact CD1-CD2 3.59Å; Y582-F590 HydrophobicContact CD1-CD2 3.59Å; Y582-F590 HydrophobicContact CD1-CG 4.03Å; Y582-F590 HydrophobicContact CD2-CD2 4.36Å; Y582-F590 HydrophobicContact CE1-CB 3.59Å; Y582-F590 AromaticContact CE1-CD2 3.22Å; Y582-F590 HydrophobicContact CE1-CD2 3.22Å; Y582-F590 HydrophobicContact CE1-CE2 4.12Å; Y582-F590 AromaticContact CE1-CG 3.68Å; Y582-F590 HydrophobicContact CE1-CG 3.68Å; Y582-F590 HydrophobicContact CE2-CD2 4.08Å; Y582-F590 HydrophobicContact CE2-CE2 4.38Å; Y582-F590 HydrophobicContact CG-CD2 4.17Å; Y582-F590 AromaticContact CZ-CD2 3.52Å; Y582-F590 AromaticContact CZ-CE2 3.97Å
583	F	75.4	Confident	73.4	Confident	36 Å²	36	64.4 Å²	64.4	16%	0.158	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	161.6	-173.4	64.4	-76.6	0	0	0	112	C588 T589 D605 T606	F583-C588 CarbonylContact O-C 3.35Å; F583-C588 VanDerWaalsContact O-C 3.3Å; F583-C588 WeakPolarHBondContact O-CA 3.44Å; F583-T589 WeakPolarHBondContact CD1-O 3.49Å; F583-T589 WeakPolarHBondContact CD1-OG1 3.47Å; F583-T589 WeakPolarHBondContact CD2-OG1 3.32Å; F583-T589 WeakPolarHBondContact CE1-O 3.32Å; F583-T589 VanDerWaalsContact CE1-OG1 3.24Å; F583-T589 WeakPolarHBondContact CE1-OG1 3.04Å; F583-T589 WeakPolarHBondContact CE2-OG1 3.4Å; F583-T589 WeakPolarHBondContact CZ-OG1 3.05Å; F583-T589 PolarHBondContact N-O 2.86Å; F583-T589 PolarHBondContact O-N 2.76Å; F583-T589 PolarHBondContact O-OG1 2.99Å; F583-D605 VanDerWaalsContact CB-C 3.42Å; F583-D605 WeakPolarHBondContact CB-O 3.49Å; F583-T606 WeakPolarHBondContact CD2-O 3.4Å
584	N	77.2	Confident	73	Confident	88 Å²	88	61.9 Å²	61.9	47%	0.471	33%	0.326	S	S	.	.	S	Bend	trans	70.9	64.1	167.6	-168.2	11.9	0	0	0	117	K587 C588	N584-K587 CarbonylContact O-C 3.44Å; N584-K587 WeakPolarHBondContact O-CA 3.42Å; N584-K587 WeakPolarHBondContact O-CB 3.14Å; N584-K587 PolarHBondContact O-N 3.27Å; N584-C588 PolarHBondContact O-N 2.89Å
585	Y	71.5	Confident	72.4	Confident	110 Å²	110	65.2 Å²	65.2	43%	0.431	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	143	175	-176	-94.3	0	0	0	113.1	Y570 E576 C578	Y570-Y585 HydrophobicContact CD1-CD2 4.29Å; Y570-Y585 AromaticContact CD1-CE2 3.78Å; Y570-Y585 HydrophobicContact CD1-CE2 3.78Å; Y570-Y585 HydrophobicContact CE1-CD2 4.26Å; Y570-Y585 AromaticContact CE1-CE2 3.72Å; Y570-Y585 HydrophobicContact CE1-CE2 3.72Å; E576-Y585 WeakPolarHBondContact O-CE2 3.49Å; E576-Y585 PolarHBondContact O-OH 2.98Å; C578-Y585 WeakPolarHBondContact SG-CA 3.29Å; C578-Y585 VanDerWaalsContact SG-CB 3.55Å; C578-Y585 PolarHBondContact SG-N 3.17Å; C578-Y585 VanDerWaalsContact SG-N 3.43Å
586	P	68.8	Low	71.8	Confident	63 Å²	63	66.4 Å²	66.4	41%	0.409	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	cis	-82.8	-3	-4.4	34.4	-36.6	0	0	0	113.7	Y570 C588	Y570-P586 HydrophobicContact CE1-CB 4.1Å; Y570-P586 WeakPolarHBondContact CE2-O 3.33Å; Y570-P586 PolarHBondContact OH-O 3.16Å; P586-C588 PolarHBondContact O-N 2.78Å
587	K	75.3	Confident	71.4	Confident	159 Å²	159	62.3 Å²	62.3	69%	0.691	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-30.6	179.8	-69.3	-173.6	175.9	-177.3	0	112.9	N584 T589	N584-K587 CarbonylContact O-C 3.44Å; N584-K587 WeakPolarHBondContact O-CA 3.42Å; N584-K587 WeakPolarHBondContact O-CB 3.14Å; N584-K587 PolarHBondContact O-N 3.27Å; K587-T589 PolarHBondContact O-N 2.91Å
588	C	75	Confident	71.1	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	31%	0.31	C	S	.	.			trans	38.9	74.4	179.6	-62.5	0	0	0	0	111.4	N569 Y570 C578 F583 N584 P586	N569-C588 HydrophobicContact CB-CB 3.51Å; N569-C588 WeakPolarHBondContact CB-O 3.42Å; N569-C588 PolarHBondContact ND2-O 2.89Å; N569-C588 WeakPolarHBondContact O-CB 3.37Å; Y570-C588 HydrophobicContact CD2-CB 4.42Å; C578-C588 WeakPolarHBondContact CA-SG 3.29Å; C578-C588 HydrophobicContact CB-CB 3.97Å; C578-C588 WeakPolarHBondContact CB-SG 3.26Å; C578-C588 WeakPolarHBondContact SG-CA 3.3Å; C578-C588 WeakPolarHBondContact SG-CB 3.42Å; C578-C588 CovalentContact SG-SG 2.05Å; C578-C588 PolarHBondContact SG-SG 2.85Å; F583-C588 CarbonylContact O-C 3.35Å; F583-C588 VanDerWaalsContact O-C 3.3Å; F583-C588 WeakPolarHBondContact O-CA 3.44Å; N584-C588 PolarHBondContact O-N 2.89Å; P586-C588 PolarHBondContact O-N 2.78Å
589	T	70.1	Confident	70.7	Confident	54 Å²	54	58.3 Å²	58.3	33%	0.331	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	141.1	177.1	31.8	0	0	0	0	111.1	Y582 F583 K587	Y582-T589 CarbonylContact C-O 3.4Å; Y582-T589 WeakPolarHBondContact CA-O 3.47Å; Y582-T589 WeakPolarHBondContact CB-O 3.41Å; F583-T589 WeakPolarHBondContact CD1-O 3.49Å; F583-T589 WeakPolarHBondContact CD1-OG1 3.47Å; F583-T589 WeakPolarHBondContact CD2-OG1 3.32Å; F583-T589 WeakPolarHBondContact CE1-O 3.32Å; F583-T589 VanDerWaalsContact CE1-OG1 3.24Å; F583-T589 WeakPolarHBondContact CE1-OG1 3.04Å; F583-T589 WeakPolarHBondContact CE2-OG1 3.4Å; F583-T589 WeakPolarHBondContact CZ-OG1 3.05Å; F583-T589 PolarHBondContact N-O 2.86Å; F583-T589 PolarHBondContact O-N 2.76Å; F583-T589 PolarHBondContact O-OG1 2.99Å; K587-T589 PolarHBondContact O-N 2.91Å
590	F	61.4	Low	70.1	Confident	99 Å²	99	62.5 Å²	62.5	43%	0.434	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	136.4	-178.3	-177.2	-134.5	0	0	0	112.7	G581 Y582 N592	G581-F590 VanDerWaalsContact O-CD2 3.27Å; G581-F590 WeakPolarHBondContact O-CD2 3.36Å; Y582-F590 HydrophobicContact CD1-CB 3.6Å; Y582-F590 AromaticContact CD1-CD2 3.59Å; Y582-F590 HydrophobicContact CD1-CD2 3.59Å; Y582-F590 HydrophobicContact CD1-CG 4.03Å; Y582-F590 HydrophobicContact CD2-CD2 4.36Å; Y582-F590 HydrophobicContact CE1-CB 3.59Å; Y582-F590 AromaticContact CE1-CD2 3.22Å; Y582-F590 HydrophobicContact CE1-CD2 3.22Å; Y582-F590 HydrophobicContact CE1-CE2 4.12Å; Y582-F590 AromaticContact CE1-CG 3.68Å; Y582-F590 HydrophobicContact CE1-CG 3.68Å; Y582-F590 HydrophobicContact CE2-CD2 4.08Å; Y582-F590 HydrophobicContact CE2-CE2 4.38Å; Y582-F590 HydrophobicContact CG-CD2 4.17Å; Y582-F590 AromaticContact CZ-CD2 3.52Å; Y582-F590 AromaticContact CZ-CE2 3.97Å; F590-N592 HydrophobicContact CD1-CB 3.95Å; F590-N592 HydrophobicContact CE1-CB 4.12Å; F590-N592 PolarHBondContact O-N 3.15Å
591	C	67.1	Low	69.6	Low	5 Å²	5	64.3 Å²	64.3	3%	0.034	34%	0.343	C	S	.	.			trans	-78.3	93.4	161.5	-63.4	0	0	0	0	109.1	G581 C593 C603	G581-C591 WeakPolarHBondContact O-CB 3.47Å; G581-C591 PolarHBondContact O-N 2.75Å; C591-C593 VanDerWaalsContact C-N 3.25Å; C591-C593 PolarHBondContact O-N 2.83Å; C591-C603 HydrophobicContact CB-CB 3.35Å; C591-C603 WeakPolarHBondContact CB-SG 3.16Å; C591-C603 WeakPolarHBondContact SG-CB 3.3Å; C591-C603 CovalentContact SG-SG 2.02Å; C591-C603 PolarHBondContact SG-SG 3.05Å
592	N	65	Low	69.1	Low	96 Å²	96	64.4 Å²	64.4	51%	0.513	34%	0.336	S	S	.	.			trans	-73.9	76.7	-176.8	-168.4	27.6	0	0	0	111.5	F590 C610 S620	F590-N592 HydrophobicContact CD1-CB 3.95Å; F590-N592 HydrophobicContact CE1-CB 4.12Å; F590-N592 PolarHBondContact O-N 3.15Å; N592-C610 VanDerWaalsContact C-SG 3.54Å; N592-C610 PolarHBondContact O-SG 3.23Å; N592-S620 PolarHBondContact ND2-OG 2.63Å; N592-S620 VanDerWaalsContact ND2-OG 3.16Å; N592-S620 WeakPolarHBondContact O-CA 3.26Å; N592-S620 WeakPolarHBondContact O-CB 3.36Å; N592-S620 PolarHBondContact O-OG 3.35Å
593	C	73.9	Confident	68.8	Low	19 Å²	19	63.5 Å²	63.5	13%	0.128	34%	0.336	C	S	.	.			trans	-125.6	129.6	-175.1	-43.2	0	0	0	0	111.2	C591 I602 C610	C591-C593 VanDerWaalsContact C-N 3.25Å; C591-C593 PolarHBondContact O-N 2.83Å; C593-I602 HydrophobicContact CB-CB 4.22Å; C593-I602 HydrophobicContact CB-CG2 3.46Å; C593-I602 VanDerWaalsContact CB-CG2 3.46Å; C593-C610 WeakPolarHBondContact CA-SG 3.49Å; C593-C610 HydrophobicContact CB-CB 3.74Å; C593-C610 WeakPolarHBondContact CB-SG 3.29Å; C593-C610 VanDerWaalsContact SG-CA 3.56Å; C593-C610 WeakPolarHBondContact SG-CB 3.37Å; C593-C610 CovalentContact SG-SG 2.03Å; C593-C610 PolarHBondContact SG-SG 2.79Å
594	N	67.5	Low	68.4	Low	51 Å²	51	65 Å²	65	27%	0.273	35%	0.346	S	S	.	.			trans	-89.4	110.1	-177.9	-169.2	-31.5	0	0	0	110.3	A596 G597 A598 S620 D622 F631	N594-A596 PolarHBondContact O-N 2.9Å; N594-A596 VanDerWaalsContact O-N 3.12Å; N594-A596 WeakPolarHBondContact OD1-CB 3.31Å; N594-A596 PolarHBondContact OD1-N 2.04Å; N594-G597 PolarHBondContact O-N 3.15Å; N594-A598 WeakPolarHBondContact O-CB 3.29Å; N594-A598 PolarHBondContact O-N 2.88Å; N594-A598 VanDerWaalsContact O-N 3.13Å; N594-S620 WeakPolarHBondContact CA-O 3.5Å; N594-S620 WeakPolarHBondContact CB-O 3.5Å; N594-S620 PolarHBondContact N-O 2.69Å; N594-D622 HydrophobicContact CB-CB 3.96Å; N594-F631 HydrophobicContact CB-CZ 4.35Å; N594-F631 VanDerWaalsContact CG-CZ 3.45Å; N594-F631 VanDerWaalsContact ND2-CE1 3.34Å; N594-F631 WeakPolarHBondContact ND2-CE1 3.5Å; N594-F631 VanDerWaalsContact ND2-CZ 3.27Å; N594-F631 WeakPolarHBondContact ND2-CZ 3.47Å
595	T	65.6	Low	67.9	Low	105 Å²	105	66.8 Å²	66.8	64%	0.644	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-29.6	-174.3	51.5	0	0	0	0	114	I602	T595-I602 HydrophobicContact CG2-CD1 3.98Å
596	A	70.4	Confident	67.8	Low	26 Å²	26	66.4 Å²	66.4	22%	0.215	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-43.3	175.2	0	0	0	0	0	112.7	N594 K613 F631 P632	N594-A596 PolarHBondContact O-N 2.9Å; N594-A596 VanDerWaalsContact O-N 3.12Å; N594-A596 WeakPolarHBondContact OD1-CB 3.31Å; N594-A596 PolarHBondContact OD1-N 2.04Å; A596-K613 WeakPolarHBondContact O-CD 3.09Å; A596-K613 WeakPolarHBondContact O-CE 3.34Å; A596-K613 PolarHBondContact O-NZ 2.75Å; A596-F631 HydrophobicContact CB-CE1 3.68Å; A596-F631 HydrophobicContact CB-CZ 3.63Å; A596-P632 HydrophobicContact CB-CB 3.33Å
597	G	73.3	Confident	67.9	Low	0 Å²	0	67.5 Å²	67.5	0%	0	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	8.5	-177	0	0	0	0	0	114.9	N594 C612 K613 H616 C621	N594-G597 PolarHBondContact O-N 3.15Å; G597-C612 CarbonylContact O-C 3.57Å; G597-C612 WeakPolarHBondContact O-CA 3.26Å; G597-K613 WeakPolarHBondContact O-CB 3.26Å; G597-K613 PolarHBondContact O-N 2.83Å; G597-H616 VanDerWaalsContact CA-CD2 3.46Å; G597-H616 WeakPolarHBondContact CA-CD2 3.03Å; G597-C621 WeakPolarHBondContact CA-O 3.45Å; G597-C621 VanDerWaalsContact O-CB 3.31Å; G597-C621 WeakPolarHBondContact O-CB 3.41Å
598	A	75.7	Confident	67.5	Low	3 Å²	3	60.5 Å²	60.5	3%	0.025	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	156.6	-169.2	0	0	0	0	0	114.2	N594 I602 K611 K613 C621	N594-A598 WeakPolarHBondContact O-CB 3.29Å; N594-A598 PolarHBondContact O-N 2.88Å; N594-A598 VanDerWaalsContact O-N 3.13Å; A598-I602 HydrophobicContact CB-CD1 4.04Å; A598-I602 HydrophobicContact CB-CG2 3.34Å; A598-K611 CarbonylContact C-O 3.21Å; A598-K611 WeakPolarHBondContact CA-O 3.38Å; A598-K611 VanDerWaalsContact CB-O 3.31Å; A598-K611 WeakPolarHBondContact CB-O 3.28Å; A598-K613 WeakPolarHBondContact O-CE 3.34Å; A598-C621 HydrophobicContact CB-CB 3.92Å
599	L	67.9	Low	67.3	Low	82 Å²	82	63.6 Å²	63.6	43%	0.429	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	140	-174.3	-64.1	174.1	0	0	0	111.4	E601 I602 K611 K613	L599-E601 VanDerWaalsContact C-N 3.34Å; L599-E601 PolarHBondContact O-N 2.9Å; L599-I602 WeakPolarHBondContact O-CA 3.39Å; L599-I602 WeakPolarHBondContact O-CB 3.25Å; L599-I602 WeakPolarHBondContact O-CG1 3.05Å; L599-I602 PolarHBondContact O-N 3.24Å; L599-K611 HydrophobicContact CB-CB 4.12Å; L599-K611 HydrophobicContact CD1-CB 4.32Å; L599-K611 PolarHBondContact N-O 3.01Å; L599-K613 HydrophobicContact CD2-CG 4.11Å
600	P	60.2	Low	67.5	Low	122 Å²	122	62.6 Å²	62.6	79%	0.792	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-53.3	-30.5	-162	-31.9	36.8	0	0	0	118.8	I602	P600-I602 WeakPolarHBondContact O-CG1 3.49Å; P600-I602 PolarHBondContact O-N 2.78Å; P600-I602 VanDerWaalsContact O-N 3.12Å
601	E	57.9	Low	68.1	Low	154 Å²	154	62.1 Å²	62.1	72%	0.72	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.5	58.9	173.5	-62.9	-178.5	162.6	0	0	111.1	L599 C603 K611	L599-E601 VanDerWaalsContact C-N 3.34Å; L599-E601 PolarHBondContact O-N 2.9Å; E601-C603 PolarHBondContact O-N 2.98Å; E601-C603 VanDerWaalsContact O-N 3.17Å; E601-K611 WeakPolarHBondContact O-CD 3.1Å; E601-K611 VanDerWaalsContact O-CE 3.26Å; E601-K611 WeakPolarHBondContact O-CE 3.43Å; E601-K611 PolarHBondContact O-NZ 2.75Å; E601-K611 IonicContact OE2-NZ 2.64Å; E601-K611 PolarHBondContact OE2-NZ 3.48Å
602	I	56.4	Low	68.7	Low	33 Å²	33	64.4 Å²	64.4	17%	0.169	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	-34.1	-142.7	-32.8	-143.5	0	0	0	114.8	C593 T595 A598 L599 P600 C610 K611	C593-I602 HydrophobicContact CB-CB 4.22Å; C593-I602 HydrophobicContact CB-CG2 3.46Å; C593-I602 VanDerWaalsContact CB-CG2 3.46Å; T595-I602 HydrophobicContact CG2-CD1 3.98Å; A598-I602 HydrophobicContact CB-CD1 4.04Å; A598-I602 HydrophobicContact CB-CG2 3.34Å; L599-I602 WeakPolarHBondContact O-CA 3.39Å; L599-I602 WeakPolarHBondContact O-CB 3.25Å; L599-I602 WeakPolarHBondContact O-CG1 3.05Å; L599-I602 PolarHBondContact O-N 3.24Å; P600-I602 WeakPolarHBondContact O-CG1 3.49Å; P600-I602 PolarHBondContact O-N 2.78Å; P600-I602 VanDerWaalsContact O-N 3.12Å; I602-C610 CarbonylContact O-C 3.58Å; I602-C610 WeakPolarHBondContact O-CA 3.24Å; I602-K611 PolarHBondContact O-N 3.3Å
603	C	68.9	Low	69.3	Low	28 Å²	28	63.4 Å²	63.4	19%	0.189	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	164	-177.7	77.4	0	0	0	0	114.2	C591 E601 A609	C591-C603 HydrophobicContact CB-CB 3.35Å; C591-C603 WeakPolarHBondContact CB-SG 3.16Å; C591-C603 WeakPolarHBondContact SG-CB 3.3Å; C591-C603 CovalentContact SG-SG 2.02Å; C591-C603 PolarHBondContact SG-SG 3.05Å; E601-C603 PolarHBondContact O-N 2.98Å; E601-C603 VanDerWaalsContact O-N 3.17Å; C603-A609 VanDerWaalsContact CA-O 3.3Å; C603-A609 WeakPolarHBondContact CA-O 3.17Å
604	N	67.2	Low	69.8	Low	69 Å²	69	67.7 Å²	67.7	37%	0.369	40%	0.396	S	S	.	.			trans	-89.6	123.4	172.7	175.9	-49	0	0	0	110.3	T606 T607 G608	N604-T606 PolarHBondContact O-N 3.28Å; N604-T606 WeakPolarHBondContact OD1-CA 3.26Å; N604-T606 PolarHBondContact OD1-N 2.94Å; N604-T606 PolarHBondContact OD1-OG1 3.37Å; N604-T607 WeakPolarHBondContact CB-OG1 3.23Å; N604-T607 VanDerWaalsContact CG-OG1 3.28Å; N604-T607 PolarHBondContact O-N 3.13Å; N604-T607 VanDerWaalsContact O-N 3.15Å; N604-T607 PolarHBondContact OD1-N 3.09Å; N604-G608 PolarHBondContact O-N 3.43Å
605	D	66.1	Low	70.4	Confident	124 Å²	124	67.4 Å²	67.4	66%	0.663	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	6.2	-177.6	51.1	-62.7	0	0	0	115.3	F583	F583-D605 VanDerWaalsContact CB-C 3.42Å; F583-D605 WeakPolarHBondContact CB-O 3.49Å
606	T	70.6	Confident	71.3	Confident	102 Å²	102	63 Å²	63	63%	0.626	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.7	-22.7	165.8	63.8	0	0	0	0	114.7	F583 N604	F583-T606 WeakPolarHBondContact CD2-O 3.4Å; N604-T606 PolarHBondContact O-N 3.28Å; N604-T606 WeakPolarHBondContact OD1-CA 3.26Å; N604-T606 PolarHBondContact OD1-N 2.94Å; N604-T606 PolarHBondContact OD1-OG1 3.37Å
607	T	70.5	Confident	71.6	Confident	86 Å²	86	63 Å²	63	53%	0.528	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121	-14.4	-174.2	72	0	0	0	0	116	N604 A609	N604-T607 WeakPolarHBondContact CB-OG1 3.23Å; N604-T607 VanDerWaalsContact CG-OG1 3.28Å; N604-T607 PolarHBondContact O-N 3.13Å; N604-T607 VanDerWaalsContact O-N 3.15Å; N604-T607 PolarHBondContact OD1-N 3.09Å; T607-A609 VanDerWaalsContact C-N 3.29Å; T607-A609 PolarHBondContact O-N 3.36Å
608	G	66.5	Low	71.6	Confident	13 Å²	13	64 Å²	64	13%	0.134	38%	0.378	C	S	.	.			trans	76.3	-4.2	172.1	0	0	0	0	0	117.6	N604	N604-G608 PolarHBondContact O-N 3.43Å
609	A	70.8	Confident	71.4	Confident	64 Å²	64	71.2 Å²	71.2	53%	0.529	42%	0.416	S	S	.	.			trans	-73.9	140.8	-174.5	0	0	0	0	0	113.6	C603 T607	C603-A609 VanDerWaalsContact CA-O 3.3Å; C603-A609 WeakPolarHBondContact CA-O 3.17Å; T607-A609 VanDerWaalsContact C-N 3.29Å; T607-A609 PolarHBondContact O-N 3.36Å
610	C	73.9	Confident	71.3	Confident	33 Å²	33	68 Å²	68	22%	0.223	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	148.8	-173.4	-56.4	0	0	0	0	114.5	N592 C593 I602	N592-C610 VanDerWaalsContact C-SG 3.54Å; N592-C610 PolarHBondContact O-SG 3.23Å; C593-C610 WeakPolarHBondContact CA-SG 3.49Å; C593-C610 HydrophobicContact CB-CB 3.74Å; C593-C610 WeakPolarHBondContact CB-SG 3.29Å; C593-C610 VanDerWaalsContact SG-CA 3.56Å; C593-C610 WeakPolarHBondContact SG-CB 3.37Å; C593-C610 CovalentContact SG-SG 2.03Å; C593-C610 PolarHBondContact SG-SG 2.79Å; I602-C610 CarbonylContact O-C 3.58Å; I602-C610 WeakPolarHBondContact O-CA 3.24Å
611	K	75.3	Confident	72.3	Confident	89 Å²	89	62.2 Å²	62.2	39%	0.387	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	110.9	176.2	-59.6	171.4	-174.2	163.3	0	111.9	A598 L599 E601 I602	A598-K611 CarbonylContact C-O 3.21Å; A598-K611 WeakPolarHBondContact CA-O 3.38Å; A598-K611 VanDerWaalsContact CB-O 3.31Å; A598-K611 WeakPolarHBondContact CB-O 3.28Å; L599-K611 HydrophobicContact CB-CB 4.12Å; L599-K611 HydrophobicContact CD1-CB 4.32Å; L599-K611 PolarHBondContact N-O 3.01Å; E601-K611 WeakPolarHBondContact O-CD 3.1Å; E601-K611 VanDerWaalsContact O-CE 3.26Å; E601-K611 WeakPolarHBondContact O-CE 3.43Å; E601-K611 PolarHBondContact O-NZ 2.75Å; E601-K611 IonicContact OE2-NZ 2.64Å; E601-K611 PolarHBondContact OE2-NZ 3.48Å; I602-K611 PolarHBondContact O-N 3.3Å
612	C	79	Confident	72.9	Confident	54 Å²	54	58.5 Å²	58.5	37%	0.365	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	155.9	-175.5	-51.7	0	0	0	0	115.7	G597 C621	G597-C612 CarbonylContact O-C 3.57Å; G597-C612 WeakPolarHBondContact O-CA 3.26Å; C612-C621 WeakPolarHBondContact CA-SG 3.35Å; C612-C621 HydrophobicContact CB-CB 3.7Å; C612-C621 WeakPolarHBondContact CB-SG 3.47Å; C612-C621 VanDerWaalsContact SG-CA 3.55Å; C612-C621 WeakPolarHBondContact SG-CB 3.05Å; C612-C621 CovalentContact SG-SG 2.04Å; C612-C621 PolarHBondContact SG-SG 3.45Å
613	K	78.5	Confident	74	Confident	74 Å²	74	64 Å²	64	32%	0.322	37%	0.367	S	S	.	.			trans	-82	162.8	170.2	-67.4	177.5	-169	172.8	0	111.6	A596 G597 A598 L599 H616	A596-K613 WeakPolarHBondContact O-CD 3.09Å; A596-K613 WeakPolarHBondContact O-CE 3.34Å; A596-K613 PolarHBondContact O-NZ 2.75Å; G597-K613 WeakPolarHBondContact O-CB 3.26Å; G597-K613 PolarHBondContact O-N 2.83Å; A598-K613 WeakPolarHBondContact O-CE 3.34Å; L599-K613 HydrophobicContact CD2-CG 4.11Å; K613-H616 WeakPolarHBondContact CB-ND1 3.47Å; K613-H616 PolarHBondContact O-N 3.45Å
614	P	82.9	Confident	74.6	Confident	109 Å²	109	63 Å²	63	71%	0.708	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-44.5	-167.7	-26.1	36.3	0	0	0	116.8	H616 R625	P614-H616 VanDerWaalsContact C-N 3.26Å; P614-H616 PolarHBondContact O-N 3.37Å; P614-R625 VanDerWaalsContact O-CZ 3.3Å; P614-R625 PolarHBondContact O-NE 3.5Å; P614-R625 PolarHBondContact O-NH2 2.85Å
615	T	80.1	Confident	75.3	Confident	45 Å²	45	65.9 Å²	65.9	28%	0.276	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-4.1	-178.2	47.2	0	0	0	0	113.6	R625 Y628	T615-R625 WeakPolarHBondContact O-CB 3.47Å; T615-R625 PolarHBondContact O-N 2.63Å; T615-Y628 HydrophobicContact CG2-CD1 4.34Å; T615-Y628 HydrophobicContact CG2-CE1 3.91Å
616	H	84.5	Confident	76	Confident	13 Å²	13	65.8 Å²	65.8	6%	0.06	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	159.8	-178.4	-54.2	89.2	0	0	0	111.5	G597 K613 P614 R623 F631 P632 C634	G597-H616 VanDerWaalsContact CA-CD2 3.46Å; G597-H616 WeakPolarHBondContact CA-CD2 3.03Å; K613-H616 WeakPolarHBondContact CB-ND1 3.47Å; K613-H616 PolarHBondContact O-N 3.45Å; P614-H616 VanDerWaalsContact C-N 3.26Å; P614-H616 PolarHBondContact O-N 3.37Å; H616-R623 CarbonylContact C-O 3.53Å; H616-R623 WeakPolarHBondContact CA-O 3.3Å; H616-F631 AromaticContact CD2-CD2 3.84Å; H616-F631 AromaticContact CD2-CE2 3.54Å; H616-P632 PolarHBondContact NE2-O 2.95Å; H616-C634 PolarHBondContact CD2-SG 3.11Å
617	A	78	Confident	76.4	Confident	25 Å²	25	62.1 Å²	62.1	21%	0.207	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	173.7	-176.5	0	0	0	0	0	111.6	C621 D622 R623 R625	A617-C621 CarbonylContact O-C 3.43Å; A617-C621 VanDerWaalsContact O-C 3.27Å; A617-C621 WeakPolarHBondContact O-CA 3.42Å; A617-D622 PolarHBondContact O-N 2.78Å; A617-R623 HydrophobicContact CB-CG 4.29Å; A617-R623 PolarHBondContact N-O 2.93Å; A617-R623 WeakPolarHBondContact O-CG 3.38Å; A617-R623 PolarHBondContact O-N 2.79Å; A617-R623 VanDerWaalsContact O-N 3.14Å; A617-R625 HydrophobicContact CB-CB 4.45Å
618	G	71.7	Confident	77	Confident	21 Å²	21	62 Å²	62	22%	0.216	34%	0.338	C	S	.	.	S	Bend	trans	98.6	156	-173.9	0	0	0	0	0	112.2	S620 C621	G618-S620 PolarHBondContact O-N 3.39Å; G618-C621 PolarHBondContact O-N 3.48Å
619	N	71.7	Confident	77.8	Confident	156 Å²	156	61.4 Å²	61.4	83%	0.834	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-27.4	177.5	-70.9	-1.5	0	0	0	111.7
620	S	66.9	Low	77.9	Confident	15 Å²	15	62 Å²	62	11%	0.105	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	9.1	177.8	-38.1	0	0	0	0	112	N592 N594 G618 D622	N592-S620 PolarHBondContact ND2-OG 2.63Å; N592-S620 VanDerWaalsContact ND2-OG 3.16Å; N592-S620 WeakPolarHBondContact O-CA 3.26Å; N592-S620 WeakPolarHBondContact O-CB 3.36Å; N592-S620 PolarHBondContact O-OG 3.35Å; N594-S620 WeakPolarHBondContact CA-O 3.5Å; N594-S620 WeakPolarHBondContact CB-O 3.5Å; N594-S620 PolarHBondContact N-O 2.69Å; G618-S620 PolarHBondContact O-N 3.39Å; S620-D622 WeakPolarHBondContact CB-OD1 3.4Å; S620-D622 PolarHBondContact N-OD1 2.8Å; S620-D622 PolarHBondContact O-N 3.24Å
621	C	81.2	Confident	77.7	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	33%	0.326	C	S	.	.	S	Bend	trans	54.4	31.9	-174.8	-40.2	0	0	0	0	113.7	G597 A598 C612 A617 G618 F631	G597-C621 WeakPolarHBondContact CA-O 3.45Å; G597-C621 VanDerWaalsContact O-CB 3.31Å; G597-C621 WeakPolarHBondContact O-CB 3.41Å; A598-C621 HydrophobicContact CB-CB 3.92Å; C612-C621 WeakPolarHBondContact CA-SG 3.35Å; C612-C621 HydrophobicContact CB-CB 3.7Å; C612-C621 WeakPolarHBondContact CB-SG 3.47Å; C612-C621 VanDerWaalsContact SG-CA 3.55Å; C612-C621 WeakPolarHBondContact SG-CB 3.05Å; C612-C621 CovalentContact SG-SG 2.04Å; C612-C621 PolarHBondContact SG-SG 3.45Å; A617-C621 CarbonylContact O-C 3.43Å; A617-C621 VanDerWaalsContact O-C 3.27Å; A617-C621 WeakPolarHBondContact O-CA 3.42Å; G618-C621 PolarHBondContact O-N 3.48Å; C621-F631 WeakPolarHBondContact O-CE2 3.08Å
622	D	71.3	Confident	77.1	Confident	75 Å²	75	62.6 Å²	62.6	40%	0.401	33%	0.33	S	S	.	.			trans	-102.1	-2.3	-158.1	55	-50.7	0	0	0	115.2	N594 A617 S620 F631	N594-D622 HydrophobicContact CB-CB 3.96Å; A617-D622 PolarHBondContact O-N 2.78Å; S620-D622 WeakPolarHBondContact CB-OD1 3.4Å; S620-D622 PolarHBondContact N-OD1 2.8Å; S620-D622 PolarHBondContact O-N 3.24Å; D622-F631 VanDerWaalsContact C-CE2 3.41Å
623	R	79.3	Confident	76.7	Confident	149 Å²	149	65.7 Å²	65.7	56%	0.562	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.5	158.1	176.8	54.4	175.2	175.6	175.2	1.6	110.9	H616 A617	H616-R623 CarbonylContact C-O 3.53Å; H616-R623 WeakPolarHBondContact CA-O 3.3Å; A617-R623 HydrophobicContact CB-CG 4.29Å; A617-R623 PolarHBondContact N-O 2.93Å; A617-R623 WeakPolarHBondContact O-CG 3.38Å; A617-R623 PolarHBondContact O-N 2.79Å; A617-R623 VanDerWaalsContact O-N 3.14Å
624	C	81.2	Confident	76.9	Confident	8 Å²	8	62.9 Å²	62.9	5%	0.054	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	152.5	164	-62.3	0	0	0	0	110.5	Y628 F629 F631 C634	C624-Y628 WeakPolarHBondContact CB-O 3.32Å; C624-F629 PolarHBondContact SG-O 3.04Å; C624-F631 PolarHBondContact SG-N 3.38Å; C624-F631 VanDerWaalsContact SG-N 3.37Å; C624-C634 WeakPolarHBondContact CA-SG 3.42Å; C624-C634 HydrophobicContact CB-CB 3.75Å; C624-C634 WeakPolarHBondContact CB-SG 3.3Å; C624-C634 WeakPolarHBondContact SG-CA 3.26Å; C624-C634 WeakPolarHBondContact SG-CB 3.43Å; C624-C634 CovalentContact SG-SG 2.04Å; C624-C634 PolarHBondContact SG-SG 2.71Å
625	R	82.3	Confident	76.8	Confident	128 Å²	128	61.5 Å²	61.5	48%	0.483	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-68.2	150.5	168.5	-168.2	176.7	-61	-141.6	-0.8	109.6	P614 T615 A617 G627 Y628	P614-R625 VanDerWaalsContact O-CZ 3.3Å; P614-R625 PolarHBondContact O-NE 3.5Å; P614-R625 PolarHBondContact O-NH2 2.85Å; T615-R625 WeakPolarHBondContact O-CB 3.47Å; T615-R625 PolarHBondContact O-N 2.63Å; A617-R625 HydrophobicContact CB-CB 4.45Å; R625-G627 PolarHBondContact O-N 3.22Å; R625-Y628 HydrophobicContact CB-CD2 4.24Å; R625-Y628 WeakPolarHBondContact O-CB 3.42Å; R625-Y628 PolarHBondContact O-N 2.77Å
626	D	79.6	Confident	76.8	Confident	122 Å²	122	61.4 Å²	61.4	65%	0.652	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	138.8	-179.8	-51.9	-66	0	0	0	111.5	Y628	D626-Y628 VanDerWaalsContact C-N 3.33Å
627	G	78.8	Confident	76.5	Confident	25 Å²	25	61 Å²	61	26%	0.258	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.1	-6.2	-168.9	0	0	0	0	0	114.7	R625 C637	R625-G627 PolarHBondContact O-N 3.22Å; G627-C637 PolarHBondContact O-N 2.93Å; G627-C637 PolarHBondContact O-SG 2.83Å; G627-C637 VanDerWaalsContact O-SG 3.33Å
628	Y	83.3	Confident	76.8	Confident	83 Å²	83	65.6 Å²	65.6	33%	0.325	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	150.4	173.2	-59	-102.6	0	0	0	112.2	T615 C624 R625 D626 C634 E635 A636	T615-Y628 HydrophobicContact CG2-CD1 4.34Å; T615-Y628 HydrophobicContact CG2-CE1 3.91Å; C624-Y628 WeakPolarHBondContact CB-O 3.32Å; R625-Y628 HydrophobicContact CB-CD2 4.24Å; R625-Y628 WeakPolarHBondContact O-CB 3.42Å; R625-Y628 PolarHBondContact O-N 2.77Å; D626-Y628 VanDerWaalsContact C-N 3.33Å; Y628-C634 WeakPolarHBondContact CD1-O 3.47Å; Y628-E635 CarbonylContact C-O 3.59Å; Y628-E635 WeakPolarHBondContact CA-O 3.48Å; Y628-E635 VanDerWaalsContact CB-O 3.31Å; Y628-E635 WeakPolarHBondContact CB-O 3.45Å; Y628-A636 HydrophobicContact CD1-CB 4.27Å; Y628-A636 HydrophobicContact CE1-CB 4.23Å
629	F	83.3	Confident	77.3	Confident	1 Å²	1	65.5 Å²	65.5	0%	0.004	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	-178.7	179.7	75.7	-72	0	0	0	111	C624 C634 E635 T651 G654	C624-F629 PolarHBondContact SG-O 3.04Å; F629-C634 CarbonylContact O-C 3.5Å; F629-C634 VanDerWaalsContact O-CA 3.29Å; F629-C634 WeakPolarHBondContact O-CA 3.4Å; F629-E635 HydrophobicContact CD1-CB 4.22Å; F629-E635 WeakPolarHBondContact CD1-O 3.29Å; F629-E635 HydrophobicContact CE1-CB 3.55Å; F629-E635 HydrophobicContact CZ-CB 3.83Å; F629-E635 PolarHBondContact N-O 3.32Å; F629-E635 PolarHBondContact O-N 3.11Å; F629-T651 VanDerWaalsContact CA-O 3.25Å; F629-T651 WeakPolarHBondContact CA-O 3.29Å; F629-T651 WeakPolarHBondContact CB-O 3.05Å; F629-G654 VanDerWaalsContact CD2-N 3.32Å; F629-G654 VanDerWaalsContact CG-CA 3.44Å
630	Q	74.2	Confident	77.8	Confident	77 Å²	77	59.2 Å²	59.2	36%	0.36	30%	0.303	S	S	.	.	S	Bend	trans	68.5	39.8	172.6	-145	172.8	-83	0	0	115.6	I633 E635 T651	Q630-I633 CarbonylContact O-C 3.45Å; Q630-I633 VanDerWaalsContact O-C 3.3Å; Q630-I633 PolarHBondContact O-N 2.84Å; Q630-E635 PolarHBondContact NE2-OE1 3.49Å; Q630-T651 PolarHBondContact N-O 3.14Å
631	F	68.5	Low	78.5	Confident	63 Å²	63	64.5 Å²	64.5	28%	0.276	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.7	125.8	167.8	-169.1	-79.6	0	0	0	109.5	N594 A596 H616 C621 D622 C624	N594-F631 HydrophobicContact CB-CZ 4.35Å; N594-F631 VanDerWaalsContact CG-CZ 3.45Å; N594-F631 VanDerWaalsContact ND2-CE1 3.34Å; N594-F631 WeakPolarHBondContact ND2-CE1 3.5Å; N594-F631 VanDerWaalsContact ND2-CZ 3.27Å; N594-F631 WeakPolarHBondContact ND2-CZ 3.47Å; A596-F631 HydrophobicContact CB-CE1 3.68Å; A596-F631 HydrophobicContact CB-CZ 3.63Å; H616-F631 AromaticContact CD2-CD2 3.84Å; H616-F631 AromaticContact CD2-CE2 3.54Å; C621-F631 WeakPolarHBondContact O-CE2 3.08Å; D622-F631 VanDerWaalsContact C-CE2 3.41Å; C624-F631 PolarHBondContact SG-N 3.38Å; C624-F631 VanDerWaalsContact SG-N 3.37Å
632	P	64.1	Low	78.6	Confident	71 Å²	71	69.2 Å²	69.2	46%	0.461	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	cis	-88.4	-14.8	22.6	32.8	-36.3	0	0	0	117.5	A596 H616	A596-P632 HydrophobicContact CB-CB 3.33Å; H616-P632 PolarHBondContact NE2-O 2.95Å
633	I	70.6	Confident	78.9	Confident	120 Å²	120	65.6 Å²	65.6	62%	0.615	34%	0.335	S	S	*	.	S	Bend	trans	-103.6	85.4	-175.2	-53.5	176.7	0	0	0	108.1	Q630 E635	Q630-I633 CarbonylContact O-C 3.45Å; Q630-I633 VanDerWaalsContact O-C 3.3Å; Q630-I633 PolarHBondContact O-N 2.84Å; I633-E635 PolarHBondContact O-N 2.87Å
634	C	81.9	Confident	79	Confident	14 Å²	14	58.7 Å²	58.7	10%	0.095	31%	0.309	C	S	.	.			trans	-68.6	98.3	-169.6	-66	0	0	0	0	113.1	H616 C624 Y628 F629	H616-C634 PolarHBondContact CD2-SG 3.11Å; C624-C634 WeakPolarHBondContact CA-SG 3.42Å; C624-C634 HydrophobicContact CB-CB 3.75Å; C624-C634 WeakPolarHBondContact CB-SG 3.3Å; C624-C634 WeakPolarHBondContact SG-CA 3.26Å; C624-C634 WeakPolarHBondContact SG-CB 3.43Å; C624-C634 CovalentContact SG-SG 2.04Å; C624-C634 PolarHBondContact SG-SG 2.71Å; Y628-C634 WeakPolarHBondContact CD1-O 3.47Å; F629-C634 CarbonylContact O-C 3.5Å; F629-C634 VanDerWaalsContact O-CA 3.29Å; F629-C634 WeakPolarHBondContact O-CA 3.4Å
635	E	79.7	Confident	79	Confident	80 Å²	80	64.6 Å²	64.6	37%	0.374	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	154.7	178.5	-76.5	179.8	-146.7	0	0	111.9	Y628 F629 Q630 I633	Y628-E635 CarbonylContact C-O 3.59Å; Y628-E635 WeakPolarHBondContact CA-O 3.48Å; Y628-E635 VanDerWaalsContact CB-O 3.31Å; Y628-E635 WeakPolarHBondContact CB-O 3.45Å; F629-E635 HydrophobicContact CD1-CB 4.22Å; F629-E635 WeakPolarHBondContact CD1-O 3.29Å; F629-E635 HydrophobicContact CE1-CB 3.55Å; F629-E635 HydrophobicContact CZ-CB 3.83Å; F629-E635 PolarHBondContact N-O 3.32Å; F629-E635 PolarHBondContact O-N 3.11Å; Q630-E635 PolarHBondContact NE2-OE1 3.49Å; I633-E635 PolarHBondContact O-N 2.87Å
636	A	80.4	Confident	78.8	Confident	44 Å²	44	60.2 Å²	60.2	36%	0.364	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	141.1	-177.8	0	0	0	0	0	113.3	Y628 L638	Y628-A636 HydrophobicContact CD1-CB 4.27Å; Y628-A636 HydrophobicContact CE1-CB 4.23Å; A636-L638 PolarHBondContact O-N 2.88Å
637	C	78.9	Confident	78.6	Confident	5 Å²	5	56.5 Å²	56.5	3%	0.034	31%	0.314	C	S	.	.			trans	-59	-44.8	-172.6	-72.9	0	0	0	0	116.2	G627 C639 C649	G627-C637 PolarHBondContact O-N 2.93Å; G627-C637 PolarHBondContact O-SG 2.83Å; G627-C637 VanDerWaalsContact O-SG 3.33Å; C637-C639 PolarHBondContact O-N 3.1Å; C637-C649 WeakPolarHBondContact CA-SG 3.47Å; C637-C649 HydrophobicContact CB-CB 3.56Å; C637-C649 WeakPolarHBondContact CB-SG 3.11Å; C637-C649 WeakPolarHBondContact SG-CB 3.1Å; C637-C649 PolarHBondContact SG-N 3.26Å; C637-C649 CovalentContact SG-SG 2.03Å; C637-C649 PolarHBondContact SG-SG 3.21Å
638	L	83.5	Confident	78.7	Confident	120 Å²	120	62 Å²	62	63%	0.628	33%	0.331	S	S	*	.			trans	54	42	179	-58	175.6	0	0	0	116	A636 K666	A636-L638 PolarHBondContact O-N 2.88Å; L638-K666 HydrophobicContact CB-CD 4.39Å; L638-K666 WeakPolarHBondContact O-CB 3.21Å; L638-K666 WeakPolarHBondContact O-CD 3.29Å; L638-K666 VanDerWaalsContact O-CG 3.3Å; L638-K666 WeakPolarHBondContact O-CG 3.15Å
639	C	82.6	Confident	78.5	Confident	19 Å²	19	58.7 Å²	58.7	13%	0.128	32%	0.32	C	S	.	.			trans	-67.4	136.3	176.5	-55	0	0	0	0	113.2	C637 A644 S646 C656	C637-C639 PolarHBondContact O-N 3.1Å; C639-A644 HydrophobicContact CB-CB 4.07Å; C639-S646 WeakPolarHBondContact CB-O 3.16Å; C639-C656 WeakPolarHBondContact CA-SG 2.98Å; C639-C656 HydrophobicContact CB-CB 3.69Å; C639-C656 WeakPolarHBondContact CB-SG 3.17Å; C639-C656 WeakPolarHBondContact SG-CB 3.48Å; C639-C656 CovalentContact SG-SG 2.03Å; C639-C656 PolarHBondContact SG-SG 3.07Å
640	S	83.6	Confident	78.2	Confident	25 Å²	25	62.1 Å²	62.1	18%	0.175	34%	0.338	C	S	.	.			trans	-72	122.8	171.3	174.9	0	0	0	0	110.6	D642 G643 A644 K666 C667	S640-D642 VanDerWaalsContact C-N 3.26Å; S640-D642 PolarHBondContact O-N 3.36Å; S640-G643 PolarHBondContact O-N 2.91Å; S640-A644 WeakPolarHBondContact O-CA 3.33Å; S640-A644 WeakPolarHBondContact O-CB 3.33Å; S640-A644 PolarHBondContact O-N 2.81Å; S640-K666 VanDerWaalsContact CB-O 3.3Å; S640-K666 WeakPolarHBondContact CB-O 3.12Å; S640-K666 PolarHBondContact N-O 2.85Å; S640-C667 WeakPolarHBondContact CB-O 3.41Å
641	L	80.2	Confident	78.1	Confident	125 Å²	125	61.9 Å²	61.9	65%	0.654	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-20.3	180	-62.9	176.4	0	0	0	113	K659	L641-K659 PolarHBondContact O-NZ 2.67Å
642	D	82.9	Confident	78.1	Confident	99 Å²	99	66.6 Å²	66.6	53%	0.529	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-42.6	176.3	-63.6	-57.8	0	0	0	111.6	S640 K659 P678	S640-D642 VanDerWaalsContact C-N 3.26Å; S640-D642 PolarHBondContact O-N 3.36Å; D642-K659 WeakPolarHBondContact O-CD 3.41Å; D642-K659 WeakPolarHBondContact O-CE 3.43Å; D642-K659 PolarHBondContact O-NZ 3.03Å; D642-P678 HydrophobicContact CB-CB 4.33Å
643	G	79	Confident	78.6	Confident	0 Å²	0	67 Å²	67	0%	0	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-15	-180	0	0	0	0	0	116	S640 C658 K659 C667	S640-G643 PolarHBondContact O-N 2.91Å; G643-C658 CarbonylContact O-C 3.57Å; G643-C658 WeakPolarHBondContact O-CA 3.4Å; G643-K659 WeakPolarHBondContact O-CB 3.39Å; G643-K659 WeakPolarHBondContact O-CG 3.19Å; G643-K659 PolarHBondContact O-N 2.9Å; G643-C667 WeakPolarHBondContact CA-O 3.36Å; G643-C667 WeakPolarHBondContact O-CB 3.31Å
644	A	81.1	Confident	79	Confident	3 Å²	3	61.3 Å²	61.3	3%	0.025	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	153.2	-177.6	0	0	0	0	0	114	C639 S640 C656 Q657 K659 C667	C639-A644 HydrophobicContact CB-CB 4.07Å; S640-A644 WeakPolarHBondContact O-CA 3.33Å; S640-A644 WeakPolarHBondContact O-CB 3.33Å; S640-A644 PolarHBondContact O-N 2.81Å; A644-C656 HydrophobicContact CB-CB 4.11Å; A644-Q657 CarbonylContact C-O 3.57Å; A644-Q657 WeakPolarHBondContact CA-O 2.9Å; A644-K659 WeakPolarHBondContact O-CE 3.06Å; A644-C667 HydrophobicContact CB-CB 3.87Å
645	F	80	Confident	78.9	Confident	132 Å²	132	64.3 Å²	64.3	58%	0.579	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.2	-23.2	176.9	-72.7	-73	0	0	0	114.2	Q657 C658 K659	F645-Q657 HydrophobicContact CB-CB 4.29Å; F645-Q657 HydrophobicContact CD2-CB 3.97Å; F645-Q657 WeakPolarHBondContact CD2-O 3.27Å; F645-Q657 PolarHBondContact N-O 3.04Å; F645-C658 WeakPolarHBondContact CE2-O 3.48Å; F645-K659 HydrophobicContact CD1-CG 4.29Å; F645-K659 HydrophobicContact CE1-CG 4.14Å; F645-K659 HydrophobicContact CE2-CG 4.4Å; F645-K659 HydrophobicContact CG-CG 4.48Å; F645-K659 HydrophobicContact CZ-CG 4.2Å
646	S	78.6	Confident	79.2	Confident	37 Å²	37	60.6 Å²	60.6	26%	0.259	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	168.3	176.1	87.5	0	0	0	0	112.6	C639 F648	C639-S646 WeakPolarHBondContact CB-O 3.16Å; S646-F648 PolarHBondContact O-N 2.86Å; S646-F648 PolarHBondContact OG-N 3.1Å; S646-F648 PolarHBondContact OG-O 2.89Å
647	G	75.3	Confident	79.3	Confident	43 Å²	43	64.7 Å²	64.7	44%	0.443	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	-5.8	171.2	0	0	0	0	0	115.1
648	F	80.8	Confident	79.6	Confident	141 Å²	141	66.3 Å²	66.3	62%	0.618	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.3	130.5	175.7	-56	-75.3	0	0	0	110.5	S646	S646-F648 PolarHBondContact O-N 2.86Å; S646-F648 PolarHBondContact OG-N 3.1Å; S646-F648 PolarHBondContact OG-O 2.89Å
649	C	80.1	Confident	79.5	Confident	13 Å²	13	63.7 Å²	63.7	9%	0.088	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	165.2	168.5	70.5	0	0	0	0	111.1	C637 T651 G654 Q655	C637-C649 WeakPolarHBondContact CA-SG 3.47Å; C637-C649 HydrophobicContact CB-CB 3.56Å; C637-C649 WeakPolarHBondContact CB-SG 3.11Å; C637-C649 WeakPolarHBondContact SG-CB 3.1Å; C637-C649 PolarHBondContact SG-N 3.26Å; C637-C649 CovalentContact SG-SG 2.03Å; C637-C649 PolarHBondContact SG-SG 3.21Å; C649-T651 PolarHBondContact O-N 3.21Å; C649-G654 WeakPolarHBondContact CB-O 3.24Å; C649-Q655 WeakPolarHBondContact CA-O 3.35Å
650	N	75.9	Confident	79.2	Confident	73 Å²	73	67.8 Å²	67.8	39%	0.39	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-60.6	123.1	168	176.2	-41.2	0	0	0	109.8	Q652 T653 G654 Q655	N650-Q652 PolarHBondContact O-N 3.19Å; N650-Q652 VanDerWaalsContact O-N 3.12Å; N650-Q652 WeakPolarHBondContact OD1-CA 3.39Å; N650-Q652 WeakPolarHBondContact OD1-CB 3.45Å; N650-Q652 PolarHBondContact OD1-N 3.31Å; N650-T653 WeakPolarHBondContact CB-OG1 3.3Å; N650-T653 VanDerWaalsContact CG-OG1 3.28Å; N650-T653 PolarHBondContact O-N 3.17Å; N650-T653 PolarHBondContact OD1-N 2.87Å; N650-T653 VanDerWaalsContact OD1-N 3.08Å; N650-G654 WeakPolarHBondContact O-CA 2.98Å; N650-G654 PolarHBondContact O-N 2.85Å; N650-Q655 PolarHBondContact N-O 2.88Å
651	T	73.8	Confident	79	Confident	72 Å²	72	69.5 Å²	69.5	44%	0.442	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-12	-174	52.7	0	0	0	0	114.7	F629 Q630 C649	F629-T651 VanDerWaalsContact CA-O 3.25Å; F629-T651 WeakPolarHBondContact CA-O 3.29Å; F629-T651 WeakPolarHBondContact CB-O 3.05Å; Q630-T651 PolarHBondContact N-O 3.14Å; C649-T651 PolarHBondContact O-N 3.21Å
652	Q	68	Low	79.2	Confident	162 Å²	162	65.6 Å²	65.6	76%	0.757	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98	-50.2	172.5	-65.2	177.2	-32.2	0	0	111.8	N650	N650-Q652 PolarHBondContact O-N 3.19Å; N650-Q652 VanDerWaalsContact O-N 3.12Å; N650-Q652 WeakPolarHBondContact OD1-CA 3.39Å; N650-Q652 WeakPolarHBondContact OD1-CB 3.45Å; N650-Q652 PolarHBondContact OD1-N 3.31Å
653	T	74.5	Confident	79	Confident	81 Å²	81	64.2 Å²	64.2	50%	0.497	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-12.7	-170.6	66.7	0	0	0	0	114.9	N650 Q655	N650-T653 WeakPolarHBondContact CB-OG1 3.3Å; N650-T653 VanDerWaalsContact CG-OG1 3.28Å; N650-T653 PolarHBondContact O-N 3.17Å; N650-T653 PolarHBondContact OD1-N 2.87Å; N650-T653 VanDerWaalsContact OD1-N 3.08Å; T653-Q655 PolarHBondContact O-N 3.13Å; T653-Q655 VanDerWaalsContact O-N 3.16Å; T653-Q655 VanDerWaalsContact OG1-CB 3.31Å; T653-Q655 WeakPolarHBondContact OG1-CB 3.49Å; T653-Q655 PolarHBondContact OG1-N 3.32Å
654	G	78.5	Confident	78.7	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	36%	0.356	C	S	.	.			trans	69.7	1.4	-171.8	0	0	0	0	0	114.3	F629 C649 N650 C656 R665	F629-G654 VanDerWaalsContact CD2-N 3.32Å; F629-G654 VanDerWaalsContact CG-CA 3.44Å; C649-G654 WeakPolarHBondContact CB-O 3.24Å; N650-G654 WeakPolarHBondContact O-CA 2.98Å; N650-G654 PolarHBondContact O-N 2.85Å; G654-C656 PolarHBondContact O-N 3Å; G654-R665 WeakPolarHBondContact O-CG 3.31Å
655	Q	80.8	Confident	78.6	Confident	76 Å²	76	70 Å²	70	36%	0.355	37%	0.372	S	S	.	.			trans	-72.7	124.9	-176.2	-174.4	59.1	50	0	0	111.2	C649 N650 T653 G664 R665	C649-Q655 WeakPolarHBondContact CA-O 3.35Å; N650-Q655 PolarHBondContact N-O 2.88Å; T653-Q655 PolarHBondContact O-N 3.13Å; T653-Q655 VanDerWaalsContact O-N 3.16Å; T653-Q655 VanDerWaalsContact OG1-CB 3.31Å; T653-Q655 WeakPolarHBondContact OG1-CB 3.49Å; T653-Q655 PolarHBondContact OG1-N 3.32Å; Q655-G664 PolarHBondContact NE2-O 3.31Å; Q655-R665 PolarHBondContact NE2-O 2.75Å
656	C	84.6	Confident	78.7	Confident	2 Å²	2	67.3 Å²	67.3	1%	0.014	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	147.2	167.9	-57.5	0	0	0	0	110.2	C639 A644 G654 C658 R665 C667	C639-C656 WeakPolarHBondContact CA-SG 2.98Å; C639-C656 HydrophobicContact CB-CB 3.69Å; C639-C656 WeakPolarHBondContact CB-SG 3.17Å; C639-C656 WeakPolarHBondContact SG-CB 3.48Å; C639-C656 CovalentContact SG-SG 2.03Å; C639-C656 PolarHBondContact SG-SG 3.07Å; A644-C656 HydrophobicContact CB-CB 4.11Å; G654-C656 PolarHBondContact O-N 3Å; C656-C658 PolarHBondContact O-N 3.29Å; C656-R665 WeakPolarHBondContact CB-O 3.42Å; C656-R665 PolarHBondContact N-O 3.38Å; C656-R665 PolarHBondContact SG-O 2.8Å; C656-C667 PolarHBondContact O-SG 3.18Å
657	Q	83.7	Confident	79	Confident	131 Å²	131	65.5 Å²	65.5	61%	0.612	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.8	114	176.8	-66.1	179.8	-16.9	0	0	109.8	A644 F645	A644-Q657 CarbonylContact C-O 3.57Å; A644-Q657 WeakPolarHBondContact CA-O 2.9Å; F645-Q657 HydrophobicContact CB-CB 4.29Å; F645-Q657 HydrophobicContact CD2-CB 3.97Å; F645-Q657 WeakPolarHBondContact CD2-O 3.27Å; F645-Q657 PolarHBondContact N-O 3.04Å
658	C	83.8	Confident	79.5	Confident	38 Å²	38	65.9 Å²	65.9	26%	0.257	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	143.7	-173.3	-51.6	0	0	0	0	113.6	G643 F645 C656 C667	G643-C658 CarbonylContact O-C 3.57Å; G643-C658 WeakPolarHBondContact O-CA 3.4Å; F645-C658 WeakPolarHBondContact CE2-O 3.48Å; C656-C658 PolarHBondContact O-N 3.29Å; C658-C667 WeakPolarHBondContact CA-SG 3.45Å; C658-C667 HydrophobicContact CB-CB 3.68Å; C658-C667 WeakPolarHBondContact CB-SG 3.47Å; C658-C667 PolarHBondContact N-SG 2.89Å; C658-C667 VanDerWaalsContact N-SG 3.39Å; C658-C667 VanDerWaalsContact SG-CA 3.52Å; C658-C667 WeakPolarHBondContact SG-CB 3.39Å; C658-C667 CovalentContact SG-SG 2.04Å; C658-C667 PolarHBondContact SG-SG 3.22Å
659	K	81.7	Confident	79.5	Confident	65 Å²	65	64.2 Å²	64.2	28%	0.283	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-71.4	160.4	170.9	-60	173	-158.2	170.5	0	110	L641 D642 G643 A644 F645 Y662	L641-K659 PolarHBondContact O-NZ 2.67Å; D642-K659 WeakPolarHBondContact O-CD 3.41Å; D642-K659 WeakPolarHBondContact O-CE 3.43Å; D642-K659 PolarHBondContact O-NZ 3.03Å; G643-K659 WeakPolarHBondContact O-CB 3.39Å; G643-K659 WeakPolarHBondContact O-CG 3.19Å; G643-K659 PolarHBondContact O-N 2.9Å; A644-K659 WeakPolarHBondContact O-CE 3.06Å; F645-K659 HydrophobicContact CD1-CG 4.29Å; F645-K659 HydrophobicContact CE1-CG 4.14Å; F645-K659 HydrophobicContact CE2-CG 4.4Å; F645-K659 HydrophobicContact CG-CG 4.48Å; F645-K659 HydrophobicContact CZ-CG 4.2Å; K659-Y662 HydrophobicContact CB-CD2 3.78Å; K659-Y662 HydrophobicContact CB-CE2 4.16Å; K659-Y662 PolarHBondContact O-N 2.85Å
660	P	76.7	Confident	79.4	Confident	105 Å²	105	64.8 Å²	64.8	68%	0.682	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	147.4	174.3	-25.8	35.4	0	0	0	113	Y662	P660-Y662 WeakPolarHBondContact O-CD2 3.04Å; P660-Y662 WeakPolarHBondContact O-CE2 3.43Å; P660-Y662 PolarHBondContact O-N 3.43Å
661	N	80.1	Confident	79.3	Confident	61 Å²	61	62.7 Å²	62.7	33%	0.326	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.1	-4.4	-172.8	-54.3	14.4	0	0	0	116.2	C670 A671 Y674 C680	N661-C670 CarbonylContact O-C 3.53Å; N661-C670 WeakPolarHBondContact O-CA 3.15Å; N661-A671 PolarHBondContact O-N 2.81Å; N661-Y674 WeakPolarHBondContact ND2-CE1 3.36Å; N661-C680 HydrophobicContact CB-CB 3.73Å; N661-C680 PolarHBondContact ND2-O 3.45Å; N661-C680 VanDerWaalsContact ND2-O 3.16Å
662	Y	83.8	Confident	78.8	Confident	43 Å²	43	63.8 Å²	63.8	17%	0.169	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	153	176.4	-55.9	-91.4	0	0	0	112.8	K659 P660 H669 F677 P678	K659-Y662 HydrophobicContact CB-CD2 3.78Å; K659-Y662 HydrophobicContact CB-CE2 4.16Å; K659-Y662 PolarHBondContact O-N 2.85Å; P660-Y662 WeakPolarHBondContact O-CD2 3.04Å; P660-Y662 WeakPolarHBondContact O-CE2 3.43Å; P660-Y662 PolarHBondContact O-N 3.43Å; Y662-H669 CarbonylContact C-O 3.5Å; Y662-H669 VanDerWaalsContact CA-O 3.27Å; Y662-H669 WeakPolarHBondContact CA-O 3.24Å; Y662-F677 AromaticContact CD1-CD2 3.92Å; Y662-F677 HydrophobicContact CD1-CD2 3.92Å; Y662-F677 AromaticContact CD1-CE2 3.74Å; Y662-F677 HydrophobicContact CD1-CE2 3.74Å; Y662-F677 AromaticContact CE1-CD2 3.97Å; Y662-F677 HydrophobicContact CE1-CD2 3.97Å; Y662-F677 AromaticContact CE1-CE2 3.87Å; Y662-F677 HydrophobicContact CE1-CE2 3.87Å; Y662-P678 PolarHBondContact OH-O 2.94Å
663	T	77.5	Confident	78.6	Confident	71 Å²	71	57.1 Å²	57.1	44%	0.436	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	-177.6	176.7	-163.9	0	0	0	0	111.6	C667 D668 H669 C670	T663-C667 CarbonylContact O-C 3.46Å; T663-C667 WeakPolarHBondContact O-CA 3.05Å; T663-D668 PolarHBondContact O-N 3.13Å; T663-D668 VanDerWaalsContact O-N 3.17Å; T663-H669 HydrophobicContact CG2-CB 3.8Å; T663-H669 PolarHBondContact N-O 2.83Å; T663-H669 PolarHBondContact O-N 2.93Å; T663-H669 VanDerWaalsContact O-N 3.11Å; T663-C670 WeakPolarHBondContact CG2-O 3.03Å
664	G	74.6	Confident	78.5	Confident	23 Å²	23	58.3 Å²	58.3	24%	0.237	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	93.4	161.2	-177	0	0	0	0	0	113.1	Q655 K666 C667	Q655-G664 PolarHBondContact NE2-O 3.31Å; G664-K666 PolarHBondContact O-N 2.82Å; G664-C667 PolarHBondContact O-N 3.25Å; G664-C667 VanDerWaalsContact O-N 3.11Å
665	R	77.1	Confident	78.1	Confident	100 Å²	100	61.8 Å²	61.8	38%	0.377	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-32.9	-175.4	-162.4	-179.6	79.7	-178.3	0.6	112.5	G654 Q655 C656	G654-R665 WeakPolarHBondContact O-CG 3.31Å; Q655-R665 PolarHBondContact NE2-O 2.75Å; C656-R665 WeakPolarHBondContact CB-O 3.42Å; C656-R665 PolarHBondContact N-O 3.38Å; C656-R665 PolarHBondContact SG-O 2.8Å
666	K	83.2	Confident	77.7	Confident	76 Å²	76	59.4 Å²	59.4	33%	0.33	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-1	179.2	-57	172.4	179.9	170.2	0	113.6	L638 S640 G664 D668	L638-K666 HydrophobicContact CB-CD 4.39Å; L638-K666 WeakPolarHBondContact O-CB 3.21Å; L638-K666 WeakPolarHBondContact O-CD 3.29Å; L638-K666 VanDerWaalsContact O-CG 3.3Å; L638-K666 WeakPolarHBondContact O-CG 3.15Å; S640-K666 VanDerWaalsContact CB-O 3.3Å; S640-K666 WeakPolarHBondContact CB-O 3.12Å; S640-K666 PolarHBondContact N-O 2.85Å; G664-K666 PolarHBondContact O-N 2.82Å; K666-D668 HydrophobicContact CB-CB 4.24Å
667	C	85.7	Confident	77	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.4	50.1	-170.2	-43	0	0	0	0	112.9	S640 G643 A644 C656 C658 T663 G664	S640-C667 WeakPolarHBondContact CB-O 3.41Å; G643-C667 WeakPolarHBondContact CA-O 3.36Å; G643-C667 WeakPolarHBondContact O-CB 3.31Å; A644-C667 HydrophobicContact CB-CB 3.87Å; C656-C667 PolarHBondContact O-SG 3.18Å; C658-C667 WeakPolarHBondContact CA-SG 3.45Å; C658-C667 HydrophobicContact CB-CB 3.68Å; C658-C667 WeakPolarHBondContact CB-SG 3.47Å; C658-C667 PolarHBondContact N-SG 2.89Å; C658-C667 VanDerWaalsContact N-SG 3.39Å; C658-C667 VanDerWaalsContact SG-CA 3.52Å; C658-C667 WeakPolarHBondContact SG-CB 3.39Å; C658-C667 CovalentContact SG-SG 2.04Å; C658-C667 PolarHBondContact SG-SG 3.22Å; T663-C667 CarbonylContact O-C 3.46Å; T663-C667 WeakPolarHBondContact O-CA 3.05Å; G664-C667 PolarHBondContact O-N 3.25Å; G664-C667 VanDerWaalsContact O-N 3.11Å
668	D	84.4	Confident	76.2	Confident	50 Å²	50	60.5 Å²	60.5	27%	0.267	34%	0.337	S	S	.	.			trans	-116.8	4.9	-169.8	51.4	-11.4	0	0	0	113.6	T663 K666 F677	T663-D668 PolarHBondContact O-N 3.13Å; T663-D668 VanDerWaalsContact O-N 3.17Å; K666-D668 HydrophobicContact CB-CB 4.24Å; D668-F677 VanDerWaalsContact C-CE2 3.5Å
669	H	81.7	Confident	75.7	Confident	107 Å²	107	67.8 Å²	67.8	50%	0.495	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	163.3	-179.2	-63.2	73.7	0	0	0	110.7	Y662 T663	Y662-H669 CarbonylContact C-O 3.5Å; Y662-H669 VanDerWaalsContact CA-O 3.27Å; Y662-H669 WeakPolarHBondContact CA-O 3.24Å; T663-H669 HydrophobicContact CG2-CB 3.8Å; T663-H669 PolarHBondContact N-O 2.83Å; T663-H669 PolarHBondContact O-N 2.93Å; T663-H669 VanDerWaalsContact O-N 3.11Å
670	C	78.6	Confident	75.1	Confident	25 Å²	25	64.8 Å²	64.8	17%	0.169	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	149	169.9	-61.2	0	0	0	0	112.1	N661 T663 F677 C680	N661-C670 CarbonylContact O-C 3.53Å; N661-C670 WeakPolarHBondContact O-CA 3.15Å; T663-C670 WeakPolarHBondContact CG2-O 3.03Å; C670-F677 PolarHBondContact SG-N 2.03Å; C670-F677 VanDerWaalsContact SG-N 3.4Å; C670-C680 WeakPolarHBondContact CA-SG 3.47Å; C670-C680 HydrophobicContact CB-CB 3.76Å; C670-C680 WeakPolarHBondContact CB-SG 3.39Å; C670-C680 WeakPolarHBondContact SG-CA 3.37Å; C670-C680 WeakPolarHBondContact SG-CB 3.49Å; C670-C680 CovalentContact SG-SG 2.04Å; C670-C680 PolarHBondContact SG-SG 2.97Å
671	A	72.4	Confident	74.6	Confident	28 Å²	28	63.6 Å²	63.6	23%	0.231	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-63.1	151.4	174.2	0	0	0	0	0	111.6	N661 G673 Y674	N661-A671 PolarHBondContact O-N 2.81Å; A671-G673 PolarHBondContact O-N 3.44Å; A671-Y674 HydrophobicContact CB-CD2 4.06Å; A671-Y674 PolarHBondContact O-N 2.87Å
672	A	63.2	Low	73.4	Confident	95 Å²	95	62.7 Å²	62.7	79%	0.785	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	127.9	-177.3	0	0	0	0	0	111.6
673	G	63.6	Low	71.7	Confident	23 Å²	23	66.9 Å²	66.9	24%	0.237	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	98.6	-11.1	-174.3	0	0	0	0	0	115.1	A671	A671-G673 PolarHBondContact O-N 3.44Å
674	Y	72.6	Confident	70.4	Confident	106 Å²	106	69.6 Å²	69.6	42%	0.416	38%	0.379	S	S	.	.			trans	-110.5	148.5	175.7	-61.1	-95.3	0	0	0	111.3	N661 A671	N661-Y674 WeakPolarHBondContact ND2-CE1 3.36Å; A671-Y674 HydrophobicContact CB-CD2 4.06Å; A671-Y674 PolarHBondContact O-N 2.87Å
675	Y	70.9	Confident	69.1	Low	72 Å²	72	76.4 Å²	76.4	28%	0.282	41%	0.41	S	S	.	.	B	Isolated β-bridge	trans	-129.2	165.6	-178.3	56.8	-80.2	0	0	0	112.4	C680 L681 D704	Y675-C680 CarbonylContact O-C 3.57Å; Y675-C680 WeakPolarHBondContact O-CA 3.4Å; Y675-L681 PolarHBondContact O-N 3.39Å; Y675-D704 WeakPolarHBondContact CD2-O 3.36Å
676	G	72.6	Confident	67.6	Low	27 Å²	27	73.1 Å²	73.1	28%	0.278	40%	0.404	S	S	.	.	S	Bend	trans	74.6	62.6	175.3	0	0	0	0	0	116.2	R679 C680	G676-R679 PolarHBondContact O-N 2.85Å; G676-C680 PolarHBondContact O-N 3.02Å
677	F	68.4	Low	65.9	Low	86 Å²	86	76.9 Å²	76.9	38%	0.377	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	144.1	165.2	-177.4	-91.5	0	0	0	110.5	Y662 D668 C670	Y662-F677 AromaticContact CD1-CD2 3.92Å; Y662-F677 HydrophobicContact CD1-CD2 3.92Å; Y662-F677 AromaticContact CD1-CE2 3.74Å; Y662-F677 HydrophobicContact CD1-CE2 3.74Å; Y662-F677 AromaticContact CE1-CD2 3.97Å; Y662-F677 HydrophobicContact CE1-CD2 3.97Å; Y662-F677 AromaticContact CE1-CE2 3.87Å; Y662-F677 HydrophobicContact CE1-CE2 3.87Å; D668-F677 VanDerWaalsContact C-CE2 3.5Å; C670-F677 PolarHBondContact SG-N 2.03Å; C670-F677 VanDerWaalsContact SG-N 3.4Å
678	P	67.9	Low	64.2	Low	69 Å²	69	80.2 Å²	80.2	45%	0.448	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	cis	-94.2	33.1	3.3	39.8	-37.5	0	0	0	113.3	D642 Y662	D642-P678 HydrophobicContact CB-CB 4.33Å; Y662-P678 PolarHBondContact OH-O 2.94Å
679	R	72.4	Confident	62.9	Low	192 Å²	192	81.9 Å²	81.9	73%	0.725	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108	-28.8	172.8	-69.8	-176.4	178.7	166.8	0.3	113.3	G676 L681	G676-R679 PolarHBondContact O-N 2.85Å; R679-L681 HydrophobicContact CB-CD1 4.41Å; R679-L681 HydrophobicContact CB-CD2 3.72Å; R679-L681 HydrophobicContact CB-CG 3.76Å
680	C	70.5	Confident	62.1	Low	1 Å²	1	77.3 Å²	77.3	1%	0.007	44%	0.436	C	S	.	.			trans	48.8	63.3	-178.1	-58.8	0	0	0	0	111.7	N661 C670 Y675 G676	N661-C680 HydrophobicContact CB-CB 3.73Å; N661-C680 PolarHBondContact ND2-O 3.45Å; N661-C680 VanDerWaalsContact ND2-O 3.16Å; C670-C680 WeakPolarHBondContact CA-SG 3.47Å; C670-C680 HydrophobicContact CB-CB 3.76Å; C670-C680 WeakPolarHBondContact CB-SG 3.39Å; C670-C680 WeakPolarHBondContact SG-CA 3.37Å; C670-C680 WeakPolarHBondContact SG-CB 3.49Å; C670-C680 CovalentContact SG-SG 2.04Å; C670-C680 PolarHBondContact SG-SG 2.97Å; Y675-C680 CarbonylContact O-C 3.57Å; Y675-C680 WeakPolarHBondContact O-CA 3.4Å; G676-C680 PolarHBondContact O-N 3.02Å
681	L	65.2	Low	61.6	Low	81 Å²	81	81 Å²	81	42%	0.424	45%	0.45	S	S	.	.	B	Isolated β-bridge	trans	-74.4	127.2	-170.1	-63.3	170.9	0	0	0	111	Y675 R679	Y675-L681 PolarHBondContact O-N 3.39Å; R679-L681 HydrophobicContact CB-CD1 4.41Å; R679-L681 HydrophobicContact CB-CD2 3.72Å; R679-L681 HydrophobicContact CB-CG 3.76Å
682	G	54.5	Low	61.7	Low	41 Å²	41	80.6 Å²	80.6	42%	0.423	45%	0.446	S	S	.	.			trans	-122.2	146.6	136.2	0	0	0	0	0	106.3
683	E	48.4	Very low	62.4	Low	131 Å²	131	77.8 Å²	77.8	61%	0.612	42%	0.417	S	S	*	.	B	Isolated β-bridge	trans	-79.5	148.6	-176.8	-67.2	-160.4	131.1	0	0	111.9	D685 A686	E683-D685 PolarHBondContact O-N 2.79Å; E683-D685 VanDerWaalsContact O-N 3.16Å; E683-A686 HydrophobicContact CB-CB 4.05Å; E683-A686 CarbonylContact O-C 3.54Å; E683-A686 PolarHBondContact O-N 3.42Å
684	P	51.7	Low	62.8	Low	128 Å²	128	87.1 Å²	87.1	83%	0.831	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-27.6	178.3	-24.7	34.9	0	0	0	114.7
685	D	46.4	Very low	62.9	Low	167 Å²	167	88.8 Å²	88.8	89%	0.893	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.3	2	-179.5	-63.9	-63.6	0	0	0	113	E683	E683-D685 PolarHBondContact O-N 2.79Å; E683-D685 VanDerWaalsContact O-N 3.16Å
686	A	45.9	Very low	63.1	Low	31 Å²	31	85.3 Å²	85.3	26%	0.256	44%	0.438	S	S	.	.	B	Isolated β-bridge	trans	-135.3	90.3	175.5	0	0	0	0	0	111.5	E683 T688	E683-A686 HydrophobicContact CB-CB 4.05Å; E683-A686 CarbonylContact O-C 3.54Å; E683-A686 PolarHBondContact O-N 3.42Å; A686-T688 PolarHBondContact O-N 2.82Å
687	Q	46.9	Very low	63.4	Low	154 Å²	154	84.3 Å²	84.3	72%	0.72	43%	0.427	S	S	*	.			trans	-66.6	20.8	175.7	-160.5	88.7	-3.7	0	0	113.4	T689	Q687-T689 PolarHBondContact O-N 2.02Å
688	T	51	Low	63.4	Low	70 Å²	70	86.3 Å²	86.3	43%	0.429	44%	0.441	S	S	.	.			trans	-78	90.3	-175.6	46.3	0	0	0	0	111.3	A686	A686-T688 PolarHBondContact O-N 2.82Å
689	T	56.3	Low	63.3	Low	85 Å²	85	84.3 Å²	84.3	52%	0.521	43%	0.433	S	S	.	.			trans	-55.6	175.2	149.1	68.1	0	0	0	0	110.6	Q687 E691	Q687-T689 PolarHBondContact O-N 2.02Å; T689-E691 WeakPolarHBondContact O-CG 3.19Å; T689-E691 PolarHBondContact O-N 3.17Å
690	C	64.1	Low	63	Low	12 Å²	12	80.7 Å²	80.7	8%	0.081	43%	0.433	C	S	.	.			trans	-56.2	-18.7	-175	-56.3	0	0	0	0	116.9	C692 T700 C702 C708	C690-C692 VanDerWaalsContact C-N 3.28Å; C690-C692 PolarHBondContact O-N 3.01Å; C690-C692 VanDerWaalsContact O-N 3.12Å; C690-T700 VanDerWaalsContact CB-O 3.28Å; C690-T700 WeakPolarHBondContact CB-O 3.45Å; C690-T700 PolarHBondContact SG-O 3.12Å; C690-T700 VanDerWaalsContact SG-O 3.35Å; C690-C702 VanDerWaalsContact CA-SG 3.6Å; C690-C702 HydrophobicContact CB-CB 3.5Å; C690-C702 VanDerWaalsContact CB-CB 3.5Å; C690-C702 WeakPolarHBondContact CB-SG 3.34Å; C690-C702 WeakPolarHBondContact SG-CB 3.42Å; C690-C702 PolarHBondContact SG-N 3.34Å; C690-C702 CovalentContact SG-SG 2.04Å; C690-C702 PolarHBondContact SG-SG 2.98Å; C690-C708 PolarHBondContact O-SG 3.02Å
691	E	69.2	Low	62.8	Low	101 Å²	101	84.3 Å²	84.3	47%	0.472	46%	0.455	S	S	.	.			trans	51	35	176.4	-69.6	-168.9	134	0	0	116.5	T689 K718	T689-E691 WeakPolarHBondContact O-CG 3.19Å; T689-E691 PolarHBondContact O-N 3.17Å; E691-K718 HydrophobicContact CB-CD 4.23Å; E691-K718 WeakPolarHBondContact O-CD 3.16Å; E691-K718 WeakPolarHBondContact O-CG 3.42Å; E691-K718 WeakPolarHBondContact OE2-CE 3.28Å; E691-K718 IonicContact OE2-NZ 2.72Å; E691-K718 PolarHBondContact OE2-NZ 2.83Å
692	C	74.5	Confident	63.1	Low	21 Å²	21	81.6 Å²	81.6	14%	0.142	44%	0.442	C	S	.	.			trans	-76.3	133.4	-175.9	-53.7	0	0	0	0	114.4	C690 R694 S697 G699 C708	C690-C692 VanDerWaalsContact C-N 3.28Å; C690-C692 PolarHBondContact O-N 3.01Å; C690-C692 VanDerWaalsContact O-N 3.12Å; C692-R694 PolarHBondContact O-N 3.34Å; C692-R694 VanDerWaalsContact O-N 3.12Å; C692-S697 WeakPolarHBondContact CB-OG 3.43Å; C692-G699 WeakPolarHBondContact CB-O 3.36Å; C692-C708 WeakPolarHBondContact CA-SG 3Å; C692-C708 HydrophobicContact CB-CB 3.74Å; C692-C708 WeakPolarHBondContact CB-SG 3.31Å; C692-C708 WeakPolarHBondContact SG-CB 3.35Å; C692-C708 CovalentContact SG-SG 2.03Å; C692-C708 PolarHBondContact SG-SG 3.1Å
693	N	77.9	Confident	63.9	Low	36 Å²	36	81.5 Å²	81.5	19%	0.193	43%	0.433	C	S	.	.			trans	-71.7	104.8	178.4	-179.9	-24	0	0	0	111.2	Y695 G696 S697 K718 Y729	N693-Y695 PolarHBondContact O-N 2.95Å; N693-Y695 WeakPolarHBondContact OD1-CB 3.34Å; N693-Y695 PolarHBondContact OD1-N 3.2Å; N693-G696 CarbonylContact O-C 3.5Å; N693-G696 PolarHBondContact O-N 3.3Å; N693-S697 WeakPolarHBondContact O-CB 3.47Å; N693-S697 PolarHBondContact O-N 2.84Å; N693-S697 PolarHBondContact O-OG 3.16Å; N693-S697 VanDerWaalsContact O-OG 3.13Å; N693-K718 WeakPolarHBondContact CB-O 3.49Å; N693-K718 PolarHBondContact N-O 3.27Å; N693-Y729 PolarHBondContact ND2-OH 3.34Å
694	R	72	Confident	64.7	Low	218 Å²	218	81.4 Å²	81.4	82%	0.823	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-41.5	-32.6	177.2	-175	178.9	-179.6	-179	1.9	116.1	C692 K711	C692-R694 PolarHBondContact O-N 3.34Å; C692-R694 VanDerWaalsContact O-N 3.12Å; R694-K711 PolarHBondContact O-NZ 3.13Å
695	Y	75.3	Confident	65.6	Low	141 Å²	141	82.1 Å²	82.1	55%	0.553	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-44.4	177	-67.3	-77.1	0	0	0	112.1	N693 K711 F714 P730	N693-Y695 PolarHBondContact O-N 2.95Å; N693-Y695 WeakPolarHBondContact OD1-CB 3.34Å; N693-Y695 PolarHBondContact OD1-N 3.2Å; Y695-K711 WeakPolarHBondContact O-CD 3.35Å; Y695-K711 VanDerWaalsContact O-CE 3.22Å; Y695-K711 WeakPolarHBondContact O-CE 3.44Å; Y695-K711 PolarHBondContact O-NZ 3.12Å; Y695-F714 WeakPolarHBondContact O-CZ 3.05Å; Y695-P730 HydrophobicContact CD1-CB 3.82Å; Y695-P730 HydrophobicContact CD1-CG 3.91Å; Y695-P730 HydrophobicContact CE1-CG 4.24Å; Y695-P730 HydrophobicContact CG-CB 3.91Å; Y695-P730 HydrophobicContact CG-CG 4.39Å
696	G	74.7	Confident	66.5	Low	0 Å²	0	75.4 Å²	75.4	0%	0	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	-10.1	-175.4	0	0	0	0	0	116.3	N693 C710 K711 C719	N693-G696 CarbonylContact O-C 3.5Å; N693-G696 PolarHBondContact O-N 3.3Å; G696-C710 CarbonylContact O-C 3.51Å; G696-C710 WeakPolarHBondContact O-CA 3.29Å; G696-K711 WeakPolarHBondContact O-CB 3.37Å; G696-K711 WeakPolarHBondContact O-CG 3.28Å; G696-K711 PolarHBondContact O-N 2.03Å; G696-C719 WeakPolarHBondContact CA-O 3.43Å; G696-C719 VanDerWaalsContact O-CB 3.25Å; G696-C719 WeakPolarHBondContact O-CB 3.33Å
697	S	77.4	Confident	68	Low	6 Å²	6	78.8 Å²	78.8	4%	0.042	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	144.6	-178	73.7	0	0	0	0	113.4	C692 N693 G699 F709 K711	C692-S697 WeakPolarHBondContact CB-OG 3.43Å; N693-S697 WeakPolarHBondContact O-CB 3.47Å; N693-S697 PolarHBondContact O-N 2.84Å; N693-S697 PolarHBondContact O-OG 3.16Å; N693-S697 VanDerWaalsContact O-OG 3.13Å; S697-G699 WeakPolarHBondContact CB-O 3.36Å; S697-G699 PolarHBondContact O-N 3.21Å; S697-G699 PolarHBondContact OG-O 3.44Å; S697-F709 CarbonylContact C-O 3.13Å; S697-F709 VanDerWaalsContact CA-O 3.23Å; S697-F709 WeakPolarHBondContact CA-O 3.4Å; S697-K711 WeakPolarHBondContact O-CE 3.42Å
698	L	68.5	Low	69.5	Low	127 Å²	127	72.1 Å²	72.1	67%	0.665	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.8	-15.4	178.8	-71.4	161.8	0	0	0	112.9	F709 C710 K711	L698-F709 HydrophobicContact CB-CB 4.14Å; L698-F709 HydrophobicContact CD1-CB 4.04Å; L698-F709 PolarHBondContact N-O 3.09Å; L698-C710 WeakPolarHBondContact CD1-O 3.43Å; L698-K711 HydrophobicContact CD2-CG 3.96Å; L698-K711 HydrophobicContact CG-CG 4.14Å
699	G	66	Low	71	Confident	27 Å²	27	73.4 Å²	73.4	28%	0.278	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-171	-169.4	175.2	0	0	0	0	0	112.2	C692 S697	C692-G699 WeakPolarHBondContact CB-O 3.36Å; S697-G699 WeakPolarHBondContact CB-O 3.36Å; S697-G699 PolarHBondContact O-N 3.21Å; S697-G699 PolarHBondContact OG-O 3.44Å
700	T	66.8	Low	72.3	Confident	117 Å²	117	71.5 Å²	71.5	72%	0.718	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.6	1	169.4	48.4	0	0	0	0	112.9	C690	C690-T700 VanDerWaalsContact CB-O 3.28Å; C690-T700 WeakPolarHBondContact CB-O 3.45Å; C690-T700 PolarHBondContact SG-O 3.12Å; C690-T700 VanDerWaalsContact SG-O 3.35Å
701	T	65.5	Low	73	Confident	77 Å²	77	74.6 Å²	74.6	47%	0.472	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	150.6	174.5	48.1	0	0	0	0	111.5	F709	T701-F709 WeakPolarHBondContact O-CD2 3.36Å
702	C	72.1	Confident	73.3	Confident	24 Å²	24	74.8 Å²	74.8	16%	0.162	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	171.7	176.9	44.9	0	0	0	0	111.1	C690 H707	C690-C702 VanDerWaalsContact CA-SG 3.6Å; C690-C702 HydrophobicContact CB-CB 3.5Å; C690-C702 VanDerWaalsContact CB-CB 3.5Å; C690-C702 WeakPolarHBondContact CB-SG 3.34Å; C690-C702 WeakPolarHBondContact SG-CB 3.42Å; C690-C702 PolarHBondContact SG-N 3.34Å; C690-C702 CovalentContact SG-SG 2.04Å; C690-C702 PolarHBondContact SG-SG 2.98Å; C702-H707 CarbonylContact C-O 3.35Å; C702-H707 WeakPolarHBondContact CA-O 3.4Å; C702-H707 WeakPolarHBondContact CB-O 3.37Å
703	T	70.5	Confident	73.3	Confident	38 Å²	38	74 Å²	74	23%	0.233	40%	0.396	C	S	.	.			trans	-64.8	168.7	164.6	67.5	0	0	0	0	111	E705 G706 H707 F709	T703-E705 WeakPolarHBondContact CB-OE2 3.05Å; T703-E705 PolarHBondContact O-N 2.04Å; T703-E705 PolarHBondContact OG1-N 3.13Å; T703-E705 PolarHBondContact OG1-OE2 2.72Å; T703-G706 PolarHBondContact O-N 2.77Å; T703-H707 HydrophobicContact CG2-CB 4.25Å; T703-H707 PolarHBondContact N-O 3Å; T703-H707 PolarHBondContact OG1-N 3.21Å; T703-F709 HydrophobicContact CG2-CE1 3.98Å; T703-F709 HydrophobicContact CG2-CZ 3.91Å
704	D	66.2	Low	73.6	Confident	129 Å²	129	73.1 Å²	73.1	69%	0.69	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-8.4	171.6	-67.6	-66.2	0	0	0	114	Y675	Y675-D704 WeakPolarHBondContact CD2-O 3.36Å
705	E	70.7	Confident	74.3	Confident	143 Å²	143	66 Å²	66	67%	0.668	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	-1.8	174.1	-44.5	122.6	141.4	0	0	113.4	T703	T703-E705 WeakPolarHBondContact CB-OE2 3.05Å; T703-E705 PolarHBondContact O-N 2.04Å; T703-E705 PolarHBondContact OG1-N 3.13Å; T703-E705 PolarHBondContact OG1-OE2 2.72Å
706	G	66	Low	74.4	Confident	27 Å²	27	60.4 Å²	60.4	28%	0.278	36%	0.357	S	S	.	.	S	Bend	trans	88.7	14.4	-177.9	0	0	0	0	0	115.7	T703	T703-G706 PolarHBondContact O-N 2.77Å
707	H	76.4	Confident	74.5	Confident	102 Å²	102	63.6 Å²	63.6	47%	0.472	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-89.4	136.9	179.6	-68.5	-30.4	0	0	0	113.9	C702 T703	C702-H707 CarbonylContact C-O 3.35Å; C702-H707 WeakPolarHBondContact CA-O 3.4Å; C702-H707 WeakPolarHBondContact CB-O 3.37Å; T703-H707 HydrophobicContact CG2-CB 4.25Å; T703-H707 PolarHBondContact N-O 3Å; T703-H707 PolarHBondContact OG1-N 3.21Å
708	C	79.2	Confident	74.6	Confident	14 Å²	14	67.7 Å²	67.7	10%	0.095	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	137.8	-178.5	-64.8	0	0	0	0	113.6	C690 C692 A717	C690-C708 PolarHBondContact O-SG 3.02Å; C692-C708 WeakPolarHBondContact CA-SG 3Å; C692-C708 HydrophobicContact CB-CB 3.74Å; C692-C708 WeakPolarHBondContact CB-SG 3.31Å; C692-C708 WeakPolarHBondContact SG-CB 3.35Å; C692-C708 CovalentContact SG-SG 2.03Å; C692-C708 PolarHBondContact SG-SG 3.1Å; C708-A717 WeakPolarHBondContact CB-O 3.2Å; C708-A717 PolarHBondContact N-O 2.97Å
709	F	82.3	Confident	75.4	Confident	97 Å²	97	61.6 Å²	61.6	43%	0.425	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	125.1	172.9	-53.4	-79	0	0	0	110.7	S697 L698 T701 T703	S697-F709 CarbonylContact C-O 3.13Å; S697-F709 VanDerWaalsContact CA-O 3.23Å; S697-F709 WeakPolarHBondContact CA-O 3.4Å; L698-F709 HydrophobicContact CB-CB 4.14Å; L698-F709 HydrophobicContact CD1-CB 4.04Å; L698-F709 PolarHBondContact N-O 3.09Å; T701-F709 WeakPolarHBondContact O-CD2 3.36Å; T703-F709 HydrophobicContact CG2-CE1 3.98Å; T703-F709 HydrophobicContact CG2-CZ 3.91Å
710	C	83	Confident	76.1	Confident	44 Å²	44	62.9 Å²	62.9	30%	0.297	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	142.5	-173.9	-53.8	0	0	0	0	114.5	G696 L698 G716 C719	G696-C710 CarbonylContact O-C 3.51Å; G696-C710 WeakPolarHBondContact O-CA 3.29Å; L698-C710 WeakPolarHBondContact CD1-O 3.43Å; C710-G716 PolarHBondContact SG-O 3.14Å; C710-G716 VanDerWaalsContact SG-O 3.38Å; C710-C719 WeakPolarHBondContact CA-SG 3.26Å; C710-C719 HydrophobicContact CB-CB 3.72Å; C710-C719 WeakPolarHBondContact CB-SG 3.47Å; C710-C719 VanDerWaalsContact SG-CA 3.5Å; C710-C719 WeakPolarHBondContact SG-CB 3.46Å; C710-C719 CovalentContact SG-SG 2.04Å; C710-C719 PolarHBondContact SG-SG 2.93Å
711	K	77.9	Confident	76.9	Confident	78 Å²	78	64.8 Å²	64.8	34%	0.339	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-66.6	154.4	172.6	-60.6	-179.6	-157.5	171.1	0	110.8	R694 Y695 G696 S697 L698 F714	R694-K711 PolarHBondContact O-NZ 3.13Å; Y695-K711 WeakPolarHBondContact O-CD 3.35Å; Y695-K711 VanDerWaalsContact O-CE 3.22Å; Y695-K711 WeakPolarHBondContact O-CE 3.44Å; Y695-K711 PolarHBondContact O-NZ 3.12Å; G696-K711 WeakPolarHBondContact O-CB 3.37Å; G696-K711 WeakPolarHBondContact O-CG 3.28Å; G696-K711 PolarHBondContact O-N 2.03Å; S697-K711 WeakPolarHBondContact O-CE 3.42Å; L698-K711 HydrophobicContact CD2-CG 3.96Å; L698-K711 HydrophobicContact CG-CG 4.14Å; K711-F714 HydrophobicContact CB-CD2 3.88Å; K711-F714 HydrophobicContact CB-CE2 4.36Å; K711-F714 PolarHBondContact O-N 2.97Å; K711-F714 VanDerWaalsContact O-N 3.11Å
712	A	75.5	Confident	77.6	Confident	104 Å²	104	62.7 Å²	62.7	86%	0.86	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	142.9	168.4	0	0	0	0	0	110.8	F714	A712-F714 VanDerWaalsContact C-N 3.29Å; A712-F714 WeakPolarHBondContact O-CD2 3.5Å; A712-F714 PolarHBondContact O-N 3.49Å
713	G	75	Confident	77.7	Confident	5 Å²	5	67.5 Å²	67.5	5%	0.052	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.1	-10.5	-172.6	0	0	0	0	0	115.3	C722 K723 C732	G713-C722 CarbonylContact O-C 3.3Å; G713-C722 VanDerWaalsContact O-CA 3.23Å; G713-C722 WeakPolarHBondContact O-CA 3.29Å; G713-K723 PolarHBondContact O-N 2.98Å; G713-C732 WeakPolarHBondContact O-CB 3.16Å; G713-C732 PolarHBondContact O-SG 3.22Å
714	F	85.2	Confident	77.6	Confident	18 Å²	18	73.8 Å²	73.8	8%	0.079	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	166.3	180	-64.8	-101.7	0	0	0	114.1	Y695 K711 A712 R721 Y729 P730 C732	Y695-F714 WeakPolarHBondContact O-CZ 3.05Å; K711-F714 HydrophobicContact CB-CD2 3.88Å; K711-F714 HydrophobicContact CB-CE2 4.36Å; K711-F714 PolarHBondContact O-N 2.97Å; K711-F714 VanDerWaalsContact O-N 3.11Å; A712-F714 VanDerWaalsContact C-N 3.29Å; A712-F714 WeakPolarHBondContact O-CD2 3.5Å; A712-F714 PolarHBondContact O-N 3.49Å; F714-R721 CarbonylContact C-O 3.51Å; F714-R721 WeakPolarHBondContact CA-O 3.32Å; F714-Y729 HydrophobicContact CD1-CD2 4.34Å; F714-Y729 HydrophobicContact CD1-CE2 4.07Å; F714-Y729 AromaticContact CE1-CD2 3.93Å; F714-Y729 HydrophobicContact CE1-CD2 3.93Å; F714-Y729 AromaticContact CE1-CE2 3.69Å; F714-Y729 HydrophobicContact CE1-CE2 3.69Å; F714-P730 WeakPolarHBondContact CZ-O 3.02Å; F714-C732 HydrophobicContact CE2-CB 4.49Å
715	T	85.1	Confident	77.1	Confident	67 Å²	67	73.7 Å²	73.7	41%	0.411	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	169.2	177.1	-168.8	0	0	0	0	112.3	C719 D720 R721	T715-C719 CarbonylContact O-C 3.28Å; T715-C719 WeakPolarHBondContact O-CA 3.28Å; T715-D720 PolarHBondContact O-N 2.97Å; T715-R721 HydrophobicContact CG2-CB 3.97Å; T715-R721 PolarHBondContact N-O 3.47Å; T715-R721 PolarHBondContact O-N 2.83Å; T715-R721 VanDerWaalsContact O-N 3.08Å
716	G	79.2	Confident	76.8	Confident	25 Å²	25	70 Å²	70	26%	0.258	38%	0.377	S	S	.	.	S	Bend	trans	106	154.7	-176.8	0	0	0	0	0	112.8	C710 K718 C719 D720	C710-G716 PolarHBondContact SG-O 3.14Å; C710-G716 VanDerWaalsContact SG-O 3.38Å; G716-K718 PolarHBondContact O-N 2.86Å; G716-K718 VanDerWaalsContact O-N 3.16Å; G716-C719 WeakPolarHBondContact O-CA 3.35Å; G716-C719 PolarHBondContact O-N 2.82Å; G716-D720 WeakPolarHBondContact CA-OD1 3.01Å
717	A	76.9	Confident	76.5	Confident	67 Å²	67	75.1 Å²	75.1	55%	0.554	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-22.7	-175.1	0	0	0	0	0	114	C708	C708-A717 WeakPolarHBondContact CB-O 3.2Å; C708-A717 PolarHBondContact N-O 2.97Å
718	K	78	Confident	75.9	Confident	91 Å²	91	75.1 Å²	75.1	40%	0.396	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	6.3	171	-65.8	-180	173.5	-176.2	0	112.6	E691 N693 G716	E691-K718 HydrophobicContact CB-CD 4.23Å; E691-K718 WeakPolarHBondContact O-CD 3.16Å; E691-K718 WeakPolarHBondContact O-CG 3.42Å; E691-K718 WeakPolarHBondContact OE2-CE 3.28Å; E691-K718 IonicContact OE2-NZ 2.72Å; E691-K718 PolarHBondContact OE2-NZ 2.83Å; N693-K718 WeakPolarHBondContact CB-O 3.49Å; N693-K718 PolarHBondContact N-O 3.27Å; G716-K718 PolarHBondContact O-N 2.86Å; G716-K718 VanDerWaalsContact O-N 3.16Å
719	C	84.9	Confident	74.8	Confident	0 Å²	0	79.7 Å²	79.7	0%	0	41%	0.412	C	S	.	.			trans	63.4	45.9	-175.9	-43.3	0	0	0	0	114.5	G696 C710 T715 G716	G696-C719 WeakPolarHBondContact CA-O 3.43Å; G696-C719 VanDerWaalsContact O-CB 3.25Å; G696-C719 WeakPolarHBondContact O-CB 3.33Å; C710-C719 WeakPolarHBondContact CA-SG 3.26Å; C710-C719 HydrophobicContact CB-CB 3.72Å; C710-C719 WeakPolarHBondContact CB-SG 3.47Å; C710-C719 VanDerWaalsContact SG-CA 3.5Å; C710-C719 WeakPolarHBondContact SG-CB 3.46Å; C710-C719 CovalentContact SG-SG 2.04Å; C710-C719 PolarHBondContact SG-SG 2.93Å; T715-C719 CarbonylContact O-C 3.28Å; T715-C719 WeakPolarHBondContact O-CA 3.28Å; G716-C719 WeakPolarHBondContact O-CA 3.35Å; G716-C719 PolarHBondContact O-N 2.82Å
720	D	81.6	Confident	74	Confident	54 Å²	54	77.6 Å²	77.6	29%	0.289	41%	0.408	S	S	.	.			trans	-92.9	-1.3	-167.3	55.8	-61.4	0	0	0	116.8	T715 G716	T715-D720 PolarHBondContact O-N 2.97Å; G716-D720 WeakPolarHBondContact CA-OD1 3.01Å
721	R	83.3	Confident	73.2	Confident	157 Å²	157	81.1 Å²	81.1	59%	0.592	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.2	153	-169.5	-49.9	176.2	-162.3	-179.8	5.9	111.4	F714 T715	F714-R721 CarbonylContact C-O 3.51Å; F714-R721 WeakPolarHBondContact CA-O 3.32Å; T715-R721 HydrophobicContact CG2-CB 3.97Å; T715-R721 PolarHBondContact N-O 3.47Å; T715-R721 PolarHBondContact O-N 2.83Å; T715-R721 VanDerWaalsContact O-N 3.08Å
722	C	80.1	Confident	72.8	Confident	33 Å²	33	77.9 Å²	77.9	22%	0.223	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	149.8	164.1	-65.5	0	0	0	0	110.6	G713 F726 Y729 C732	G713-C722 CarbonylContact O-C 3.3Å; G713-C722 VanDerWaalsContact O-CA 3.23Å; G713-C722 WeakPolarHBondContact O-CA 3.29Å; C722-F726 HydrophobicContact CB-CB 4.45Å; C722-Y729 VanDerWaalsContact SG-CA 3.58Å; C722-Y729 VanDerWaalsContact SG-CB 3.57Å; C722-C732 VanDerWaalsContact CA-SG 3.55Å; C722-C732 HydrophobicContact CB-CB 4.04Å; C722-C732 WeakPolarHBondContact CB-SG 3.32Å; C722-C732 VanDerWaalsContact SG-CA 3.58Å; C722-C732 WeakPolarHBondContact SG-CB 3.35Å; C722-C732 CovalentContact SG-SG 2.05Å; C722-C732 PolarHBondContact SG-SG 2.84Å
723	K	74.6	Confident	72	Confident	124 Å²	124	77.3 Å²	77.3	54%	0.539	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-76.2	154.4	171	-157.8	170.4	-175.3	175.8	0	109.6	G713 F726	G713-K723 PolarHBondContact O-N 2.98Å; K723-F726 HydrophobicContact CB-CD2 4.14Å; K723-F726 PolarHBondContact O-N 3.01Å
724	E	68.2	Low	70.7	Confident	171 Å²	171	84 Å²	84	80%	0.799	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	142.8	-177.1	-66.7	-170.9	131.2	0	0	112.6	F726	E724-F726 VanDerWaalsContact C-N 3.29Å; E724-F726 PolarHBondContact O-N 3.29Å
725	N	56.2	Low	68.9	Low	126 Å²	126	87 Å²	87	67%	0.674	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.5	-3.2	-174.2	-48	-75.9	0	0	0	117	F727	N725-F727 WeakPolarHBondContact O-CD2 3.21Å; N725-F727 WeakPolarHBondContact O-CE2 3.24Å
726	F	63.7	Low	66.9	Low	65 Å²	65	89.4 Å²	89.4	29%	0.285	48%	0.475	S	S	.	.			trans	-96.3	135.9	169.2	-64.5	-91.3	0	0	0	111	C722 K723 E724 C732 E734	C722-F726 HydrophobicContact CB-CB 4.45Å; K723-F726 HydrophobicContact CB-CD2 4.14Å; K723-F726 PolarHBondContact O-N 3.01Å; E724-F726 VanDerWaalsContact C-N 3.29Å; E724-F726 PolarHBondContact O-N 3.29Å; F726-C732 HydrophobicContact CB-CB 3.96Å; F726-C732 VanDerWaalsContact CD1-O 3.25Å; F726-C732 WeakPolarHBondContact CD1-O 3.03Å; F726-E734 HydrophobicContact CD1-CG 3.75Å; F726-E734 HydrophobicContact CE1-CG 3.66Å; F726-E734 HydrophobicContact CZ-CG 4.43Å
727	F	60.2	Low	65	Low	135 Å²	135	96.1 Å²	96.1	59%	0.592	50%	0.504	S	S	*	.	B	Isolated β-bridge	trans	-113.8	169.4	-173.9	-60.6	-86.8	0	0	0	111.8	N725 C732 E733	N725-F727 WeakPolarHBondContact O-CD2 3.21Å; N725-F727 WeakPolarHBondContact O-CE2 3.24Å; F727-C732 CarbonylContact O-C 3.38Å; F727-C732 WeakPolarHBondContact O-CA 3.03Å; F727-C732 PolarHBondContact O-N 2.72Å; F727-E733 PolarHBondContact N-O 3.33Å; F727-E733 PolarHBondContact O-N 3.03Å
728	N	62.9	Low	63.6	Low	103 Å²	103	98.5 Å²	98.5	55%	0.551	52%	0.515	S	S	*	.	S	Bend	trans	61	61.5	177.8	-50.5	-22.4	0	0	0	115.1	L731 C732 E733	N728-L731 HydrophobicContact CB-CB 4.47Å; N728-L731 VanDerWaalsContact O-CA 3.32Å; N728-L731 WeakPolarHBondContact O-CA 3.07Å; N728-L731 VanDerWaalsContact O-CB 3.28Å; N728-L731 WeakPolarHBondContact O-CB 3.5Å; N728-L731 PolarHBondContact O-N 3.32Å; N728-C732 PolarHBondContact O-N 2.79Å; N728-E733 PolarHBondContact ND2-OE2 3Å
729	Y	57.2	Low	62.4	Low	109 Å²	109	99.3 Å²	99.3	43%	0.427	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	135.6	167.1	178.8	-90.5	0	0	0	110.6	N693 F714 C722	N693-Y729 PolarHBondContact ND2-OH 3.34Å; F714-Y729 HydrophobicContact CD1-CD2 4.34Å; F714-Y729 HydrophobicContact CD1-CE2 4.07Å; F714-Y729 AromaticContact CE1-CD2 3.93Å; F714-Y729 HydrophobicContact CE1-CD2 3.93Å; F714-Y729 AromaticContact CE1-CE2 3.69Å; F714-Y729 HydrophobicContact CE1-CE2 3.69Å; C722-Y729 VanDerWaalsContact SG-CA 3.58Å; C722-Y729 VanDerWaalsContact SG-CB 3.57Å
730	P	66.1	Low	61.3	Low	54 Å²	54	102.1 Å²	102.1	35%	0.351	55%	0.551	S	S	.	*	T	Hydrogen-bonded Turn	cis	-98.1	28.5	7.2	40.1	-37	0	0	0	114.6	Y695 F714	Y695-P730 HydrophobicContact CD1-CB 3.82Å; Y695-P730 HydrophobicContact CD1-CG 3.91Å; Y695-P730 HydrophobicContact CE1-CG 4.24Å; Y695-P730 HydrophobicContact CG-CB 3.91Å; Y695-P730 HydrophobicContact CG-CG 4.39Å; F714-P730 WeakPolarHBondContact CZ-O 3.02Å
731	L	64.8	Low	60.6	Low	117 Å²	117	103.5 Å²	103.5	61%	0.613	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	-38.3	174.4	-54.9	171.2	0	0	0	111.8	N728 E733	N728-L731 HydrophobicContact CB-CB 4.47Å; N728-L731 VanDerWaalsContact O-CA 3.32Å; N728-L731 WeakPolarHBondContact O-CA 3.07Å; N728-L731 VanDerWaalsContact O-CB 3.28Å; N728-L731 WeakPolarHBondContact O-CB 3.5Å; N728-L731 PolarHBondContact O-N 3.32Å; L731-E733 HydrophobicContact CB-CG 3.71Å
732	C	69.6	Low	60.5	Low	11 Å²	11	98.9 Å²	98.9	7%	0.074	55%	0.546	C	S	.	.			trans	52.7	69.4	178.7	-55.5	0	0	0	0	112.5	G713 F714 C722 F726 F727 N728	G713-C732 WeakPolarHBondContact O-CB 3.16Å; G713-C732 PolarHBondContact O-SG 3.22Å; F714-C732 HydrophobicContact CE2-CB 4.49Å; C722-C732 VanDerWaalsContact CA-SG 3.55Å; C722-C732 HydrophobicContact CB-CB 4.04Å; C722-C732 WeakPolarHBondContact CB-SG 3.32Å; C722-C732 VanDerWaalsContact SG-CA 3.58Å; C722-C732 WeakPolarHBondContact SG-CB 3.35Å; C722-C732 CovalentContact SG-SG 2.05Å; C722-C732 PolarHBondContact SG-SG 2.84Å; F726-C732 HydrophobicContact CB-CB 3.96Å; F726-C732 VanDerWaalsContact CD1-O 3.25Å; F726-C732 WeakPolarHBondContact CD1-O 3.03Å; F727-C732 CarbonylContact O-C 3.38Å; F727-C732 WeakPolarHBondContact O-CA 3.03Å; F727-C732 PolarHBondContact O-N 2.72Å; N728-C732 PolarHBondContact O-N 2.79Å
733	E	59.7	Low	60.6	Low	92 Å²	92	99.6 Å²	99.6	43%	0.43	55%	0.546	S	S	.	.	B	Isolated β-bridge	trans	-108.2	164.2	-169.9	-57.2	170.8	132.5	0	0	113.7	F727 N728 L731	F727-E733 PolarHBondContact N-O 3.33Å; F727-E733 PolarHBondContact O-N 3.03Å; N728-E733 PolarHBondContact ND2-OE2 3Å; L731-E733 HydrophobicContact CB-CG 3.71Å
734	E	46.8	Very low	60.8	Low	146 Å²	146	94.1 Å²	94.1	68%	0.682	52%	0.523	S	S	*	.			trans	-124	139.5	176.3	-58.8	-175.9	133.1	0	0	112.3	F726	F726-E734 HydrophobicContact CD1-CG 3.75Å; F726-E734 HydrophobicContact CE1-CG 3.66Å; F726-E734 HydrophobicContact CZ-CG 4.43Å
735	G	48.8	Very low	61.4	Low	79 Å²	79	88.9 Å²	88.9	81%	0.814	50%	0.503	S	S	*	.			trans	152.1	154.7	161.7	0	0	0	0	0	118.6
736	S	42.5	Very low	61.9	Low	118 Å²	118	84.1 Å²	84.1	83%	0.825	48%	0.484	S	S	*	.			trans	-161.9	172.1	165.8	67	0	0	0	0	113
737	L	39.6	Very low	61.6	Low	167 Å²	167	93.1 Å²	93.1	87%	0.874	52%	0.516	S	S	*	.			trans	-63	130.5	-169.7	-173.2	71.6	0	0	0	114.4	S739	L737-S739 PolarHBondContact O-N 2.86Å
738	C	46.4	Very low	61.8	Low	117 Å²	117	97.2 Å²	97.2	79%	0.791	53%	0.527	S	S	*	.			trans	-68	85.8	-174.6	-60.4	0	0	0	0	115.2
739	S	54	Low	62.3	Low	108 Å²	108	94.2 Å²	94.2	76%	0.755	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-66.9	128.8	144.9	-61.7	0	0	0	0	108.3	L737 K741	L737-S739 PolarHBondContact O-N 2.86Å; S739-K741 PolarHBondContact O-N 2.82Å
740	C	62	Low	63.1	Low	58 Å²	58	93.1 Å²	93.1	39%	0.392	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-60	128.5	172.1	-69.8	0	0	0	0	109.4	C749	C740-C749 WeakPolarHBondContact CA-SG 3.1Å; C740-C749 HydrophobicContact CB-CB 3.9Å; C740-C749 WeakPolarHBondContact CB-SG 3.44Å; C740-C749 WeakPolarHBondContact SG-CB 3.43Å; C740-C749 CovalentContact SG-SG 2.04Å; C740-C749 PolarHBondContact SG-SG 3.05Å
741	K	66.5	Low	63.7	Low	84 Å²	84	96 Å²	96	37%	0.365	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-53.6	147.4	174.8	-59.9	174.9	171.7	-179.6	0	109.6	S739 Q743 V744 Y761 N763 Q765	S739-K741 PolarHBondContact O-N 2.82Å; K741-Q743 PolarHBondContact O-N 2.94Å; K741-V744 HydrophobicContact CB-CG2 4.04Å; K741-V744 PolarHBondContact O-N 3.32Å; K741-Y761 PolarHBondContact NZ-O 2.87Å; K741-N763 VanDerWaalsContact CD-O 3.28Å; K741-N763 WeakPolarHBondContact CD-O 3.23Å; K741-N763 WeakPolarHBondContact CE-O 3.39Å; K741-N763 PolarHBondContact NZ-O 3.39Å; K741-Q765 CarbonylContact C-O 3.55Å; K741-Q765 VanDerWaalsContact CB-C 3.42Å; K741-Q765 VanDerWaalsContact CB-O 3.28Å; K741-Q765 WeakPolarHBondContact CB-O 3.35Å
742	S	81.7	Confident	64.6	Low	59 Å²	59	91.4 Å²	91.4	41%	0.413	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.9	-31.7	-159.6	43.1	0	0	0	0	115.6	K753 Q765	S742-K753 WeakPolarHBondContact O-CE 3.47Å; S742-K753 PolarHBondContact O-NZ 3.07Å; S742-Q765 WeakPolarHBondContact OG-CB 3.33Å; S742-Q765 VanDerWaalsContact OG-CD 3.23Å; S742-Q765 WeakPolarHBondContact OG-CG 2.89Å; S742-Q765 PolarHBondContact OG-OE1 2.92Å
743	Q	81.3	Confident	65.1	Low	49 Å²	49	94.9 Å²	94.9	23%	0.229	51%	0.513	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	11	-174.8	-49.2	-57	3.1	0	0	114.6	K741 K753 H756 Q765 C767	K741-Q743 PolarHBondContact O-N 2.94Å; Q743-K753 WeakPolarHBondContact O-CB 3.47Å; Q743-K753 WeakPolarHBondContact O-CG 3.26Å; Q743-K753 PolarHBondContact O-N 3.42Å; Q743-H756 HydrophobicContact CB-CB 4.37Å; Q743-H756 WeakPolarHBondContact CB-CD2 3.46Å; Q743-H756 WeakPolarHBondContact CG-CD2 3.33Å; Q743-H756 VanDerWaalsContact CG-NE2 3.31Å; Q743-H756 WeakPolarHBondContact CG-NE2 3.37Å; Q743-H756 PolarHBondContact OE1-CE1 2.96Å; Q743-H756 PolarHBondContact OE1-NE2 2.72Å; Q743-Q765 HydrophobicContact CG-CB 3.92Å; Q743-Q765 PolarHBondContact N-O 2.78Å; Q743-C767 HydrophobicContact CB-CB 4.32Å
744	V	79.7	Confident	66	Low	8 Å²	8	94.9 Å²	94.9	5%	0.048	52%	0.521	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	148.8	-178.5	-160.6	0	0	0	0	111	K741 C749 Q751 K753 L759 G766	K741-V744 HydrophobicContact CB-CG2 4.04Å; K741-V744 PolarHBondContact O-N 3.32Å; V744-C749 HydrophobicContact CB-CB 4.31Å; V744-C749 HydrophobicContact CG1-CB 3.74Å; V744-C749 WeakPolarHBondContact CG1-O 3.36Å; V744-Q751 CarbonylContact C-O 3.48Å; V744-Q751 WeakPolarHBondContact CG1-O 2.98Å; V744-K753 WeakPolarHBondContact O-CE 3.48Å; V744-L759 HydrophobicContact CG1-CD1 3.79Å; V744-L759 HydrophobicContact CG2-CD1 4.48Å; V744-G766 VanDerWaalsContact CG2-CA 3.46Å
745	T	80.5	Confident	67.6	Low	61 Å²	61	93 Å²	93	37%	0.374	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	177.1	178.7	-165.9	0	0	0	0	111.5	C749 Q750 Q751 C752 K753	T745-C749 CarbonylContact O-C 3.6Å; T745-C749 WeakPolarHBondContact O-CA 3.12Å; T745-Q750 PolarHBondContact O-N 2.81Å; T745-Q750 VanDerWaalsContact O-N 3.09Å; T745-Q751 HydrophobicContact CG2-CB 3.82Å; T745-Q751 PolarHBondContact N-O 3.38Å; T745-Q751 PolarHBondContact O-N 3.31Å; T745-C752 WeakPolarHBondContact CG2-O 3.48Å; T745-K753 HydrophobicContact CG2-CG 4.34Å
746	G	65.2	Low	69.4	Low	26 Å²	26	90.3 Å²	90.3	27%	0.268	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.9	157.2	-174.5	0	0	0	0	0	113.7	R748 C749	G746-R748 PolarHBondContact O-N 3.39Å; G746-R748 VanDerWaalsContact O-N 3.09Å; G746-C749 PolarHBondContact O-N 3.19Å
747	R	58.6	Low	71.6	Confident	255 Å²	255	86.2 Å²	86.2	96%	0.962	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-14.4	-173.2	-80.5	-175.1	172.4	-178.6	-2.6	115.3
748	R	64.5	Low	73.5	Confident	221 Å²	221	79.7 Å²	79.7	83%	0.834	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.8	17.1	177.5	-59.8	-178.9	-180	169.4	-2.9	111.7	G746 Q750	G746-R748 PolarHBondContact O-N 3.39Å; G746-R748 VanDerWaalsContact O-N 3.09Å; R748-Q750 VanDerWaalsContact C-N 3.31Å; R748-Q750 HydrophobicContact CB-CB 4.25Å; R748-Q750 HydrophobicContact CB-CG 4.46Å; R748-Q750 PolarHBondContact O-N 2.97Å
749	C	72.1	Confident	74.9	Confident	39 Å²	39	78 Å²	78	26%	0.264	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.4	50.3	-170	-38.1	0	0	0	0	111.2	C740 V744 T745 G746	C740-C749 WeakPolarHBondContact CA-SG 3.1Å; C740-C749 HydrophobicContact CB-CB 3.9Å; C740-C749 WeakPolarHBondContact CB-SG 3.44Å; C740-C749 WeakPolarHBondContact SG-CB 3.43Å; C740-C749 CovalentContact SG-SG 2.04Å; C740-C749 PolarHBondContact SG-SG 3.05Å; V744-C749 HydrophobicContact CB-CB 4.31Å; V744-C749 HydrophobicContact CG1-CB 3.74Å; V744-C749 WeakPolarHBondContact CG1-O 3.36Å; T745-C749 CarbonylContact O-C 3.6Å; T745-C749 WeakPolarHBondContact O-CA 3.12Å; G746-C749 PolarHBondContact O-N 3.19Å
750	Q	74.7	Confident	75.8	Confident	87 Å²	87	76.5 Å²	76.5	41%	0.407	37%	0.373	S	S	.	.			trans	-115.5	13.9	-167.5	86.1	-58.5	-30.6	0	0	114.8	T745 R748 L759	T745-Q750 PolarHBondContact O-N 2.81Å; T745-Q750 VanDerWaalsContact O-N 3.09Å; R748-Q750 VanDerWaalsContact C-N 3.31Å; R748-Q750 HydrophobicContact CB-CB 4.25Å; R748-Q750 HydrophobicContact CB-CG 4.46Å; R748-Q750 PolarHBondContact O-N 2.97Å; Q750-L759 VanDerWaalsContact C-CD2 3.49Å; Q750-L759 WeakPolarHBondContact O-CD2 3.01Å
751	Q	78.5	Confident	75.8	Confident	113 Å²	113	83.7 Å²	83.7	53%	0.528	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	145.5	175	-73.1	177.1	-50	0	0	109.5	V744 T745	V744-Q751 CarbonylContact C-O 3.48Å; V744-Q751 WeakPolarHBondContact CG1-O 2.98Å; T745-Q751 HydrophobicContact CG2-CB 3.82Å; T745-Q751 PolarHBondContact N-O 3.38Å; T745-Q751 PolarHBondContact O-N 3.31Å
752	C	82.9	Confident	75.6	Confident	22 Å²	22	85 Å²	85	15%	0.149	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	148.3	166.9	-59.2	0	0	0	0	111.1	T745 H756 C767	T745-C752 WeakPolarHBondContact CG2-O 3.48Å; C752-H756 HydrophobicContact CB-CB 4.03Å; C752-H756 WeakPolarHBondContact CB-O 3.42Å; C752-C767 WeakPolarHBondContact CA-SG 3.39Å; C752-C767 HydrophobicContact CB-CB 3.67Å; C752-C767 WeakPolarHBondContact CB-SG 3.49Å; C752-C767 WeakPolarHBondContact SG-CB 3.44Å; C752-C767 CovalentContact SG-SG 2.04Å; C752-C767 PolarHBondContact SG-SG 3.42Å
753	K	80.7	Confident	74.8	Confident	84 Å²	84	83.1 Å²	83.1	37%	0.365	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-66.2	159.2	162.5	-71.4	179.2	-172.9	171.5	0	109.3	S742 Q743 V744 T745 H756	S742-K753 WeakPolarHBondContact O-CE 3.47Å; S742-K753 PolarHBondContact O-NZ 3.07Å; Q743-K753 WeakPolarHBondContact O-CB 3.47Å; Q743-K753 WeakPolarHBondContact O-CG 3.26Å; Q743-K753 PolarHBondContact O-N 3.42Å; V744-K753 WeakPolarHBondContact O-CE 3.48Å; T745-K753 HydrophobicContact CG2-CG 4.34Å; K753-H756 WeakPolarHBondContact O-CB 3.48Å; K753-H756 PolarHBondContact O-N 2.79Å
754	P	78.2	Confident	74.1	Confident	91 Å²	91	88.5 Å²	88.5	59%	0.591	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.1	150.5	169.5	-27.4	35.7	0	0	0	111.9	H756	P754-H756 PolarHBondContact O-N 3.5Å; P754-H756 PolarHBondContact O-ND1 2.78Å
755	F	81.4	Confident	73.9	Confident	106 Å²	106	92.4 Å²	92.4	47%	0.465	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.3	19.2	-173	-36.8	-70.2	0	0	0	115.2	C770 D783	F755-C770 PolarHBondContact O-N 2.81Å; F755-C770 PolarHBondContact O-SG 2.94Å; F755-D783 HydrophobicContact CD1-CB 3.98Å; F755-D783 HydrophobicContact CE1-CB 4.07Å; F755-D783 PolarHBondContact N-OD1 2.66Å
756	H	87.1	Confident	73.9	Confident	23 Å²	23	89.6 Å²	89.6	11%	0.106	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	152.2	177.8	-58.9	77.6	0	0	0	113	Q743 C752 K753 P754 C767 E768 P769	Q743-H756 HydrophobicContact CB-CB 4.37Å; Q743-H756 WeakPolarHBondContact CB-CD2 3.46Å; Q743-H756 WeakPolarHBondContact CG-CD2 3.33Å; Q743-H756 VanDerWaalsContact CG-NE2 3.31Å; Q743-H756 WeakPolarHBondContact CG-NE2 3.37Å; Q743-H756 PolarHBondContact OE1-CE1 2.96Å; Q743-H756 PolarHBondContact OE1-NE2 2.72Å; C752-H756 HydrophobicContact CB-CB 4.03Å; C752-H756 WeakPolarHBondContact CB-O 3.42Å; K753-H756 WeakPolarHBondContact O-CB 3.48Å; K753-H756 PolarHBondContact O-N 2.79Å; P754-H756 PolarHBondContact O-N 3.5Å; P754-H756 PolarHBondContact O-ND1 2.78Å; H756-C767 HydrophobicContact CB-CB 3.77Å; H756-E768 CarbonylContact C-O 3.48Å; H756-E768 WeakPolarHBondContact CA-O 3.46Å; H756-E768 VanDerWaalsContact CB-O 3.29Å; H756-E768 WeakPolarHBondContact CB-O 3.32Å; H756-P769 WeakPolarHBondContact CD2-CA 3.43Å
757	W	88.9	Confident	74.9	Confident	32 Å²	32	88.4 Å²	88.4	12%	0.121	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	-171.9	-174.8	78.5	-65.6	0	0	0	111	C767 E768 S788 G789 R800	W757-C767 CarbonylContact O-C 3.51Å; W757-C767 VanDerWaalsContact O-CA 3.25Å; W757-C767 WeakPolarHBondContact O-CA 3.19Å; W757-C767 WeakPolarHBondContact O-CB 3.46Å; W757-E768 WeakPolarHBondContact CZ2-OE2 3.44Å; W757-E768 PolarHBondContact N-O 3.35Å; W757-E768 PolarHBondContact O-N 2.03Å; W757-S788 WeakPolarHBondContact CZ3-O 3.47Å; W757-G789 VanDerWaalsContact CE3-N 3.3Å; W757-R800 VanDerWaalsContact CH2-CD 3.45Å
758	N	77.6	Confident	76	Confident	31 Å²	31	79.4 Å²	79.4	17%	0.166	37%	0.372	C	S	.	.			trans	52.9	63.5	177.7	-151.1	24.9	0	0	0	113.4	Q760 N763 E768	N758-Q760 HydrophobicContact CB-CG 4.44Å; N758-Q760 VanDerWaalsContact CG-CG 3.46Å; N758-Q760 PolarHBondContact O-N 3.09Å; N758-Q760 WeakPolarHBondContact OD1-CG 3.46Å; N758-Q760 PolarHBondContact OD1-NE2 2.95Å; N758-N763 PolarHBondContact O-ND2 2.86Å; N758-E768 HydrophobicContact CB-CB 4.46Å; N758-E768 PolarHBondContact ND2-OE1 3.17Å
759	L	77.6	Confident	77	Confident	82 Å²	82	71.2 Å²	71.2	43%	0.429	35%	0.348	S	S	.	.			trans	-69.3	75.5	174.9	-175.5	71.5	0	0	0	110.8	V744 Q750 G766 C767	V744-L759 HydrophobicContact CG1-CD1 3.79Å; V744-L759 HydrophobicContact CG2-CD1 4.48Å; Q750-L759 VanDerWaalsContact C-CD2 3.49Å; Q750-L759 WeakPolarHBondContact O-CD2 3.01Å; L759-G766 WeakPolarHBondContact CA-O 3.41Å; L759-C767 VanDerWaalsContact CD1-SG 3.5Å
760	Q	71.1	Confident	77.6	Confident	76 Å²	76	69.5 Å²	69.5	36%	0.355	34%	0.337	S	S	.	.			trans	-102.4	141.2	-178.8	-63.3	-76.3	-7.3	0	0	110.6	N758 H762 N763	N758-Q760 HydrophobicContact CB-CG 4.44Å; N758-Q760 VanDerWaalsContact CG-CG 3.46Å; N758-Q760 PolarHBondContact O-N 3.09Å; N758-Q760 WeakPolarHBondContact OD1-CG 3.46Å; N758-Q760 PolarHBondContact OD1-NE2 2.95Å; Q760-H762 WeakPolarHBondContact CB-NE2 3.2Å; Q760-H762 PolarHBondContact O-N 3.27Å; Q760-H762 PolarHBondContact OE1-CE1 3.48Å; Q760-N763 HydrophobicContact CB-CB 3.95Å; Q760-N763 WeakPolarHBondContact O-CB 3.5Å; Q760-N763 PolarHBondContact O-N 3.49Å
761	Y	63.7	Low	78.1	Confident	209 Å²	209	70.6 Å²	70.6	82%	0.82	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-36.9	178.2	90.5	-85.1	0	0	0	112	K741	K741-Y761 PolarHBondContact NZ-O 2.87Å
762	H	61.7	Low	78.4	Confident	112 Å²	112	65.8 Å²	65.8	52%	0.519	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-17.3	-178.7	56.8	-108.6	0	0	0	114.5	Q760 L764	Q760-H762 WeakPolarHBondContact CB-NE2 3.2Å; Q760-H762 PolarHBondContact O-N 3.27Å; Q760-H762 PolarHBondContact OE1-CE1 3.48Å; H762-L764 PolarHBondContact O-N 3.01Å
763	N	64.2	Low	78.6	Confident	18 Å²	18	69.3 Å²	69.3	10%	0.096	34%	0.335	C	S	.	.			trans	-66.2	123.7	-177.5	178.3	-22.7	0	0	0	110.7	K741 N758 Q760 Q765 G766 C767 E768	K741-N763 VanDerWaalsContact CD-O 3.28Å; K741-N763 WeakPolarHBondContact CD-O 3.23Å; K741-N763 WeakPolarHBondContact CE-O 3.39Å; K741-N763 PolarHBondContact NZ-O 3.39Å; N758-N763 PolarHBondContact O-ND2 2.86Å; Q760-N763 HydrophobicContact CB-CB 3.95Å; Q760-N763 WeakPolarHBondContact O-CB 3.5Å; Q760-N763 PolarHBondContact O-N 3.49Å; N763-Q765 PolarHBondContact O-N 3.47Å; N763-Q765 PolarHBondContact OD1-N 2.91Å; N763-Q765 VanDerWaalsContact OD1-N 3.14Å; N763-G766 VanDerWaalsContact O-CA 3.32Å; N763-G766 WeakPolarHBondContact O-CA 3.49Å; N763-G766 PolarHBondContact O-N 3.22Å; N763-G766 PolarHBondContact OD1-N 2.57Å; N763-G766 VanDerWaalsContact OD1-N 3.13Å; N763-C767 WeakPolarHBondContact ND2-CA 3.5Å; N763-E768 PolarHBondContact ND2-N 3.31Å
764	L	67.9	Low	78.6	Confident	162 Å²	162	68 Å²	68	85%	0.848	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-36.9	-173.2	-81.7	168.2	0	0	0	113.8	H762 G766	H762-L764 PolarHBondContact O-N 3.01Å; L764-G766 VanDerWaalsContact C-N 3.35Å
765	Q	74.2	Confident	78.7	Confident	90 Å²	90	66.4 Å²	66.4	42%	0.421	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	0.2	172.6	-63.3	-155.2	26.3	0	0	112.8	K741 S742 Q743 N763 C767	K741-Q765 CarbonylContact C-O 3.55Å; K741-Q765 VanDerWaalsContact CB-C 3.42Å; K741-Q765 VanDerWaalsContact CB-O 3.28Å; K741-Q765 WeakPolarHBondContact CB-O 3.35Å; S742-Q765 WeakPolarHBondContact OG-CB 3.33Å; S742-Q765 VanDerWaalsContact OG-CD 3.23Å; S742-Q765 WeakPolarHBondContact OG-CG 2.89Å; S742-Q765 PolarHBondContact OG-OE1 2.92Å; Q743-Q765 HydrophobicContact CG-CB 3.92Å; Q743-Q765 PolarHBondContact N-O 2.78Å; N763-Q765 PolarHBondContact O-N 3.47Å; N763-Q765 PolarHBondContact OD1-N 2.91Å; N763-Q765 VanDerWaalsContact OD1-N 3.14Å; Q765-C767 PolarHBondContact O-N 3.4Å; Q765-C767 VanDerWaalsContact O-N 3.09Å
766	G	80.4	Confident	78.6	Confident	3 Å²	3	61.3 Å²	61.3	3%	0.031	30%	0.296	C	S	.	.	S	Bend	trans	79.8	-30.3	172.6	0	0	0	0	0	114.2	V744 L759 N763 L764	V744-G766 VanDerWaalsContact CG2-CA 3.46Å; L759-G766 WeakPolarHBondContact CA-O 3.41Å; N763-G766 VanDerWaalsContact O-CA 3.32Å; N763-G766 WeakPolarHBondContact O-CA 3.49Å; N763-G766 PolarHBondContact O-N 3.22Å; N763-G766 PolarHBondContact OD1-N 2.57Å; N763-G766 VanDerWaalsContact OD1-N 3.13Å; L764-G766 VanDerWaalsContact C-N 3.35Å
767	C	85.8	Confident	78.4	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	29%	0.291	C	S	.	.	S	Bend	trans	-132	145.3	157.9	-68.4	0	0	0	0	109.1	Q743 C752 H756 W757 L759 N763 Q765	Q743-C767 HydrophobicContact CB-CB 4.32Å; C752-C767 WeakPolarHBondContact CA-SG 3.39Å; C752-C767 HydrophobicContact CB-CB 3.67Å; C752-C767 WeakPolarHBondContact CB-SG 3.49Å; C752-C767 WeakPolarHBondContact SG-CB 3.44Å; C752-C767 CovalentContact SG-SG 2.04Å; C752-C767 PolarHBondContact SG-SG 3.42Å; H756-C767 HydrophobicContact CB-CB 3.77Å; W757-C767 CarbonylContact O-C 3.51Å; W757-C767 VanDerWaalsContact O-CA 3.25Å; W757-C767 WeakPolarHBondContact O-CA 3.19Å; W757-C767 WeakPolarHBondContact O-CB 3.46Å; L759-C767 VanDerWaalsContact CD1-SG 3.5Å; N763-C767 WeakPolarHBondContact ND2-CA 3.5Å; Q765-C767 PolarHBondContact O-N 3.4Å; Q765-C767 VanDerWaalsContact O-N 3.09Å
768	E	82	Confident	77.4	Confident	66 Å²	66	62.7 Å²	62.7	31%	0.308	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	143.1	173.9	-91.2	155	-109.5	0	0	110.2	H756 W757 N758 N763	H756-E768 CarbonylContact C-O 3.48Å; H756-E768 WeakPolarHBondContact CA-O 3.46Å; H756-E768 VanDerWaalsContact CB-O 3.29Å; H756-E768 WeakPolarHBondContact CB-O 3.32Å; W757-E768 WeakPolarHBondContact CZ2-OE2 3.44Å; W757-E768 PolarHBondContact N-O 3.35Å; W757-E768 PolarHBondContact O-N 2.03Å; N758-E768 HydrophobicContact CB-CB 4.46Å; N758-E768 PolarHBondContact ND2-OE1 3.17Å; N763-E768 PolarHBondContact ND2-N 3.31Å
769	P	85.8	Confident	76.9	Confident	50 Å²	50	66.3 Å²	66.3	33%	0.325	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	140.9	166.8	27.2	-33.5	0	0	0	109.9	H756 N771	H756-P769 WeakPolarHBondContact CD2-CA 3.43Å; P769-N771 WeakPolarHBondContact CB-OD1 3.27Å; P769-N771 WeakPolarHBondContact CG-OD1 3.18Å; P769-N771 PolarHBondContact O-N 3.32Å; P769-N771 VanDerWaalsContact O-N 3.08Å
770	C	85	Confident	76.2	Confident	3 Å²	3	65.9 Å²	65.9	2%	0.02	34%	0.337	C	S	.	.			trans	-53.1	-33.4	178.4	-72.9	0	0	0	0	112.1	F755 C772 C784 R800	F755-C770 PolarHBondContact O-N 2.81Å; F755-C770 PolarHBondContact O-SG 2.94Å; C770-C772 PolarHBondContact O-N 3.39Å; C770-C772 VanDerWaalsContact O-N 3.11Å; C770-C784 HydrophobicContact CB-CB 3.69Å; C770-C784 WeakPolarHBondContact CB-SG 3.42Å; C770-C784 WeakPolarHBondContact SG-CB 3.46Å; C770-C784 PolarHBondContact SG-N 2.81Å; C770-C784 VanDerWaalsContact SG-N 3.38Å; C770-C784 CovalentContact SG-SG 2.02Å; C770-C784 PolarHBondContact SG-SG 3.42Å; C770-R800 PolarHBondContact O-NH1 3.33Å; C770-R800 PolarHBondContact O-NH2 3.44Å
771	N	85.4	Confident	75.9	Confident	110 Å²	110	66.4 Å²	66.4	59%	0.588	34%	0.342	S	S	*	.			trans	54.7	22.9	-178.5	-71.9	-13.9	0	0	0	114.4	P769 Y773	P769-N771 WeakPolarHBondContact CB-OD1 3.27Å; P769-N771 WeakPolarHBondContact CG-OD1 3.18Å; P769-N771 PolarHBondContact O-N 3.32Å; P769-N771 VanDerWaalsContact O-N 3.08Å; N771-Y773 PolarHBondContact O-N 2.93Å
772	C	85.6	Confident	76.3	Confident	11 Å²	11	59.3 Å²	59.3	7%	0.074	32%	0.321	C	S	.	.			trans	-52.3	121.7	-179.8	-57.8	0	0	0	0	111.9	C770 V774 T777 C791	C770-C772 PolarHBondContact O-N 3.39Å; C770-C772 VanDerWaalsContact O-N 3.11Å; C772-V774 PolarHBondContact O-N 3.41Å; C772-T777 HydrophobicContact CB-CG2 3.9Å; C772-C791 WeakPolarHBondContact CA-SG 3.39Å; C772-C791 HydrophobicContact CB-CB 3.76Å; C772-C791 WeakPolarHBondContact CB-SG 3.14Å; C772-C791 WeakPolarHBondContact SG-CB 3.46Å; C772-C791 CovalentContact SG-SG 2.03Å; C772-C791 PolarHBondContact SG-SG 3.41Å
773	Y	86.4	Confident	77.1	Confident	97 Å²	97	57.2 Å²	57.2	38%	0.38	31%	0.313	S	S	.	.			trans	-74.4	99.6	179.9	-168	-108.9	0	0	0	109.7	N771 Q775 G776 T777 D801 M812	N771-Y773 PolarHBondContact O-N 2.93Å; Y773-Q775 HydrophobicContact CD1-CB 4.03Å; Y773-Q775 HydrophobicContact CE1-CB 3.67Å; Y773-Q775 HydrophobicContact CE1-CG 3.95Å; Y773-Q775 PolarHBondContact O-N 2.84Å; Y773-Q775 PolarHBondContact OH-OE1 3.35Å; Y773-G776 WeakPolarHBondContact O-CA 3.02Å; Y773-G776 PolarHBondContact O-N 2.04Å; Y773-T777 PolarHBondContact O-N 3.24Å; Y773-D801 WeakPolarHBondContact CB-O 3.45Å; Y773-D801 PolarHBondContact N-O 2.85Å; Y773-M812 HydrophobicContact CD1-CE 4.39Å; Y773-M812 HydrophobicContact CD1-SD 3.43Å; Y773-M812 WeakPolarHBondContact CD1-SD 3.2Å; Y773-M812 HydrophobicContact CE1-CG 4.43Å; Y773-M812 HydrophobicContact CE1-SD 3.52Å; Y773-M812 VanDerWaalsContact CE1-SD 3.52Å
774	V	80.7	Confident	78.1	Confident	57 Å²	57	56.7 Å²	56.7	35%	0.345	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-11	-172.1	-74.5	0	0	0	0	116.5	C772 T782	C772-V774 PolarHBondContact O-N 3.41Å; V774-T782 HydrophobicContact CG1-CG2 3.5Å
775	Q	80.7	Confident	78.6	Confident	56 Å²	56	52.2 Å²	52.2	26%	0.262	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-28.4	170.9	-50.1	-167.2	-16.4	0	0	112.6	Y773 K794 Q814	Y773-Q775 HydrophobicContact CD1-CB 4.03Å; Y773-Q775 HydrophobicContact CE1-CB 3.67Å; Y773-Q775 HydrophobicContact CE1-CG 3.95Å; Y773-Q775 PolarHBondContact O-N 2.84Å; Y773-Q775 PolarHBondContact OH-OE1 3.35Å; Q775-K794 VanDerWaalsContact O-CE 3.24Å; Q775-K794 WeakPolarHBondContact O-CE 3.15Å; Q775-K794 PolarHBondContact O-NZ 3.16Å; Q775-Q814 HydrophobicContact CB-CB 4.01Å; Q775-Q814 HydrophobicContact CB-CG 4.4Å; Q775-Q814 HydrophobicContact CG-CB 3.9Å; Q775-Q814 HydrophobicContact CG-CG 4.24Å
776	G	79.3	Confident	78.7	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-9	-178.5	0	0	0	0	0	114.7	Y773 C793 K794 T797 M812	Y773-G776 WeakPolarHBondContact O-CA 3.02Å; Y773-G776 PolarHBondContact O-N 2.04Å; G776-C793 WeakPolarHBondContact O-CA 3.03Å; G776-K794 PolarHBondContact O-N 2.82Å; G776-T797 PolarHBondContact O-OG1 3.31Å; G776-M812 VanDerWaalsContact CA-SD 3.51Å
777	T	82.9	Confident	78.3	Confident	2 Å²	2	60.8 Å²	60.8	1%	0.012	33%	0.331	C	S	.	.	B	Isolated β-bridge	trans	-90.2	152.7	174.2	54.8	0	0	0	0	114.5	C772 Y773 L781 C791 Q792 K794 C802	C772-T777 HydrophobicContact CB-CG2 3.9Å; Y773-T777 PolarHBondContact O-N 3.24Å; T777-L781 WeakPolarHBondContact CB-O 3.15Å; T777-L781 PolarHBondContact OG1-O 3.21Å; T777-C791 HydrophobicContact CG2-CB 3.95Å; T777-Q792 CarbonylContact C-O 3.58Å; T777-Q792 WeakPolarHBondContact CA-O 3.4Å; T777-Q792 WeakPolarHBondContact CB-O 3.5Å; T777-K794 VanDerWaalsContact O-CE 3.3Å; T777-K794 WeakPolarHBondContact O-CE 3.47Å; T777-C802 HydrophobicContact CG2-CB 4.18Å
778	L	68.1	Low	78	Confident	82 Å²	82	63.9 Å²	63.9	43%	0.429	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-67	137.9	168.3	-78.2	162	0	0	0	110.5	S780 L781 Q792 C793 K794	L778-S780 PolarHBondContact O-N 3.09Å; L778-L781 PolarHBondContact O-N 3.22Å; L778-Q792 PolarHBondContact N-O 2.91Å; L778-C793 WeakPolarHBondContact CD1-O 3.35Å; L778-K794 HydrophobicContact CG-CG 4.46Å
779	S	67.1	Low	78	Confident	107 Å²	107	60.7 Å²	60.7	75%	0.748	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	54	23	175.2	-55.7	0	0	0	0	115.9	L781	S779-L781 PolarHBondContact O-N 2.78Å
780	S	63.1	Low	77.9	Confident	72 Å²	72	62.3 Å²	62.3	50%	0.503	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	57	22.9	-176.3	-52.3	0	0	0	0	114.5	L778	L778-S780 PolarHBondContact O-N 3.09Å
781	L	64.9	Low	78.1	Confident	87 Å²	87	62.3 Å²	62.3	46%	0.455	34%	0.341	S	S	.	.			trans	-72.3	136.9	179.6	-74.2	163.6	0	0	0	110.8	T777 L778 S779	T777-L781 WeakPolarHBondContact CB-O 3.15Å; T777-L781 PolarHBondContact OG1-O 3.21Å; L778-L781 PolarHBondContact O-N 3.22Å; S779-L781 PolarHBondContact O-N 2.78Å
782	T	72.1	Confident	78.1	Confident	61 Å²	61	62.8 Å²	62.8	37%	0.374	34%	0.34	S	S	.	.			trans	-105	5.6	177.7	54.1	0	0	0	0	113.4	V774	V774-T782 HydrophobicContact CG1-CG2 3.5Å
783	D	77.4	Confident	78.1	Confident	67 Å²	67	63.8 Å²	63.8	36%	0.358	35%	0.346	S	S	.	.			trans	-88.1	149.4	178.6	-157.3	30.9	0	0	0	110.7	F755	F755-D783 HydrophobicContact CD1-CB 3.98Å; F755-D783 HydrophobicContact CE1-CB 4.07Å; F755-D783 PolarHBondContact N-OD1 2.66Å
784	C	84.9	Confident	77.8	Confident	7 Å²	7	60 Å²	60	5%	0.047	33%	0.332	C	S	.	.	B	Isolated β-bridge	trans	-140.7	161.9	-177.2	72.7	0	0	0	0	111.6	C770 H786 G789 Q790	C770-C784 HydrophobicContact CB-CB 3.69Å; C770-C784 WeakPolarHBondContact CB-SG 3.42Å; C770-C784 WeakPolarHBondContact SG-CB 3.46Å; C770-C784 PolarHBondContact SG-N 2.81Å; C770-C784 VanDerWaalsContact SG-N 3.38Å; C770-C784 CovalentContact SG-SG 2.02Å; C770-C784 PolarHBondContact SG-SG 3.42Å; C784-H786 PolarHBondContact O-N 2.78Å; C784-H786 PolarHBondContact O-ND1 2.91Å; C784-G789 VanDerWaalsContact CB-O 3.32Å; C784-G789 WeakPolarHBondContact CB-O 3.49Å; C784-Q790 WeakPolarHBondContact CA-O 3.34Å; C784-Q790 WeakPolarHBondContact CB-O 3.27Å
785	D	79.5	Confident	77.9	Confident	68 Å²	68	62.6 Å²	62.6	36%	0.364	34%	0.343	S	S	.	.			trans	-58.4	133.8	175.3	174.5	-108	0	0	0	111.4	L787 S788 G789 Q790	D785-L787 PolarHBondContact O-N 2.03Å; D785-L787 PolarHBondContact OD1-N 2.05Å; D785-S788 WeakPolarHBondContact CB-OG 3.42Å; D785-S788 WeakPolarHBondContact OD1-CB 3.38Å; D785-S788 PolarHBondContact OD1-N 3.24Å; D785-S788 PolarHBondContact OD1-OG 2.84Å; D785-G789 WeakPolarHBondContact O-CA 3.07Å; D785-G789 PolarHBondContact O-N 3.08Å; D785-Q790 PolarHBondContact N-O 3.49Å; D785-Q790 VanDerWaalsContact N-O 3.07Å
786	H	76.4	Confident	78.1	Confident	122 Å²	122	61 Å²	61	57%	0.565	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-12.6	-164.8	-31.8	-41.4	0	0	0	113.1	C784	C784-H786 PolarHBondContact O-N 2.78Å; C784-H786 PolarHBondContact O-ND1 2.91Å
787	L	71.8	Confident	78.3	Confident	152 Å²	152	61.1 Å²	61.1	80%	0.796	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.8	-56.1	-178	-73.8	161.2	0	0	0	111.2	D785	D785-L787 PolarHBondContact O-N 2.03Å; D785-L787 PolarHBondContact OD1-N 2.05Å
788	S	78.6	Confident	78.1	Confident	64 Å²	64	64.4 Å²	64.4	45%	0.448	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-15.4	-178.5	65.1	0	0	0	0	114.2	W757 D785 Q790	W757-S788 WeakPolarHBondContact CZ3-O 3.47Å; D785-S788 WeakPolarHBondContact CB-OG 3.42Å; D785-S788 WeakPolarHBondContact OD1-CB 3.38Å; D785-S788 PolarHBondContact OD1-N 3.24Å; D785-S788 PolarHBondContact OD1-OG 2.84Å; S788-Q790 PolarHBondContact O-N 3.12Å; S788-Q790 PolarHBondContact OG-N 2.84Å
789	G	81.9	Confident	78.4	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	34%	0.344	C	S	.	.			trans	70.5	6.2	-177.2	0	0	0	0	0	114.9	W757 C784 D785 C791 R800	W757-G789 VanDerWaalsContact CE3-N 3.3Å; C784-G789 VanDerWaalsContact CB-O 3.32Å; C784-G789 WeakPolarHBondContact CB-O 3.49Å; D785-G789 WeakPolarHBondContact O-CA 3.07Å; D785-G789 PolarHBondContact O-N 3.08Å; G789-C791 PolarHBondContact O-N 2.86Å; G789-R800 WeakPolarHBondContact O-CG 3.46Å; G789-R800 PolarHBondContact O-NH1 2.68Å
790	Q	84.5	Confident	79.2	Confident	83 Å²	83	59.3 Å²	59.3	39%	0.388	32%	0.32	S	S	.	.			trans	-67.9	121.1	-174.1	-174.8	57.6	59.5	0	0	111.2	C784 D785 S788 C793 G799 R800	C784-Q790 WeakPolarHBondContact CA-O 3.34Å; C784-Q790 WeakPolarHBondContact CB-O 3.27Å; D785-Q790 PolarHBondContact N-O 3.49Å; D785-Q790 VanDerWaalsContact N-O 3.07Å; S788-Q790 PolarHBondContact O-N 3.12Å; S788-Q790 PolarHBondContact OG-N 2.84Å; Q790-C793 PolarHBondContact NE2-SG 3.12Å; Q790-C793 VanDerWaalsContact NE2-SG 3.44Å; Q790-G799 PolarHBondContact NE2-O 2.68Å; Q790-G799 VanDerWaalsContact NE2-O 3.09Å; Q790-R800 PolarHBondContact NE2-O 2.97Å
791	C	88.4	Confident	80.4	Confident	3 Å²	3	57.9 Å²	57.9	2%	0.02	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-79.1	153.2	171.6	-61.8	0	0	0	0	110.8	C772 T777 G789 C793 R800 C802	C772-C791 WeakPolarHBondContact CA-SG 3.39Å; C772-C791 HydrophobicContact CB-CB 3.76Å; C772-C791 WeakPolarHBondContact CB-SG 3.14Å; C772-C791 WeakPolarHBondContact SG-CB 3.46Å; C772-C791 CovalentContact SG-SG 2.03Å; C772-C791 PolarHBondContact SG-SG 3.41Å; T777-C791 HydrophobicContact CG2-CB 3.95Å; G789-C791 PolarHBondContact O-N 2.86Å; C791-C793 PolarHBondContact O-N 2.81Å; C791-C793 VanDerWaalsContact O-N 3.07Å; C791-C793 PolarHBondContact O-SG 3.12Å; C791-R800 WeakPolarHBondContact CB-O 3.49Å; C791-R800 PolarHBondContact N-O 2.62Å; C791-R800 PolarHBondContact SG-O 3.12Å; C791-R800 VanDerWaalsContact SG-O 3.41Å; C791-C802 VanDerWaalsContact CB-SG 3.56Å
792	Q	85.4	Confident	81.5	Confident	120 Å²	120	53.8 Å²	53.8	56%	0.561	29%	0.285	S	S	*	.			trans	-77	92.9	178.5	-67.9	-168.4	3.3	0	0	111.7	T777 L778	T777-Q792 CarbonylContact C-O 3.58Å; T777-Q792 WeakPolarHBondContact CA-O 3.4Å; T777-Q792 WeakPolarHBondContact CB-O 3.5Å; L778-Q792 PolarHBondContact N-O 2.91Å
793	C	86.2	Confident	82.1	Confident	32 Å²	32	53 Å²	53	22%	0.216	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-76.8	151.2	-175.9	-54.3	0	0	0	0	114	G776 L778 Q790 C791 T797 C802	G776-C793 WeakPolarHBondContact O-CA 3.03Å; L778-C793 WeakPolarHBondContact CD1-O 3.35Å; Q790-C793 PolarHBondContact NE2-SG 3.12Å; Q790-C793 VanDerWaalsContact NE2-SG 3.44Å; C791-C793 PolarHBondContact O-N 2.81Å; C791-C793 VanDerWaalsContact O-N 3.07Å; C791-C793 PolarHBondContact O-SG 3.12Å; C793-T797 WeakPolarHBondContact CB-OG1 3.37Å; C793-C802 WeakPolarHBondContact CA-SG 3.3Å; C793-C802 HydrophobicContact CB-CB 3.84Å; C793-C802 WeakPolarHBondContact CB-SG 3.31Å; C793-C802 PolarHBondContact N-SG 3.24Å; C793-C802 VanDerWaalsContact N-SG 3.37Å; C793-C802 VanDerWaalsContact SG-CA 3.56Å; C793-C802 WeakPolarHBondContact SG-CB 3.44Å; C793-C802 CovalentContact SG-SG 2.04Å; C793-C802 PolarHBondContact SG-SG 2.8Å
794	K	80.3	Confident	82.5	Confident	19 Å²	19	54.5 Å²	54.5	8%	0.083	29%	0.287	C	S	.	.			trans	-69.5	165.5	166.6	-65.5	176.3	175.8	177.5	0	110.9	Q775 G776 T777 L778 N796 T797 N813 Q814 N816 F818 G819	Q775-K794 VanDerWaalsContact O-CE 3.24Å; Q775-K794 WeakPolarHBondContact O-CE 3.15Å; Q775-K794 PolarHBondContact O-NZ 3.16Å; G776-K794 PolarHBondContact O-N 2.82Å; T777-K794 VanDerWaalsContact O-CE 3.3Å; T777-K794 WeakPolarHBondContact O-CE 3.47Å; L778-K794 HydrophobicContact CG-CG 4.46Å; K794-N796 VanDerWaalsContact C-N 3.28Å; K794-N796 PolarHBondContact O-N 3.19Å; K794-N796 VanDerWaalsContact O-N 3.12Å; K794-T797 PolarHBondContact N-OG1 3Å; K794-T797 PolarHBondContact O-N 3.25Å; K794-T797 PolarHBondContact O-OG1 3.04Å; K794-T797 VanDerWaalsContact O-OG1 3.09Å; K794-N813 PolarHBondContact NZ-O 3.07Å; K794-Q814 PolarHBondContact NZ-O 3.17Å; K794-N816 PolarHBondContact NZ-O 3.25Å; K794-F818 WeakPolarHBondContact CB-O 3.35Å; K794-G819 VanDerWaalsContact CD-CA 3.42Å
795	L	82.1	Confident	82.5	Confident	111 Å²	111	54.4 Å²	54.4	58%	0.581	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-36.9	-167.9	-166.3	69.8	0	0	0	114.8	K806 F818	L795-K806 WeakPolarHBondContact O-CE 3.32Å; L795-K806 PolarHBondContact O-NZ 3.21Å; L795-F818 HydrophobicContact CB-CB 4.27Å; L795-F818 HydrophobicContact CB-CD1 4Å; L795-F818 HydrophobicContact CD2-CD1 3.67Å; L795-F818 HydrophobicContact CD2-CE1 4.13Å; L795-F818 HydrophobicContact CG-CD1 4.5Å; L795-F818 PolarHBondContact N-O 2.73Å
796	N	85.4	Confident	82.6	Confident	21 Å²	21	55.2 Å²	55.2	11%	0.112	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	8.9	-173.4	-55.2	-8.4	0	0	0	113.2	K794 K806 F809 F818 C820	K794-N796 VanDerWaalsContact C-N 3.28Å; K794-N796 PolarHBondContact O-N 3.19Å; K794-N796 VanDerWaalsContact O-N 3.12Å; N796-K806 PolarHBondContact O-N 3.23Å; N796-F809 HydrophobicContact CB-CB 4.5Å; N796-F809 HydrophobicContact CB-CD1 3.66Å; N796-F809 HydrophobicContact CB-CD2 4.48Å; N796-F809 HydrophobicContact CB-CE1 3.97Å; N796-F809 HydrophobicContact CB-CG 3.97Å; N796-F809 HydrophobicContact CB-CZ 4.49Å; N796-F809 VanDerWaalsContact CG-CE1 3.41Å; N796-F809 WeakPolarHBondContact ND2-CD1 3.32Å; N796-F809 WeakPolarHBondContact ND2-CE1 3.03Å; N796-F818 WeakPolarHBondContact CA-O 3.25Å; N796-F818 HydrophobicContact CB-CB 4.45Å; N796-F818 VanDerWaalsContact CB-O 3.28Å; N796-F818 WeakPolarHBondContact CB-O 3.03Å; N796-F818 PolarHBondContact N-O 3.03Å; N796-F818 VanDerWaalsContact ND2-CB 3.34Å; N796-F818 WeakPolarHBondContact ND2-CB 3.29Å; N796-C820 HydrophobicContact CB-CB 4.09Å; N796-C820 PolarHBondContact ND2-O 3.12Å
797	T	82.4	Confident	82.5	Confident	4 Å²	4	54 Å²	54	3%	0.025	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	157.3	176	50.4	0	0	0	0	112.4	G776 C793 K794 Q804 K806 M812	G776-T797 PolarHBondContact O-OG1 3.31Å; C793-T797 WeakPolarHBondContact CB-OG1 3.37Å; K794-T797 PolarHBondContact N-OG1 3Å; K794-T797 PolarHBondContact O-N 3.25Å; K794-T797 PolarHBondContact O-OG1 3.04Å; K794-T797 VanDerWaalsContact O-OG1 3.09Å; T797-Q804 CarbonylContact C-O 3.49Å; T797-Q804 VanDerWaalsContact CA-O 3.25Å; T797-Q804 WeakPolarHBondContact CA-O 3.47Å; T797-Q804 WeakPolarHBondContact CB-O 3.32Å; T797-K806 VanDerWaalsContact O-CE 3.31Å; T797-K806 WeakPolarHBondContact O-CE 3.4Å; T797-M812 HydrophobicContact CG2-CE 3.57Å; T797-M812 HydrophobicContact CG2-CG 4.11Å; T797-M812 HydrophobicContact CG2-SD 3.72Å
798	L	79.9	Confident	82.6	Confident	70 Å²	70	47.7 Å²	47.7	37%	0.366	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	168.8	-179.1	111.2	100.8	0	0	0	110.2	C802 Q804 C805 K806	L798-C802 CarbonylContact O-C 3.47Å; L798-C802 WeakPolarHBondContact O-CA 3.41Å; L798-Q804 HydrophobicContact CD2-CB 4.35Å; L798-Q804 HydrophobicContact CG-CB 4.17Å; L798-Q804 PolarHBondContact N-O 2.98Å; L798-Q804 PolarHBondContact O-N 2.75Å; L798-C805 WeakPolarHBondContact CD2-O 3.39Å; L798-K806 HydrophobicContact CB-CG 3.94Å
799	G	73.5	Confident	82.9	Confident	21 Å²	21	47.1 Å²	47.1	22%	0.216	25%	0.25	C	S	.	.	S	Bend	trans	98.6	155.9	178.2	0	0	0	0	0	112	Q790 D801 C802	Q790-G799 PolarHBondContact NE2-O 2.68Å; Q790-G799 VanDerWaalsContact NE2-O 3.09Å; G799-D801 PolarHBondContact O-N 2.04Å; G799-C802 PolarHBondContact O-N 2.55Å
800	R	85.4	Confident	83.2	Confident	62 Å²	62	48.4 Å²	48.4	23%	0.234	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-38.5	-179	-167.5	-160.3	59.5	63.3	-3.9	112	W757 C770 G789 Q790 C791	W757-R800 VanDerWaalsContact CH2-CD 3.45Å; C770-R800 PolarHBondContact O-NH1 3.33Å; C770-R800 PolarHBondContact O-NH2 3.44Å; G789-R800 WeakPolarHBondContact O-CG 3.46Å; G789-R800 PolarHBondContact O-NH1 2.68Å; Q790-R800 PolarHBondContact NE2-O 2.97Å; C791-R800 WeakPolarHBondContact CB-O 3.49Å; C791-R800 PolarHBondContact N-O 2.62Å; C791-R800 PolarHBondContact SG-O 3.12Å; C791-R800 VanDerWaalsContact SG-O 3.41Å
801	D	86.8	Confident	82.8	Confident	42 Å²	42	46.1 Å²	46.1	23%	0.225	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	1.1	-179.1	63.9	-4.6	0	0	0	114	Y773 G799 S803	Y773-D801 WeakPolarHBondContact CB-O 3.45Å; Y773-D801 PolarHBondContact N-O 2.85Å; G799-D801 PolarHBondContact O-N 2.04Å; D801-S803 VanDerWaalsContact CG-CB 3.48Å; D801-S803 PolarHBondContact O-N 3.21Å; D801-S803 VanDerWaalsContact OD1-CB 3.22Å; D801-S803 WeakPolarHBondContact OD1-CB 3.21Å; D801-S803 PolarHBondContact OD1-N 3.01Å; D801-S803 PolarHBondContact OD1-OG 3.26Å; D801-S803 WeakPolarHBondContact OD2-CB 3.31Å; D801-S803 PolarHBondContact OD2-OG 2.74Å
802	C	88.7	Confident	82.3	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.257	C	S	.	.	S	Bend	trans	58.4	24.8	-172.1	-43.8	0	0	0	0	115	T777 C791 C793 L798 G799 Q804 M812	T777-C802 HydrophobicContact CG2-CB 4.18Å; C791-C802 VanDerWaalsContact CB-SG 3.56Å; C793-C802 WeakPolarHBondContact CA-SG 3.3Å; C793-C802 HydrophobicContact CB-CB 3.84Å; C793-C802 WeakPolarHBondContact CB-SG 3.31Å; C793-C802 PolarHBondContact N-SG 3.24Å; C793-C802 VanDerWaalsContact N-SG 3.37Å; C793-C802 VanDerWaalsContact SG-CA 3.56Å; C793-C802 WeakPolarHBondContact SG-CB 3.44Å; C793-C802 CovalentContact SG-SG 2.04Å; C793-C802 PolarHBondContact SG-SG 2.8Å; L798-C802 CarbonylContact O-C 3.47Å; L798-C802 WeakPolarHBondContact O-CA 3.41Å; G799-C802 PolarHBondContact O-N 2.55Å; C802-Q804 VanDerWaalsContact C-N 3.32Å; C802-Q804 PolarHBondContact O-N 3.24Å; C802-M812 WeakPolarHBondContact O-CE 3.48Å
803	S	84.7	Confident	81.8	Confident	45 Å²	45	44.8 Å²	44.8	32%	0.315	25%	0.246	S	C	.	.			trans	-79.3	-6.7	-178	65	0	0	0	0	115.2	D801 M812	D801-S803 VanDerWaalsContact CG-CB 3.48Å; D801-S803 PolarHBondContact O-N 3.21Å; D801-S803 VanDerWaalsContact OD1-CB 3.22Å; D801-S803 WeakPolarHBondContact OD1-CB 3.21Å; D801-S803 PolarHBondContact OD1-N 3.01Å; D801-S803 PolarHBondContact OD1-OG 3.26Å; D801-S803 WeakPolarHBondContact OD2-CB 3.31Å; D801-S803 PolarHBondContact OD2-OG 2.74Å; S803-M812 WeakPolarHBondContact O-CE 3.3Å
804	Q	85.2	Confident	81	Confident	98 Å²	98	48 Å²	48	46%	0.458	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	150.4	-174.2	-58.8	179.7	11.2	0	0	112.1	T797 L798 C802 M812	T797-Q804 CarbonylContact C-O 3.49Å; T797-Q804 VanDerWaalsContact CA-O 3.25Å; T797-Q804 WeakPolarHBondContact CA-O 3.47Å; T797-Q804 WeakPolarHBondContact CB-O 3.32Å; L798-Q804 HydrophobicContact CD2-CB 4.35Å; L798-Q804 HydrophobicContact CG-CB 4.17Å; L798-Q804 PolarHBondContact N-O 2.98Å; L798-Q804 PolarHBondContact O-N 2.75Å; C802-Q804 VanDerWaalsContact C-N 3.32Å; C802-Q804 PolarHBondContact O-N 3.24Å; Q804-M812 VanDerWaalsContact C-CE 3.42Å; Q804-M812 WeakPolarHBondContact O-CE 3.41Å
805	C	84.9	Confident	80.6	Confident	6 Å²	6	52.2 Å²	52.2	4%	0.041	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	143.8	166.8	-61	0	0	0	0	110	L798 F809 Y810 C820	L798-C805 WeakPolarHBondContact CD2-O 3.39Å; C805-F809 HydrophobicContact CB-CB 4.02Å; C805-F809 WeakPolarHBondContact CB-O 3.35Å; C805-Y810 VanDerWaalsContact SG-C 3.57Å; C805-C820 WeakPolarHBondContact CA-SG 3.2Å; C805-C820 HydrophobicContact CB-CB 3.62Å; C805-C820 WeakPolarHBondContact CB-SG 3.34Å; C805-C820 WeakPolarHBondContact SG-CB 3Å; C805-C820 CovalentContact SG-SG 2.03Å; C805-C820 PolarHBondContact SG-SG 2.83Å
806	K	82.3	Confident	80	Confident	85 Å²	85	48 Å²	48	37%	0.37	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-57.5	154.5	173.4	-75.4	-179.4	179.7	173.7	0	111.4	L795 N796 T797 L798 G808 F809	L795-K806 WeakPolarHBondContact O-CE 3.32Å; L795-K806 PolarHBondContact O-NZ 3.21Å; N796-K806 PolarHBondContact O-N 3.23Å; T797-K806 VanDerWaalsContact O-CE 3.31Å; T797-K806 WeakPolarHBondContact O-CE 3.4Å; L798-K806 HydrophobicContact CB-CG 3.94Å; K806-G808 PolarHBondContact O-N 3.47Å; K806-F809 HydrophobicContact CB-CD2 3.75Å; K806-F809 HydrophobicContact CB-CE2 4.34Å; K806-F809 WeakPolarHBondContact O-CA 3.49Å; K806-F809 WeakPolarHBondContact O-CB 3.45Å; K806-F809 PolarHBondContact O-N 3Å
807	P	73.2	Confident	79.3	Confident	96 Å²	96	51.3 Å²	51.3	62%	0.623	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	133.8	169.2	-25.1	34.6	0	0	0	110.6	F809	P807-F809 WeakPolarHBondContact O-CD2 3.01Å
808	G	74.2	Confident	79.1	Confident	19 Å²	19	56.3 Å²	56.3	20%	0.196	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.6	10.6	-170.5	0	0	0	0	0	115	K806 P822 C823	K806-G808 PolarHBondContact O-N 3.47Å; G808-P822 CarbonylContact O-C 3.57Å; G808-P822 WeakPolarHBondContact O-CA 3.41Å; G808-C823 PolarHBondContact O-N 2.68Å
809	F	86.3	Confident	79.2	Confident	52 Å²	52	53 Å²	53	23%	0.228	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	151.9	175.1	-59.6	-95.5	0	0	0	113	N796 C805 K806 P807 C820 E821 P822 C823	N796-F809 HydrophobicContact CB-CB 4.5Å; N796-F809 HydrophobicContact CB-CD1 3.66Å; N796-F809 HydrophobicContact CB-CD2 4.48Å; N796-F809 HydrophobicContact CB-CE1 3.97Å; N796-F809 HydrophobicContact CB-CG 3.97Å; N796-F809 HydrophobicContact CB-CZ 4.49Å; N796-F809 VanDerWaalsContact CG-CE1 3.41Å; N796-F809 WeakPolarHBondContact ND2-CD1 3.32Å; N796-F809 WeakPolarHBondContact ND2-CE1 3.03Å; C805-F809 HydrophobicContact CB-CB 4.02Å; C805-F809 WeakPolarHBondContact CB-O 3.35Å; K806-F809 HydrophobicContact CB-CD2 3.75Å; K806-F809 HydrophobicContact CB-CE2 4.34Å; K806-F809 WeakPolarHBondContact O-CA 3.49Å; K806-F809 WeakPolarHBondContact O-CB 3.45Å; K806-F809 PolarHBondContact O-N 3Å; P807-F809 WeakPolarHBondContact O-CD2 3.01Å; F809-C820 HydrophobicContact CB-CB 3.82Å; F809-E821 CarbonylContact C-O 3.48Å; F809-E821 WeakPolarHBondContact CA-O 3.08Å; F809-E821 WeakPolarHBondContact CB-O 3.37Å; F809-P822 HydrophobicContact CD1-CB 4.15Å; F809-P822 HydrophobicContact CE1-CB 4.04Å; F809-C823 PolarHBondContact N-SG 3.41Å; F809-C823 VanDerWaalsContact N-SG 3.43Å
810	Y	86.5	Confident	79.8	Confident	28 Å²	28	52 Å²	52	11%	0.11	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	-178.9	-177	83.9	-63.9	0	0	0	112.2	C805 C820 E821 P822 R851	C805-Y810 VanDerWaalsContact SG-C 3.57Å; Y810-C820 WeakPolarHBondContact O-CA 3.48Å; Y810-C820 VanDerWaalsContact O-CB 3.31Å; Y810-C820 WeakPolarHBondContact O-CB 3.03Å; Y810-E821 HydrophobicContact CD1-CB 4.05Å; Y810-E821 WeakPolarHBondContact CD1-O 3.21Å; Y810-E821 HydrophobicContact CE1-CB 3.51Å; Y810-E821 PolarHBondContact N-O 3.43Å; Y810-E821 PolarHBondContact O-N 3.37Å; Y810-E821 PolarHBondContact OH-OE2 2.94Å; Y810-P822 WeakPolarHBondContact CD1-O 3.21Å; Y810-P822 VanDerWaalsContact CE1-O 3.23Å; Y810-P822 WeakPolarHBondContact CE1-O 3.32Å; Y810-R851 VanDerWaalsContact CZ-NH2 3.26Å; Y810-R851 PolarHBondContact OH-NH2 3.34Å
811	A	77	Confident	79.7	Confident	34 Å²	34	52.7 Å²	52.7	28%	0.281	29%	0.29	S	S	.	.			trans	49.1	69	171.6	0	0	0	0	0	113.9	N813	A811-N813 PolarHBondContact O-N 2.8Å
812	M	77.6	Confident	79.4	Confident	33 Å²	33	54.6 Å²	54.6	16%	0.163	31%	0.305	C	S	.	.			trans	-61.2	126.7	176	-159.3	177	-50.8	0	0	111	Y773 G776 T797 C802 S803 Q804 G819	Y773-M812 HydrophobicContact CD1-CE 4.39Å; Y773-M812 HydrophobicContact CD1-SD 3.43Å; Y773-M812 WeakPolarHBondContact CD1-SD 3.2Å; Y773-M812 HydrophobicContact CE1-CG 4.43Å; Y773-M812 HydrophobicContact CE1-SD 3.52Å; Y773-M812 VanDerWaalsContact CE1-SD 3.52Å; G776-M812 VanDerWaalsContact CA-SD 3.51Å; T797-M812 HydrophobicContact CG2-CE 3.57Å; T797-M812 HydrophobicContact CG2-CG 4.11Å; T797-M812 HydrophobicContact CG2-SD 3.72Å; C802-M812 WeakPolarHBondContact O-CE 3.48Å; S803-M812 WeakPolarHBondContact O-CE 3.3Å; Q804-M812 VanDerWaalsContact C-CE 3.42Å; Q804-M812 WeakPolarHBondContact O-CE 3.41Å; M812-G819 CarbonylContact C-O 3.23Å; M812-G819 WeakPolarHBondContact CA-O 3.3Å
813	N	74.4	Confident	78.9	Confident	62 Å²	62	55.6 Å²	55.6	33%	0.332	31%	0.312	S	S	.	.			trans	-134.2	124.1	-171.7	-179.7	-9.9	0	0	0	109.7	K794 A811 S815 N816 G819	K794-N813 PolarHBondContact NZ-O 3.07Å; A811-N813 PolarHBondContact O-N 2.8Å; N813-S815 PolarHBondContact O-N 3.17Å; N813-S815 VanDerWaalsContact OD1-CB 3.26Å; N813-S815 WeakPolarHBondContact OD1-CB 2.98Å; N813-S815 PolarHBondContact OD1-N 3Å; N813-S815 PolarHBondContact OD1-OG 2.83Å; N813-N816 HydrophobicContact CB-CB 3.91Å; N813-N816 WeakPolarHBondContact O-CB 3.32Å; N813-N816 PolarHBondContact O-N 3.41Å; N813-G819 PolarHBondContact N-O 3.31Å
814	Q	69.5	Low	78.6	Confident	101 Å²	101	56.8 Å²	56.8	47%	0.472	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-34.3	179.6	-165.4	163.5	15.1	0	0	112.4	Q775 K794	Q775-Q814 HydrophobicContact CB-CB 4.01Å; Q775-Q814 HydrophobicContact CB-CG 4.4Å; Q775-Q814 HydrophobicContact CG-CB 3.9Å; Q775-Q814 HydrophobicContact CG-CG 4.24Å; K794-Q814 PolarHBondContact NZ-O 3.17Å
815	S	72.8	Confident	78.2	Confident	106 Å²	106	52.7 Å²	52.7	74%	0.741	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-22.4	178.4	-44.9	0	0	0	0	113.9	N813 P817	N813-S815 PolarHBondContact O-N 3.17Å; N813-S815 VanDerWaalsContact OD1-CB 3.26Å; N813-S815 WeakPolarHBondContact OD1-CB 2.98Å; N813-S815 PolarHBondContact OD1-N 3Å; N813-S815 PolarHBondContact OD1-OG 2.83Å; S815-P817 WeakPolarHBondContact O-CD 3.04Å
816	N	69.7	Low	77.7	Confident	23 Å²	23	54.1 Å²	54.1	12%	0.123	30%	0.304	C	S	.	.			trans	-76.6	120.4	-179.7	178.7	-12.9	0	0	0	108.9	K794 N813 F818 G819 C820	K794-N816 PolarHBondContact NZ-O 3.25Å; N813-N816 HydrophobicContact CB-CB 3.91Å; N813-N816 WeakPolarHBondContact O-CB 3.32Å; N813-N816 PolarHBondContact O-N 3.41Å; N816-F818 PolarHBondContact O-N 2.8Å; N816-F818 WeakPolarHBondContact OD1-CA 3.42Å; N816-F818 WeakPolarHBondContact OD1-CB 3.04Å; N816-F818 PolarHBondContact OD1-N 2.88Å; N816-G819 PolarHBondContact O-N 2.78Å; N816-G819 PolarHBondContact OD1-N 3.07Å; N816-C820 PolarHBondContact ND2-O 2.86Å; N816-C820 VanDerWaalsContact ND2-O 3.11Å
817	P	70.7	Confident	76.7	Confident	91 Å²	91	53.4 Å²	53.4	59%	0.591	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-25.9	-179.8	27.1	-34.4	0	0	0	112.8	S815	S815-P817 WeakPolarHBondContact O-CD 3.04Å
818	F	78.4	Confident	76.2	Confident	108 Å²	108	49 Å²	49	47%	0.474	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-10	175	-47.5	-70.4	0	0	0	112.8	K794 L795 N796 N816 C820	K794-F818 WeakPolarHBondContact CB-O 3.35Å; L795-F818 HydrophobicContact CB-CB 4.27Å; L795-F818 HydrophobicContact CB-CD1 4Å; L795-F818 HydrophobicContact CD2-CD1 3.67Å; L795-F818 HydrophobicContact CD2-CE1 4.13Å; L795-F818 HydrophobicContact CG-CD1 4.5Å; L795-F818 PolarHBondContact N-O 2.73Å; N796-F818 WeakPolarHBondContact CA-O 3.25Å; N796-F818 HydrophobicContact CB-CB 4.45Å; N796-F818 VanDerWaalsContact CB-O 3.28Å; N796-F818 WeakPolarHBondContact CB-O 3.03Å; N796-F818 PolarHBondContact N-O 3.03Å; N796-F818 VanDerWaalsContact ND2-CB 3.34Å; N796-F818 WeakPolarHBondContact ND2-CB 3.29Å; N816-F818 PolarHBondContact O-N 2.8Å; N816-F818 WeakPolarHBondContact OD1-CA 3.42Å; N816-F818 WeakPolarHBondContact OD1-CB 3.04Å; N816-F818 PolarHBondContact OD1-N 2.88Å; F818-C820 PolarHBondContact O-N 3.38Å
819	G	81.2	Confident	75.8	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.273	C	S	.	.	S	Bend	trans	93.2	-57.7	174.3	0	0	0	0	0	113.7	K794 M812 N813 N816	K794-G819 VanDerWaalsContact CD-CA 3.42Å; M812-G819 CarbonylContact C-O 3.23Å; M812-G819 WeakPolarHBondContact CA-O 3.3Å; N813-G819 PolarHBondContact N-O 3.31Å; N816-G819 PolarHBondContact O-N 2.78Å; N816-G819 PolarHBondContact OD1-N 3.07Å
820	C	86.5	Confident	75.2	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.263	C	S	.	.	S	Bend	trans	-118.6	152.1	178.1	-63	0	0	0	0	112	N796 C805 F809 Y810 N816 F818	N796-C820 HydrophobicContact CB-CB 4.09Å; N796-C820 PolarHBondContact ND2-O 3.12Å; C805-C820 WeakPolarHBondContact CA-SG 3.2Å; C805-C820 HydrophobicContact CB-CB 3.62Å; C805-C820 WeakPolarHBondContact CB-SG 3.34Å; C805-C820 WeakPolarHBondContact SG-CB 3Å; C805-C820 CovalentContact SG-SG 2.03Å; C805-C820 PolarHBondContact SG-SG 2.83Å; F809-C820 HydrophobicContact CB-CB 3.82Å; Y810-C820 WeakPolarHBondContact O-CA 3.48Å; Y810-C820 VanDerWaalsContact O-CB 3.31Å; Y810-C820 WeakPolarHBondContact O-CB 3.03Å; N816-C820 PolarHBondContact ND2-O 2.86Å; N816-C820 VanDerWaalsContact ND2-O 3.11Å; F818-C820 PolarHBondContact O-N 3.38Å
821	E	82.6	Confident	74.3	Confident	77 Å²	77	49.9 Å²	49.9	36%	0.36	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	149.6	173.4	-70.2	-178.2	-173.9	0	0	110.6	F809 Y810	F809-E821 CarbonylContact C-O 3.48Å; F809-E821 WeakPolarHBondContact CA-O 3.08Å; F809-E821 WeakPolarHBondContact CB-O 3.37Å; Y810-E821 HydrophobicContact CD1-CB 4.05Å; Y810-E821 WeakPolarHBondContact CD1-O 3.21Å; Y810-E821 HydrophobicContact CE1-CB 3.51Å; Y810-E821 PolarHBondContact N-O 3.43Å; Y810-E821 PolarHBondContact O-N 3.37Å; Y810-E821 PolarHBondContact OH-OE2 2.94Å
822	P	80	Confident	73.8	Confident	83 Å²	83	50.3 Å²	50.3	54%	0.539	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	146.8	175.1	28.4	-34.7	0	0	0	111.5	G808 F809 Y810	G808-P822 CarbonylContact O-C 3.57Å; G808-P822 WeakPolarHBondContact O-CA 3.41Å; F809-P822 HydrophobicContact CD1-CB 4.15Å; F809-P822 HydrophobicContact CE1-CB 4.04Å; Y810-P822 WeakPolarHBondContact CD1-O 3.21Å; Y810-P822 VanDerWaalsContact CE1-O 3.23Å; Y810-P822 WeakPolarHBondContact CE1-O 3.32Å
823	C	79.1	Confident	73.4	Confident	20 Å²	20	54.7 Å²	54.7	14%	0.135	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-59.8	137.2	171.4	-71.9	0	0	0	0	110.4	G808 F809 H833 C835	G808-C823 PolarHBondContact O-N 2.68Å; F809-C823 PolarHBondContact N-SG 3.41Å; F809-C823 VanDerWaalsContact N-SG 3.43Å; C823-H833 WeakPolarHBondContact CB-O 3.4Å; C823-C835 HydrophobicContact CB-CB 3.85Å; C823-C835 WeakPolarHBondContact CB-SG 3.38Å; C823-C835 WeakPolarHBondContact SG-CB 3.34Å; C823-C835 PolarHBondContact SG-N 2.85Å; C823-C835 CovalentContact SG-SG 2.03Å; C823-C835 PolarHBondContact SG-SG 2.98Å
824	D	78.5	Confident	73.3	Confident	70 Å²	70	55.8 Å²	55.8	37%	0.374	31%	0.305	S	S	.	.			trans	-118.1	61.9	-173.4	-165.2	-20.8	0	0	0	107.9	R852	D824-R852 WeakPolarHBondContact O-CB 3.44Å; D824-R852 WeakPolarHBondContact O-CG 3.5Å; D824-R852 IonicContact OD1-CZ 2.69Å; D824-R852 IonicContact OD1-NH1 3.69Å; D824-R852 PolarHBondContact OD1-NH1 3.02Å; D824-R852 IonicContact OD2-CZ 3.15Å; D824-R852 IonicContact OD2-NE 2.93Å; D824-R852 IonicContact OD2-NH1 2.67Å; D824-R852 PolarHBondContact OD2-NH1 2.81Å; D824-R852 IonicContact OD2-NH2 3.31Å; D824-R852 PolarHBondContact OD2-NH2 3Å
825	C	76.8	Confident	74	Confident	13 Å²	13	51.3 Å²	51.3	9%	0.088	29%	0.285	C	S	.	.			trans	-95.5	130.7	-175.5	-54.2	0	0	0	0	110.5	S827 C842	C825-S827 PolarHBondContact O-N 3.2Å; C825-C842 WeakPolarHBondContact CA-SG 3.3Å; C825-C842 HydrophobicContact CB-CB 3.7Å; C825-C842 WeakPolarHBondContact CB-SG 3.03Å; C825-C842 WeakPolarHBondContact SG-CB 3.4Å; C825-C842 CovalentContact SG-SG 2.03Å; C825-C842 PolarHBondContact SG-SG 3.25Å
826	D	73.8	Confident	74.3	Confident	35 Å²	35	51.2 Å²	51.2	19%	0.187	27%	0.272	C	S	.	.			trans	-76.4	125.9	177.3	-160.3	-63.9	0	0	0	110.5	G828 G829 S830 R852 F1172 S1173	D826-G828 VanDerWaalsContact C-N 3.3Å; D826-G828 PolarHBondContact O-N 3.41Å; D826-G828 PolarHBondContact OD1-N 2.03Å; D826-G829 PolarHBondContact O-N 3.38Å; D826-S830 WeakPolarHBondContact O-CB 3.33Å; D826-S830 PolarHBondContact O-N 2.93Å; D826-S830 PolarHBondContact O-OG 2.89Å; D826-R852 PolarHBondContact N-O 2.98Å; D826-F1172 HydrophobicContact CB-CE1 3.93Å; D826-F1172 VanDerWaalsContact CG-CE1 3.47Å; D826-F1172 WeakPolarHBondContact OD1-CE1 3.4Å; D826-S1173 PolarHBondContact OD1-OG 3.36Å
827	S	61.6	Low	74.3	Confident	71 Å²	71	52.6 Å²	52.6	50%	0.497	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-36.6	-169.9	-47.8	0	0	0	0	113.5	C825	C825-S827 PolarHBondContact O-N 3.2Å
828	G	62.6	Low	74.5	Confident	4 Å²	4	58.9 Å²	58.9	4%	0.041	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-26.3	-179.3	0	0	0	0	0	113.6	D826 K845 S1173 V1176	D826-G828 VanDerWaalsContact C-N 3.3Å; D826-G828 PolarHBondContact O-N 3.41Å; D826-G828 PolarHBondContact OD1-N 2.03Å; G828-K845 WeakPolarHBondContact O-CD 3Å; G828-K845 VanDerWaalsContact O-CE 3.29Å; G828-K845 WeakPolarHBondContact O-CE 3.18Å; G828-K845 PolarHBondContact O-NZ 3Å; G828-S1173 WeakPolarHBondContact CA-OG 3Å; G828-S1173 PolarHBondContact N-OG 2.92Å; G828-S1173 VanDerWaalsContact N-OG 3.08Å; G828-V1176 WeakPolarHBondContact O-CG1 3.47Å
829	G	67.1	Low	74.6	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-18	-176.2	0	0	0	0	0	116	D826 K845 C853	D826-G829 PolarHBondContact O-N 3.38Å; G829-K845 PolarHBondContact O-N 3.09Å; G829-C853 WeakPolarHBondContact CA-O 3.41Å; G829-C853 VanDerWaalsContact O-CB 3.3Å; G829-C853 WeakPolarHBondContact O-CB 3.36Å
830	S	72.5	Confident	74.7	Confident	2 Å²	2	57.2 Å²	57.2	1%	0.014	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	162.4	179.9	63.5	0	0	0	0	112.4	D826 S832 H843	D826-S830 WeakPolarHBondContact O-CB 3.33Å; D826-S830 PolarHBondContact O-N 2.93Å; D826-S830 PolarHBondContact O-OG 2.89Å; S830-S832 PolarHBondContact OG-O 2.04Å; S830-H843 CarbonylContact C-O 3.48Å; S830-H843 WeakPolarHBondContact CA-O 3.06Å; S830-H843 WeakPolarHBondContact CB-O 3.32Å
831	Y	67.8	Low	74.7	Confident	115 Å²	115	60.6 Å²	60.6	45%	0.451	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	-14.9	174	-75.9	-78.4	0	0	0	113.5	H843 C844 P846 Y1020	Y831-H843 HydrophobicContact CD2-CB 4.37Å; Y831-H843 PolarHBondContact N-O 2.93Å; Y831-C844 WeakPolarHBondContact CE2-O 3.35Å; Y831-P846 WeakPolarHBondContact OH-CD 3.44Å; Y831-Y1020 VanDerWaalsContact CA-OH 3.24Å; Y831-Y1020 WeakPolarHBondContact CA-OH 3.43Å; Y831-Y1020 WeakPolarHBondContact CD1-OH 3.15Å; Y831-Y1020 WeakPolarHBondContact O-CE1 3.14Å; Y831-Y1020 VanDerWaalsContact O-CZ 3.3Å; Y831-Y1020 PolarHBondContact O-OH 2.6Å; Y831-Y1020 VanDerWaalsContact O-OH 3.11Å
832	S	66.5	Low	74.8	Confident	42 Å²	42	57 Å²	57	29%	0.294	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.7	172.3	172.1	65.5	0	0	0	0	110.7	S830 I834	S830-S832 PolarHBondContact OG-O 2.04Å; S832-I834 PolarHBondContact O-N 3.42Å; S832-I834 VanDerWaalsContact O-N 3.16Å; S832-I834 WeakPolarHBondContact OG-CB 3.33Å; S832-I834 PolarHBondContact OG-N 3.39Å; S832-I834 VanDerWaalsContact OG-N 3.12Å
833	H	69.6	Low	74.9	Confident	125 Å²	125	58.1 Å²	58.1	58%	0.579	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71	4.9	168.2	-49.9	-57.9	0	0	0	114	C823	C823-H833 WeakPolarHBondContact CB-O 3.4Å
834	I	73.1	Confident	75.1	Confident	85 Å²	85	58.7 Å²	58.7	44%	0.436	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	133.5	176.4	-52.8	175	0	0	0	109	S832	S832-I834 PolarHBondContact O-N 3.42Å; S832-I834 VanDerWaalsContact O-N 3.16Å; S832-I834 WeakPolarHBondContact OG-CB 3.33Å; S832-I834 PolarHBondContact OG-N 3.39Å; S832-I834 VanDerWaalsContact OG-N 3.12Å
835	C	82.9	Confident	74.9	Confident	8 Å²	8	56 Å²	56	5%	0.054	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	159.1	179.7	73.2	0	0	0	0	112	C823 S837 Q841 C842	C823-C835 HydrophobicContact CB-CB 3.85Å; C823-C835 WeakPolarHBondContact CB-SG 3.38Å; C823-C835 WeakPolarHBondContact SG-CB 3.34Å; C823-C835 PolarHBondContact SG-N 2.85Å; C823-C835 CovalentContact SG-SG 2.03Å; C823-C835 PolarHBondContact SG-SG 2.98Å; C835-S837 PolarHBondContact O-N 2.03Å; C835-Q841 CarbonylContact C-O 3.57Å; C835-Q841 WeakPolarHBondContact CA-O 3.42Å; C835-Q841 WeakPolarHBondContact CB-O 3.15Å; C835-C842 HydrophobicContact CB-CB 4.33Å
836	E	78.9	Confident	74.7	Confident	104 Å²	104	58.4 Å²	58.4	49%	0.486	30%	0.296	S	S	.	.			trans	-60.5	117.1	179.6	-178.6	-178.4	-134.7	0	0	110.8	R838 T839 G840 Q841	E836-R838 PolarHBondContact O-N 3.38Å; E836-T839 PolarHBondContact O-N 3.43Å; E836-T839 WeakPolarHBondContact OE2-CB 3.31Å; E836-T839 WeakPolarHBondContact OE2-CG2 3.21Å; E836-T839 PolarHBondContact OE2-OG1 2.72Å; E836-G840 WeakPolarHBondContact O-CA 3.4Å; E836-G840 PolarHBondContact O-N 2.64Å; E836-Q841 HydrophobicContact CB-CB 4.27Å; E836-Q841 PolarHBondContact N-O 2.96Å
837	S	70.5	Confident	74.9	Confident	52 Å²	52	63 Å²	63	36%	0.364	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-10.4	-163.3	56.3	0	0	0	0	116.1	C835	C835-S837 PolarHBondContact O-N 2.03Å
838	R	74.2	Confident	75.8	Confident	222 Å²	222	60.1 Å²	60.1	84%	0.838	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	-51.4	171.9	-74.6	-173	173.9	-171.3	0.5	113.5	E836	E836-R838 PolarHBondContact O-N 3.38Å
839	T	81.2	Confident	76.4	Confident	74 Å²	74	60.6 Å²	60.6	45%	0.454	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-24.8	-171.4	59.8	0	0	0	0	112.5	E836 Q841 R851	E836-T839 PolarHBondContact O-N 3.43Å; E836-T839 WeakPolarHBondContact OE2-CB 3.31Å; E836-T839 WeakPolarHBondContact OE2-CG2 3.21Å; E836-T839 PolarHBondContact OE2-OG1 2.72Å; T839-Q841 VanDerWaalsContact C-N 3.27Å; T839-Q841 VanDerWaalsContact OG1-CB 3.22Å; T839-Q841 WeakPolarHBondContact OG1-CB 3.07Å; T839-Q841 PolarHBondContact OG1-N 2.03Å; T839-R851 WeakPolarHBondContact O-CD 3.22Å
840	G	82.7	Confident	77.1	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	31%	0.312	C	S	.	.			trans	73.3	16	-165.6	0	0	0	0	0	114	E836 C842 R851	E836-G840 WeakPolarHBondContact O-CA 3.4Å; E836-G840 PolarHBondContact O-N 2.64Å; G840-C842 PolarHBondContact O-N 2.83Å; G840-R851 WeakPolarHBondContact O-CG 3.3Å; G840-R851 PolarHBondContact O-NH1 3Å
841	Q	85.9	Confident	77.6	Confident	70 Å²	70	65.4 Å²	65.4	33%	0.327	32%	0.324	S	S	.	.			trans	-71.7	115.2	178.6	-179.9	57.8	61.3	0	0	110.1	C835 E836 T839 G850	C835-Q841 CarbonylContact C-O 3.57Å; C835-Q841 WeakPolarHBondContact CA-O 3.42Å; C835-Q841 WeakPolarHBondContact CB-O 3.15Å; E836-Q841 HydrophobicContact CB-CB 4.27Å; E836-Q841 PolarHBondContact N-O 2.96Å; T839-Q841 VanDerWaalsContact C-N 3.27Å; T839-Q841 VanDerWaalsContact OG1-CB 3.22Å; T839-Q841 WeakPolarHBondContact OG1-CB 3.07Å; T839-Q841 PolarHBondContact OG1-N 2.03Å; Q841-G850 PolarHBondContact NE2-O 2.78Å
842	C	85.4	Confident	78.4	Confident	3 Å²	3	64.6 Å²	64.6	2%	0.02	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	153.6	174.8	-57.9	0	0	0	0	110.7	C825 C835 G840 C844 R851 C853	C825-C842 WeakPolarHBondContact CA-SG 3.3Å; C825-C842 HydrophobicContact CB-CB 3.7Å; C825-C842 WeakPolarHBondContact CB-SG 3.03Å; C825-C842 WeakPolarHBondContact SG-CB 3.4Å; C825-C842 CovalentContact SG-SG 2.03Å; C825-C842 PolarHBondContact SG-SG 3.25Å; C835-C842 HydrophobicContact CB-CB 4.33Å; G840-C842 PolarHBondContact O-N 2.83Å; C842-C844 PolarHBondContact O-N 2.96Å; C842-C844 PolarHBondContact O-SG 2.73Å; C842-R851 PolarHBondContact N-O 3.36Å; C842-R851 PolarHBondContact SG-O 2.9Å; C842-R851 VanDerWaalsContact SG-O 3.4Å; C842-C853 VanDerWaalsContact C-SG 3.55Å; C842-C853 WeakPolarHBondContact CB-SG 3.02Å; C842-C853 PolarHBondContact O-SG 2.88Å
843	H	82.9	Confident	79.3	Confident	105 Å²	105	62.6 Å²	62.6	49%	0.486	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	109.4	175.1	-65	-84.3	0	0	0	109.4	S830 Y831	S830-H843 CarbonylContact C-O 3.48Å; S830-H843 WeakPolarHBondContact CA-O 3.06Å; S830-H843 WeakPolarHBondContact CB-O 3.32Å; Y831-H843 HydrophobicContact CD2-CB 4.37Å; Y831-H843 PolarHBondContact N-O 2.93Å
844	C	82.6	Confident	79.8	Confident	32 Å²	32	59.4 Å²	59.4	22%	0.216	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	143.3	-170.9	-53.5	0	0	0	0	113.3	Y831 C842 V848 C853	Y831-C844 WeakPolarHBondContact CE2-O 3.35Å; C842-C844 PolarHBondContact O-N 2.96Å; C842-C844 PolarHBondContact O-SG 2.73Å; C844-V848 HydrophobicContact CB-CB 4.25Å; C844-V848 WeakPolarHBondContact CB-O 3.41Å; C844-C853 WeakPolarHBondContact CA-SG 3.48Å; C844-C853 HydrophobicContact CB-CB 3.63Å; C844-C853 WeakPolarHBondContact CB-SG 3.08Å; C844-C853 PolarHBondContact N-SG 2.92Å; C844-C853 WeakPolarHBondContact SG-CA 3.23Å; C844-C853 WeakPolarHBondContact SG-CB 3.39Å; C844-C853 CovalentContact SG-SG 2.03Å; C844-C853 PolarHBondContact SG-SG 3.17Å
845	K	73.9	Confident	80.1	Confident	13 Å²	13	58.9 Å²	58.9	6%	0.057	29%	0.289	C	S	.	.			trans	-62.2	157.5	169.1	-70.1	-174.6	-174.2	170.8	0	111.2	G828 G829 R847 V848 V1176 D1177	G828-K845 WeakPolarHBondContact O-CD 3Å; G828-K845 VanDerWaalsContact O-CE 3.29Å; G828-K845 WeakPolarHBondContact O-CE 3.18Å; G828-K845 PolarHBondContact O-NZ 3Å; G829-K845 PolarHBondContact O-N 3.09Å; K845-R847 PolarHBondContact O-N 3.35Å; K845-V848 HydrophobicContact CB-CG2 4.16Å; K845-V848 VanDerWaalsContact O-CB 3.31Å; K845-V848 WeakPolarHBondContact O-CB 3.31Å; K845-V848 WeakPolarHBondContact O-CG2 3.29Å; K845-V848 PolarHBondContact O-N 3.17Å; K845-V1176 HydrophobicContact CD-CG1 4.41Å; K845-D1177 IonicContact NZ-OD1 2.71Å; K845-D1177 PolarHBondContact NZ-OD1 2.88Å
846	P	74	Confident	80	Confident	65 Å²	65	59.2 Å²	59.2	42%	0.422	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-43.5	129.2	-179.2	-33.6	35.1	0	0	0	114.4	Y831 V848 A1180 G1181 A1182	Y831-P846 WeakPolarHBondContact OH-CD 3.44Å; P846-V848 PolarHBondContact O-N 3.12Å; P846-V848 VanDerWaalsContact O-N 3.1Å; P846-A1180 WeakPolarHBondContact CD-O 3.5Å; P846-G1181 CarbonylContact O-C 3.59Å; P846-G1181 WeakPolarHBondContact O-CA 3.47Å; P846-A1182 PolarHBondContact O-N 2.94Å
847	R	78.2	Confident	80	Confident	131 Å²	131	58 Å²	58	49%	0.494	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.3	6.6	176.3	-27.6	-162.9	-159.4	-160.6	3	115.2	K845 I857 H860 A1182	K845-R847 PolarHBondContact O-N 3.35Å; R847-I857 HydrophobicContact CB-CD1 4.12Å; R847-I857 HydrophobicContact CB-CG1 4.24Å; R847-I857 PolarHBondContact O-N 3.18Å; R847-I857 VanDerWaalsContact O-N 3.15Å; R847-H860 WeakPolarHBondContact CD-CD2 3.14Å; R847-H860 WeakPolarHBondContact CD-NE2 3.38Å; R847-H860 PolarHBondContact NH1-NE2 3.36Å; R847-H860 VanDerWaalsContact NH1-NE2 3.17Å; R847-A1182 HydrophobicContact CB-CB 4.05Å; R847-A1182 VanDerWaalsContact CD-O 3.31Å; R847-A1182 WeakPolarHBondContact CD-O 3.44Å
848	V	79.7	Confident	80.2	Confident	10 Å²	10	63.4 Å²	63.4	6%	0.061	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	147.8	167.9	-167.5	0	0	0	0	109.4	C844 K845 P846 C853 F862 F1172 V1176	C844-V848 HydrophobicContact CB-CB 4.25Å; C844-V848 WeakPolarHBondContact CB-O 3.41Å; K845-V848 HydrophobicContact CB-CG2 4.16Å; K845-V848 VanDerWaalsContact O-CB 3.31Å; K845-V848 WeakPolarHBondContact O-CB 3.31Å; K845-V848 WeakPolarHBondContact O-CG2 3.29Å; K845-V848 PolarHBondContact O-N 3.17Å; P846-V848 PolarHBondContact O-N 3.12Å; P846-V848 VanDerWaalsContact O-N 3.1Å; V848-C853 HydrophobicContact CG1-CB 4.07Å; V848-F862 HydrophobicContact CG1-CE1 4.24Å; V848-F862 HydrophobicContact CG1-CZ 4.25Å; V848-F862 HydrophobicContact CG2-CE1 4.32Å; V848-F1172 HydrophobicContact CG1-CZ 4.33Å; V848-V1176 HydrophobicContact CG2-CG1 3.59Å
849	G	76.1	Confident	80.4	Confident	15 Å²	15	54.7 Å²	54.7	16%	0.155	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	-165.2	-180	0	0	0	0	0	113.6	C853 N854 E855	G849-C853 CarbonylContact O-C 3.6Å; G849-C853 WeakPolarHBondContact O-CA 3.47Å; G849-N854 PolarHBondContact O-N 3.43Å; G849-E855 CarbonylContact C-O 3.58Å; G849-E855 PolarHBondContact N-O 3.03Å; G849-E855 PolarHBondContact O-N 2.9Å; G849-E855 VanDerWaalsContact O-N 3.09Å
850	G	80.3	Confident	80.5	Confident	33 Å²	33	52.6 Å²	52.6	34%	0.34	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.9	162.2	-167.1	0	0	0	0	0	112.3	Q841 R852 C853	Q841-G850 PolarHBondContact NE2-O 2.78Å; G850-R852 PolarHBondContact O-N 3.45Å; G850-R852 VanDerWaalsContact O-N 3.16Å; G850-C853 PolarHBondContact O-N 2.99Å
851	R	83.8	Confident	80.5	Confident	70 Å²	70	52.7 Å²	52.7	26%	0.264	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-37.7	-172.4	-171.5	177.8	78.5	80.9	-17.5	113.5	Y810 T839 G840 C842	Y810-R851 VanDerWaalsContact CZ-NH2 3.26Å; Y810-R851 PolarHBondContact OH-NH2 3.34Å; T839-R851 WeakPolarHBondContact O-CD 3.22Å; G840-R851 WeakPolarHBondContact O-CG 3.3Å; G840-R851 PolarHBondContact O-NH1 3Å; C842-R851 PolarHBondContact N-O 3.36Å; C842-R851 PolarHBondContact SG-O 2.9Å; C842-R851 VanDerWaalsContact SG-O 3.4Å
852	R	84.4	Confident	80.1	Confident	98 Å²	98	49.4 Å²	49.4	37%	0.37	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-0.7	-176.5	-46.8	-175.8	176.4	-136.3	-15	113.5	D824 D826 G850 N854	D824-R852 WeakPolarHBondContact O-CB 3.44Å; D824-R852 WeakPolarHBondContact O-CG 3.5Å; D824-R852 IonicContact OD1-CZ 2.69Å; D824-R852 IonicContact OD1-NH1 3.69Å; D824-R852 PolarHBondContact OD1-NH1 3.02Å; D824-R852 IonicContact OD2-CZ 3.15Å; D824-R852 IonicContact OD2-NE 2.93Å; D824-R852 IonicContact OD2-NH1 2.67Å; D824-R852 PolarHBondContact OD2-NH1 2.81Å; D824-R852 IonicContact OD2-NH2 3.31Å; D824-R852 PolarHBondContact OD2-NH2 3Å; D826-R852 PolarHBondContact N-O 2.98Å; G850-R852 PolarHBondContact O-N 3.45Å; G850-R852 VanDerWaalsContact O-N 3.16Å; R852-N854 HydrophobicContact CB-CB 4.21Å; R852-N854 WeakPolarHBondContact CB-OD1 3.4Å
853	C	85.5	Confident	79.1	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.2	62.1	-166	-50	0	0	0	0	112.1	G829 C842 C844 V848 G849 G850 F1172	G829-C853 WeakPolarHBondContact CA-O 3.41Å; G829-C853 VanDerWaalsContact O-CB 3.3Å; G829-C853 WeakPolarHBondContact O-CB 3.36Å; C842-C853 VanDerWaalsContact C-SG 3.55Å; C842-C853 WeakPolarHBondContact CB-SG 3.02Å; C842-C853 PolarHBondContact O-SG 2.88Å; C844-C853 WeakPolarHBondContact CA-SG 3.48Å; C844-C853 HydrophobicContact CB-CB 3.63Å; C844-C853 WeakPolarHBondContact CB-SG 3.08Å; C844-C853 PolarHBondContact N-SG 2.92Å; C844-C853 WeakPolarHBondContact SG-CA 3.23Å; C844-C853 WeakPolarHBondContact SG-CB 3.39Å; C844-C853 CovalentContact SG-SG 2.03Å; C844-C853 PolarHBondContact SG-SG 3.17Å; V848-C853 HydrophobicContact CG1-CB 4.07Å; G849-C853 CarbonylContact O-C 3.6Å; G849-C853 WeakPolarHBondContact O-CA 3.47Å; G850-C853 PolarHBondContact O-N 2.99Å; C853-F1172 VanDerWaalsContact O-CZ 3.25Å; C853-F1172 WeakPolarHBondContact O-CZ 3.49Å
854	N	79.6	Confident	78.1	Confident	58 Å²	58	45.8 Å²	45.8	31%	0.31	24%	0.236	S	C	.	.			trans	-139.7	9.5	-170	76.1	-68.7	0	0	0	114	G849 R852	G849-N854 PolarHBondContact O-N 3.43Å; R852-N854 HydrophobicContact CB-CB 4.21Å; R852-N854 WeakPolarHBondContact CB-OD1 3.4Å
855	E	80.2	Confident	76.7	Confident	73 Å²	73	46.1 Å²	46.1	34%	0.341	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	147.1	174.6	-49	-155.2	130.5	0	0	109.9	G849 R1199	G849-E855 CarbonylContact C-O 3.58Å; G849-E855 PolarHBondContact N-O 3.03Å; G849-E855 PolarHBondContact O-N 2.9Å; G849-E855 VanDerWaalsContact O-N 3.09Å; E855-R1199 IonicContact OE1-CZ 2.75Å; E855-R1199 IonicContact OE1-NH1 3.76Å; E855-R1199 PolarHBondContact OE1-NH1 3.39Å; E855-R1199 IonicContact OE1-NH2 2.63Å; E855-R1199 PolarHBondContact OE1-NH2 2.79Å; E855-R1199 VanDerWaalsContact OE1-NH2 3.17Å; E855-R1199 IonicContact OE2-CZ 2.63Å; E855-R1199 IonicContact OE2-NH1 2.67Å; E855-R1199 IonicContact OE2-NH2 3.35Å; E855-R1199 PolarHBondContact OE2-NH2 2.84Å
856	P	80.5	Confident	75.5	Confident	15 Å²	15	50.4 Å²	50.4	10%	0.097	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	152.6	173.2	33.5	-31.9	0	0	0	109.5	H860 F862 A1182 R1199	P856-H860 HydrophobicContact CB-CB 4.37Å; P856-F862 HydrophobicContact CB-CD1 4.09Å; P856-F862 HydrophobicContact CB-CE1 3.8Å; P856-F862 HydrophobicContact CB-CZ 4.13Å; P856-F862 HydrophobicContact CG-CE1 4.4Å; P856-F862 HydrophobicContact CG-CE2 4.39Å; P856-F862 HydrophobicContact CG-CZ 4.33Å; P856-A1182 HydrophobicContact CB-CB 4.3Å; P856-R1199 HydrophobicContact CG-CB 4.24Å; P856-R1199 HydrophobicContact CG-CG 3.84Å
857	I	79.4	Confident	74.4	Confident	79 Å²	79	49.7 Å²	49.7	41%	0.405	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-69.5	168.8	170.6	66.5	175.8	0	0	0	111.2	R847 H860	R847-I857 HydrophobicContact CB-CD1 4.12Å; R847-I857 HydrophobicContact CB-CG1 4.24Å; R847-I857 PolarHBondContact O-N 3.18Å; R847-I857 VanDerWaalsContact O-N 3.15Å; I857-H860 HydrophobicContact CG1-CB 4.03Å; I857-H860 WeakPolarHBondContact CG1-ND1 3.35Å; I857-H860 WeakPolarHBondContact O-CB 2.98Å; I857-H860 PolarHBondContact O-N 3.32Å
858	E	74.8	Confident	72.7	Confident	165 Å²	165	45.4 Å²	45.4	77%	0.771	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	149.6	177	-71.5	-165	133.1	0	0	112.2	H860	E858-H860 PolarHBondContact O-N 2.83Å; E858-H860 PolarHBondContact O-ND1 2.86Å
859	A	76.4	Confident	70.7	Confident	40 Å²	40	52 Å²	52	33%	0.331	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.9	20.5	-171.4	0	0	0	0	0	115.3	C1185	A859-C1185 VanDerWaalsContact O-CB 3.3Å; A859-C1185 WeakPolarHBondContact O-CB 3.46Å; A859-C1185 PolarHBondContact O-N 2.9Å; A859-C1185 PolarHBondContact O-SG 3.31Å
860	H	83.7	Confident	68.9	Low	30 Å²	30	55.9 Å²	55.9	14%	0.139	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	161.6	176.2	-66.4	78.8	0	0	0	112.7	R847 P856 I857 E858 M1183	R847-H860 WeakPolarHBondContact CD-CD2 3.14Å; R847-H860 WeakPolarHBondContact CD-NE2 3.38Å; R847-H860 PolarHBondContact NH1-NE2 3.36Å; R847-H860 VanDerWaalsContact NH1-NE2 3.17Å; P856-H860 HydrophobicContact CB-CB 4.37Å; I857-H860 HydrophobicContact CG1-CB 4.03Å; I857-H860 WeakPolarHBondContact CG1-ND1 3.35Å; I857-H860 WeakPolarHBondContact O-CB 2.98Å; I857-H860 PolarHBondContact O-N 3.32Å; E858-H860 PolarHBondContact O-N 2.83Å; E858-H860 PolarHBondContact O-ND1 2.86Å; H860-M1183 CarbonylContact C-O 3.44Å; H860-M1183 WeakPolarHBondContact CA-O 3.34Å; H860-M1183 VanDerWaalsContact CB-O 3.3Å; H860-M1183 WeakPolarHBondContact CB-O 3.09Å; H860-M1183 PolarHBondContact CD2-O 2.03Å; H860-M1183 VanDerWaalsContact CD2-O 3.31Å
861	F	84.3	Confident	66.6	Low	1 Å²	1	58.9 Å²	58.9	0%	0.004	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	156.1	-176.7	77.3	-86.6	0	0	0	112.8	P863 H867 A1182 M1183 S1184 E1198 R1199 G1202	F861-P863 HydrophobicContact CE2-CB 4.45Å; F861-H867 AromaticContact CE2-CD2 3.5Å; F861-H867 AromaticContact CE2-NE2 3.4Å; F861-H867 WeakPolarHBondContact CE2-NE2 3.44Å; F861-H867 AromaticContact CZ-CD2 3.9Å; F861-H867 AromaticContact CZ-NE2 3.81Å; F861-A1182 WeakPolarHBondContact O-CB 3.48Å; F861-M1183 HydrophobicContact CD1-CB 4.03Å; F861-M1183 WeakPolarHBondContact CD1-O 3.39Å; F861-M1183 HydrophobicContact CE1-CB 3.49Å; F861-M1183 VanDerWaalsContact CE1-CB 3.49Å; F861-M1183 HydrophobicContact CE2-CB 4.22Å; F861-M1183 HydrophobicContact CE2-SD 4.4Å; F861-M1183 HydrophobicContact CZ-CB 3.6Å; F861-M1183 HydrophobicContact CZ-CG 4.39Å; F861-M1183 HydrophobicContact CZ-SD 4.01Å; F861-M1183 PolarHBondContact N-O 3.32Å; F861-M1183 PolarHBondContact O-N 3Å; F861-S1184 VanDerWaalsContact CE1-O 3.28Å; F861-S1184 WeakPolarHBondContact CE1-O 3.22Å; F861-E1198 WeakPolarHBondContact CB-O 3.4Å; F861-R1199 WeakPolarHBondContact CA-O 3.18Å; F861-G1202 VanDerWaalsContact CD1-CA 3.48Å
862	F	77	Confident	64.4	Low	1 Å²	1	56.7 Å²	56.7	0%	0.004	27%	0.273	C	S	.	.	B	Isolated β-bridge	trans	-86.9	122.4	170.6	-58.5	-36.5	0	0	0	110.4	V848 P856 F1172 V1176 A1182 R1199 Y1200 G1201	V848-F862 HydrophobicContact CG1-CE1 4.24Å; V848-F862 HydrophobicContact CG1-CZ 4.25Å; V848-F862 HydrophobicContact CG2-CE1 4.32Å; P856-F862 HydrophobicContact CB-CD1 4.09Å; P856-F862 HydrophobicContact CB-CE1 3.8Å; P856-F862 HydrophobicContact CB-CZ 4.13Å; P856-F862 HydrophobicContact CG-CE1 4.4Å; P856-F862 HydrophobicContact CG-CE2 4.39Å; P856-F862 HydrophobicContact CG-CZ 4.33Å; F862-F1172 HydrophobicContact CD1-CD2 4.09Å; F862-F1172 AromaticContact CD1-CE2 3.98Å; F862-F1172 HydrophobicContact CD1-CE2 3.98Å; F862-F1172 AromaticContact CD2-CD2 3.48Å; F862-F1172 HydrophobicContact CD2-CD2 3.48Å; F862-F1172 VanDerWaalsContact CD2-CD2 3.48Å; F862-F1172 AromaticContact CD2-CE2 3.94Å; F862-F1172 HydrophobicContact CD2-CE2 3.94Å; F862-F1172 HydrophobicContact CE1-CD2 4.03Å; F862-F1172 AromaticContact CE1-CE2 3.52Å; F862-F1172 HydrophobicContact CE1-CE2 3.52Å; F862-F1172 AromaticContact CE2-CD2 3.37Å; F862-F1172 HydrophobicContact CE2-CD2 3.37Å; F862-F1172 AromaticContact CE2-CE2 3.42Å; F862-F1172 HydrophobicContact CE2-CE2 3.42Å; F862-F1172 VanDerWaalsContact CE2-CE2 3.42Å; F862-F1172 HydrophobicContact CE2-CG 4.41Å; F862-F1172 HydrophobicContact CE2-CZ 4.48Å; F862-F1172 AromaticContact CG-CD2 3.82Å; F862-F1172 HydrophobicContact CG-CD2 3.82Å; F862-F1172 HydrophobicContact CG-CE2 4.17Å; F862-F1172 AromaticContact CZ-CD2 3.65Å; F862-F1172 HydrophobicContact CZ-CD2 3.65Å; F862-F1172 AromaticContact CZ-CE2 3.17Å; F862-F1172 HydrophobicContact CZ-CE2 3.17Å; F862-F1172 HydrophobicContact CZ-CZ 4.14Å; F862-V1176 HydrophobicContact CD1-CG2 3.58Å; F862-V1176 HydrophobicContact CE1-CG2 3.99Å; F862-V1176 HydrophobicContact CG-CG2 4.19Å; F862-A1182 HydrophobicContact CD1-CB 3.78Å; F862-A1182 HydrophobicContact CE1-CB 3.94Å; F862-R1199 PolarHBondContact N-O 3.05Å; F862-Y1200 HydrophobicContact CB-CD1 3.73Å; F862-Y1200 HydrophobicContact CB-CE1 3.94Å; F862-Y1200 HydrophobicContact CD2-CD1 4.12Å; F862-Y1200 AromaticContact CD2-CE1 3.62Å; F862-Y1200 HydrophobicContact CD2-CE1 3.62Å; F862-Y1200 AromaticContact CD2-CZ 3.91Å; F862-Y1200 HydrophobicContact CG-CD1 4.46Å; F862-Y1200 HydrophobicContact CG-CE1 4.28Å; F862-Y1200 WeakPolarHBondContact O-CA 3.26Å; F862-G1201 PolarHBondContact O-N 2.71Å
863	P	63.5	Low	62.5	Low	1 Å²	1	53.7 Å²	53.7	1%	0.006	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-55.8	145.1	172.3	12.3	-20.3	0	0	0	111.2	F861 H867 T1175 N1179 M1183	F861-P863 HydrophobicContact CE2-CB 4.45Å; P863-H867 HydrophobicContact CB-CB 3.83Å; P863-T1175 WeakPolarHBondContact O-CB 3.31Å; P863-T1175 WeakPolarHBondContact O-CG2 3.19Å; P863-T1175 PolarHBondContact O-OG1 3.08Å; P863-N1179 HydrophobicContact CG-CB 4.45Å; P863-N1179 VanDerWaalsContact CG-ND2 3.33Å; P863-N1179 WeakPolarHBondContact CG-ND2 3.25Å; P863-M1183 HydrophobicContact CB-SD 3.92Å; P863-M1183 HydrophobicContact CG-CG 4.1Å; P863-M1183 HydrophobicContact CG-SD 3.78Å
864	I	63.2	Low	60.6	Low	32 Å²	32	56.8 Å²	56.8	16%	0.164	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-96	168.3	173	52.7	170.5	0	0	0	109.9	Q866 H867 M1160	I864-Q866 HydrophobicContact CD1-CB 4.03Å; I864-Q866 HydrophobicContact CG1-CB 4.18Å; I864-Q866 PolarHBondContact O-N 3.41Å; I864-H867 WeakPolarHBondContact O-CB 3.22Å; I864-H867 PolarHBondContact O-N 3.35Å; I864-M1160 HydrophobicContact CG2-CE 4.22Å; I864-M1160 HydrophobicContact CG2-SD 4.3Å
865	L	52.8	Low	59.1	Low	39 Å²	39	54.1 Å²	54.1	20%	0.204	27%	0.266	C	S	.	.	H	α-helix	trans	-60.1	-14.8	178.7	-90.3	169.7	0	0	0	114.6	I868 K869 L1153 I1171	L865-I868 PolarHBondContact O-N 3.28Å; L865-K869 VanDerWaalsContact O-CB 3.28Å; L865-K869 WeakPolarHBondContact O-CB 3.44Å; L865-K869 WeakPolarHBondContact O-CG 3.41Å; L865-K869 PolarHBondContact O-N 2.93Å; L865-L1153 HydrophobicContact CD1-CD1 3.65Å; L865-L1153 HydrophobicContact CD1-CD2 3.65Å; L865-L1153 HydrophobicContact CD1-CG 4.32Å; L865-I1171 HydrophobicContact CD1-CG1 4.09Å; L865-I1171 HydrophobicContact CG-CG1 4.5Å
866	Q	49	Very low	57.8	Low	102 Å²	102	53.6 Å²	53.6	48%	0.477	26%	0.263	S	S	.	.	H	α-helix	trans	-74	-31.4	169.1	-74.4	173	-43.4	0	0	113.1	I864 I868 K869	I864-Q866 HydrophobicContact CD1-CB 4.03Å; I864-Q866 HydrophobicContact CG1-CB 4.18Å; I864-Q866 PolarHBondContact O-N 3.41Å; Q866-I868 PolarHBondContact O-N 2.99Å; Q866-K869 CarbonylContact O-C 3.58Å; Q866-K869 PolarHBondContact O-N 3.3Å
867	H	50.9	Low	56.2	Low	50 Å²	50	54.1 Å²	54.1	23%	0.231	27%	0.267	C	S	.	.	H	α-helix	trans	-73.4	-16.5	172.8	-62.4	15.1	0	0	0	112.5	F861 P863 I864 E871 G1201	F861-H867 AromaticContact CE2-CD2 3.5Å; F861-H867 AromaticContact CE2-NE2 3.4Å; F861-H867 WeakPolarHBondContact CE2-NE2 3.44Å; F861-H867 AromaticContact CZ-CD2 3.9Å; F861-H867 AromaticContact CZ-NE2 3.81Å; P863-H867 HydrophobicContact CB-CB 3.83Å; I864-H867 WeakPolarHBondContact O-CB 3.22Å; I864-H867 PolarHBondContact O-N 3.35Å; H867-E871 IonicContact CE1-OE1 2.71Å; H867-E871 PolarHBondContact CE1-OE1 3.3Å; H867-E871 VanDerWaalsContact CE1-OE1 3.31Å; H867-E871 IonicContact ND1-OE1 3.51Å; H867-E871 PolarHBondContact ND1-OE1 3.22Å; H867-G1201 PolarHBondContact NE2-O 3.48Å
868	I	41.6	Very low	54.7	Low	42 Å²	42	53.2 Å²	53.2	22%	0.215	27%	0.266	C	S	.	.	H	α-helix	trans	-95.7	-25.6	170.1	-55.1	-176.4	0	0	0	111	L865 Q866 Y870 T1175 F1178	L865-I868 PolarHBondContact O-N 3.28Å; Q866-I868 PolarHBondContact O-N 2.99Å; I868-Y870 PolarHBondContact O-N 2.96Å; I868-T1175 HydrophobicContact CD1-CG2 3.46Å; I868-T1175 VanDerWaalsContact CD1-CG2 3.46Å; I868-T1175 HydrophobicContact CG1-CG2 4.3Å; I868-F1178 HydrophobicContact CD1-CB 4.18Å; I868-F1178 HydrophobicContact CD1-CD1 3.84Å; I868-F1178 HydrophobicContact CD1-CG 4.19Å; I868-F1178 HydrophobicContact CG1-CD1 4.03Å; I868-F1178 HydrophobicContact CG1-CE1 4.37Å; I868-F1178 HydrophobicContact CG2-CD1 4.38Å; I868-F1178 HydrophobicContact CG2-CE1 4.24Å
869	K	37.5	Very low	53.5	Low	147 Å²	147	50.5 Å²	50.5	64%	0.639	26%	0.257	S	S	*	.	S	Bend	trans	-96.8	62.5	169.7	-72.7	-176.5	168	-175.9	0	112.2	L865 Q866	L865-K869 VanDerWaalsContact O-CB 3.28Å; L865-K869 WeakPolarHBondContact O-CB 3.44Å; L865-K869 WeakPolarHBondContact O-CG 3.41Å; L865-K869 PolarHBondContact O-N 2.93Å; Q866-K869 CarbonylContact O-C 3.58Å; Q866-K869 PolarHBondContact O-N 3.3Å
870	Y	37.6	Very low	51.9	Low	98 Å²	98	55.3 Å²	55.3	38%	0.384	27%	0.268	S	S	.	.			trans	48.1	75.1	156.6	-50.1	-55.1	0	0	0	116.6	I868 A872 I920	I868-Y870 PolarHBondContact O-N 2.96Å; Y870-A872 PolarHBondContact O-N 3.34Å; Y870-I920 HydrophobicContact CD1-CD1 3.39Å; Y870-I920 HydrophobicContact CD1-CG1 3.72Å; Y870-I920 HydrophobicContact CD2-CD1 4.33Å; Y870-I920 HydrophobicContact CD2-CG1 4.05Å; Y870-I920 HydrophobicContact CE1-CD1 3.68Å; Y870-I920 HydrophobicContact CE1-CG1 3.54Å; Y870-I920 HydrophobicContact CE2-CG1 3.89Å; Y870-I920 HydrophobicContact CE2-CG2 4.2Å; Y870-I920 HydrophobicContact CG-CD1 3.74Å; Y870-I920 HydrophobicContact CG-CG1 3.96Å
871	E	32.3	Very low	50.1	Low	95 Å²	95	60.1 Å²	60.1	44%	0.444	29%	0.288	S	S	.	.			trans	-73	74.8	164.2	-82.4	-175	-136.7	0	0	111.6	H867 E873	H867-E871 IonicContact CE1-OE1 2.71Å; H867-E871 PolarHBondContact CE1-OE1 3.3Å; H867-E871 VanDerWaalsContact CE1-OE1 3.31Å; H867-E871 IonicContact ND1-OE1 3.51Å; H867-E871 PolarHBondContact ND1-OE1 3.22Å; E871-E873 PolarHBondContact O-N 3.17Å; E871-E873 VanDerWaalsContact O-N 3.13Å
872	A	39.1	Very low	48.2	Very low	24 Å²	24	63.8 Å²	63.8	20%	0.198	32%	0.318	C	S	.	.			trans	-78.5	91.5	177.7	0	0	0	0	0	111.9	Y870 D874 L911	Y870-A872 PolarHBondContact O-N 3.34Å; A872-D874 PolarHBondContact O-N 3.01Å; A872-L911 HydrophobicContact CB-CB 3.68Å; A872-L911 HydrophobicContact CB-CD1 4.4Å; A872-L911 HydrophobicContact CB-CD2 3.89Å; A872-L911 HydrophobicContact CB-CG 4.19Å
873	E	43	Very low	46.9	Very low	36 Å²	36	65.1 Å²	65.1	17%	0.168	33%	0.325	C	S	.	.	S	Bend	trans	-66.5	-18.5	174.4	-63.6	-152.9	95.7	0	0	113.5	E871 K898 K914 K1217	E871-E873 PolarHBondContact O-N 3.17Å; E871-E873 VanDerWaalsContact O-N 3.13Å; E873-K898 VanDerWaalsContact O-CD 3.24Å; E873-K898 WeakPolarHBondContact O-CD 3.17Å; E873-K898 WeakPolarHBondContact O-CE 3.45Å; E873-K914 WeakPolarHBondContact OE2-CE 3.39Å; E873-K914 IonicContact OE2-NZ 2.64Å; E873-K914 PolarHBondContact OE2-NZ 2.84Å; E873-K1217 IonicContact OE1-NZ 3.7Å; E873-K1217 PolarHBondContact OE1-NZ 3.34Å; E873-K1217 IonicContact OE2-NZ 3.53Å; E873-K1217 PolarHBondContact OE2-NZ 2.84Å
874	D	46.1	Very low	46	Very low	65 Å²	65	69.3 Å²	69.3	35%	0.348	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	151.5	178.7	-98	-61.1	0	0	0	112	A872 F876 Y885 K898 H912	A872-D874 PolarHBondContact O-N 3.01Å; D874-F876 HydrophobicContact CB-CE2 4.45Å; D874-Y885 WeakPolarHBondContact CA-OH 3.33Å; D874-K898 IonicContact OD1-NZ 3.13Å; D874-K898 PolarHBondContact OD1-NZ 2.79Å; D874-K898 WeakPolarHBondContact OD2-CE 3.19Å; D874-K898 IonicContact OD2-NZ 2.69Å; D874-K898 PolarHBondContact OD2-NZ 3.21Å; D874-H912 HydrophobicContact CB-CB 4.37Å; D874-H912 PolarHBondContact O-N 2.72Å
875	G	48.1	Very low	45.4	Very low	1 Å²	1	69.5 Å²	69.5	1%	0.01	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172	143.8	-171.8	0	0	0	0	0	114.2	I883 Y885 H910	G875-I883 VanDerWaalsContact C-CD1 3.44Å; G875-I883 WeakPolarHBondContact O-CG1 3.39Å; G875-I883 PolarHBondContact O-N 2.79Å; G875-Y885 PolarHBondContact N-OH 2.92Å; G875-H910 CarbonylContact C-O 3.03Å; G875-H910 WeakPolarHBondContact CA-O 3.45Å
876	F	52.7	Low	45.1	Very low	62 Å²	62	68.6 Å²	68.6	27%	0.272	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	143.2	-168.3	-55.2	-86.1	0	0	0	111	D874 I883 H910	D874-F876 HydrophobicContact CB-CE2 4.45Å; F876-I883 VanDerWaalsContact C-CG1 3.48Å; F876-H910 PolarHBondContact N-O 2.88Å; F876-H910 WeakPolarHBondContact O-CB 3.04Å; F876-H910 PolarHBondContact O-N 3.22Å
877	S	47.4	Very low	45.1	Very low	27 Å²	27	67.7 Å²	67.7	19%	0.189	34%	0.34	C	S	.	.			trans	-66.6	164.1	164.9	60.9	0	0	0	0	110.4	D879 Y880 K881	S877-D879 PolarHBondContact O-N 2.88Å; S877-Y880 WeakPolarHBondContact O-CA 3.48Å; S877-Y880 PolarHBondContact O-N 2.74Å; S877-K881 PolarHBondContact N-O 3.07Å; S877-K881 WeakPolarHBondContact OG-CB 3.43Å; S877-K881 PolarHBondContact OG-N 2.81Å; S877-K881 PolarHBondContact OG-O 3.17Å
878	P	48.4	Very low	45	Very low	60 Å²	60	68.3 Å²	68.3	39%	0.39	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-18.4	177	-23.3	33.6	0	0	0	113.9	Y880 S908	P878-Y880 PolarHBondContact O-N 3.06Å; P878-S908 WeakPolarHBondContact CD-O 3.49Å; P878-S908 VanDerWaalsContact CG-OG 3.25Å; P878-S908 WeakPolarHBondContact CG-OG 3.39Å
879	D	49.4	Very low	45.4	Very low	108 Å²	108	73.5 Å²	73.5	58%	0.578	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	11	173.3	-60.4	-12.2	0	0	0	112.9	S877 K881	S877-D879 PolarHBondContact O-N 2.88Å; D879-K881 HydrophobicContact CB-CD 3.76Å; D879-K881 HydrophobicContact CB-CG 3.98Å; D879-K881 PolarHBondContact O-N 2.78Å; D879-K881 WeakPolarHBondContact OD2-CE 3.47Å; D879-K881 IonicContact OD2-NZ 2.7Å; D879-K881 PolarHBondContact OD2-NZ 3.42Å
880	Y	42.4	Very low	45.9	Very low	141 Å²	141	75.3 Å²	75.3	55%	0.553	38%	0.376	S	S	*	.	S	Bend	trans	55.2	9.5	-168.6	-70.1	-93.9	0	0	0	115.7	S877 P878	S877-Y880 WeakPolarHBondContact O-CA 3.48Å; S877-Y880 PolarHBondContact O-N 2.74Å; P878-Y880 PolarHBondContact O-N 3.06Å
881	K	45.9	Very low	46.2	Very low	130 Å²	130	73.7 Å²	73.7	57%	0.565	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-72.4	131	173.6	-55.2	158.7	-173.2	160.8	0	108.8	S877 D879 I883	S877-K881 PolarHBondContact N-O 3.07Å; S877-K881 WeakPolarHBondContact OG-CB 3.43Å; S877-K881 PolarHBondContact OG-N 2.81Å; S877-K881 PolarHBondContact OG-O 3.17Å; D879-K881 HydrophobicContact CB-CD 3.76Å; D879-K881 HydrophobicContact CB-CG 3.98Å; D879-K881 PolarHBondContact O-N 2.78Å; D879-K881 WeakPolarHBondContact OD2-CE 3.47Å; D879-K881 IonicContact OD2-NZ 2.7Å; D879-K881 PolarHBondContact OD2-NZ 3.42Å; K881-I883 PolarHBondContact O-N 2.99Å
882	A	44.6	Very low	46.5	Very low	78 Å²	78	71.8 Å²	71.8	65%	0.645	37%	0.367	S	S	*	.	B	Isolated β-bridge	trans	-56.2	132.4	177.3	0	0	0	0	0	111.6
883	I	49.3	Very low	46.5	Very low	30 Å²	30	73.5 Å²	73.5	15%	0.154	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-77.8	150.1	-179.3	-48.4	159.9	0	0	0	109.7	G875 F876 K881 V901 V909	G875-I883 VanDerWaalsContact C-CD1 3.44Å; G875-I883 WeakPolarHBondContact O-CG1 3.39Å; G875-I883 PolarHBondContact O-N 2.79Å; F876-I883 VanDerWaalsContact C-CG1 3.48Å; K881-I883 PolarHBondContact O-N 2.99Å; I883-V901 HydrophobicContact CD1-CG1 4.36Å; I883-V901 HydrophobicContact CD1-CG2 4.48Å; I883-V901 HydrophobicContact CG2-CG1 3.73Å; I883-V901 HydrophobicContact CG2-CG2 4.44Å; I883-V909 HydrophobicContact CD1-CB 4.04Å; I883-V909 HydrophobicContact CD1-CG1 3.47Å; I883-V909 VanDerWaalsContact CD1-CG1 3.47Å; I883-V909 HydrophobicContact CD1-CG2 3.8Å
884	R	44.7	Very low	46.3	Very low	89 Å²	89	80 Å²	80	34%	0.336	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-84.4	118.6	173.7	-57.8	-146.9	-157.5	147.1	20.7	111.3	L1270 I1271	R884-L1270 WeakPolarHBondContact CD-O 3.45Å; R884-L1270 VanDerWaalsContact CZ-C 3.5Å; R884-L1270 PolarHBondContact NE-O 3.43Å; R884-L1270 VanDerWaalsContact NE-O 3.07Å; R884-L1270 VanDerWaalsContact NH1-C 3.33Å; R884-L1270 PolarHBondContact NH1-O 3.16Å; R884-L1270 PolarHBondContact NH2-O 3.36Å; R884-I1271 PolarHBondContact NH2-O 3.21Å
885	Y	51.5	Low	46.1	Very low	35 Å²	35	82.1 Å²	82.1	14%	0.137	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	137.3	169.1	-61.5	-88.8	0	0	0	110.4	D874 G875 K898 G899 F900 V901	D874-Y885 WeakPolarHBondContact CA-OH 3.33Å; G875-Y885 PolarHBondContact N-OH 2.92Å; Y885-K898 WeakPolarHBondContact CB-O 3.31Å; Y885-K898 HydrophobicContact CD1-CB 3.93Å; Y885-K898 HydrophobicContact CD2-CB 3.8Å; Y885-K898 HydrophobicContact CD2-CD 4.42Å; Y885-K898 HydrophobicContact CE1-CB 4.16Å; Y885-K898 HydrophobicContact CE2-CB 4.07Å; Y885-K898 HydrophobicContact CE2-CD 4.04Å; Y885-K898 HydrophobicContact CG-CB 3.73Å; Y885-G899 WeakPolarHBondContact CD1-O 3.03Å; Y885-F900 WeakPolarHBondContact CA-O 3.48Å; Y885-V901 HydrophobicContact CD1-CG2 4.17Å; Y885-V901 HydrophobicContact CE1-CG2 3.88Å
886	A	46.6	Very low	45.6	Very low	20 Å²	20	83.6 Å²	83.6	17%	0.165	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	141	164	0	0	0	0	0	109.5	G899 F900	A886-G899 CarbonylContact O-C 3.48Å; A886-G899 VanDerWaalsContact O-CA 3.26Å; A886-G899 WeakPolarHBondContact O-CA 3.42Å; A886-F900 HydrophobicContact CB-CD1 4.22Å; A886-F900 HydrophobicContact CB-CD2 4.11Å; A886-F900 HydrophobicContact CB-CE1 3.78Å; A886-F900 HydrophobicContact CB-CE2 3.67Å; A886-F900 HydrophobicContact CB-CG 4.38Å; A886-F900 HydrophobicContact CB-CZ 3.49Å; A886-F900 VanDerWaalsContact CB-CZ 3.49Å; A886-F900 PolarHBondContact N-O 2.72Å; A886-F900 WeakPolarHBondContact O-CD1 3.47Å; A886-F900 WeakPolarHBondContact O-CE1 3.36Å; A886-F900 PolarHBondContact O-N 2.87Å
887	T	47.4	Very low	45.4	Very low	83 Å²	83	81.2 Å²	81.2	51%	0.509	41%	0.413	S	S	.	.			trans	-121.8	117.3	171.9	51.9	0	0	0	0	109	K898	T887-K898 WeakPolarHBondContact CG2-O 3.4Å
888	D	50.3	Low	45.3	Very low	63 Å²	63	83.7 Å²	83.7	34%	0.337	42%	0.42	S	S	.	.			trans	-125.9	110.8	175.6	-175.4	0.9	0	0	0	109.8	K890 T891 F892 F900	D888-K890 PolarHBondContact O-N 3.04Å; D888-K890 VanDerWaalsContact OD1-CB 3.32Å; D888-K890 WeakPolarHBondContact OD1-CB 3.45Å; D888-K890 PolarHBondContact OD1-N 2.86Å; D888-T891 PolarHBondContact O-N 3.36Å; D888-T891 PolarHBondContact OD2-OG1 2.8Å; D888-F892 PolarHBondContact O-N 2.78Å; D888-F900 HydrophobicContact CB-CE1 4.05Å; D888-F900 HydrophobicContact CB-CZ 4.46Å
889	E	48.4	Very low	45.4	Very low	151 Å²	151	81.4 Å²	81.4	71%	0.706	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-14.3	176.4	-74.2	-166	126.9	0	0	113.5	P893	E889-P893 WeakPolarHBondContact O-CB 3.28Å; E889-P893 WeakPolarHBondContact O-CD 3.35Å
890	K	49.5	Very low	45.4	Very low	185 Å²	185	79.5 Å²	79.5	80%	0.804	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-33.5	173.2	-63.7	179.9	176.9	178.9	0	112.8	D888	D888-K890 PolarHBondContact O-N 3.04Å; D888-K890 VanDerWaalsContact OD1-CB 3.32Å; D888-K890 WeakPolarHBondContact OD1-CB 3.45Å; D888-K890 PolarHBondContact OD1-N 2.86Å
891	T	42.4	Very low	45.6	Very low	64 Å²	64	74 Å²	74	39%	0.393	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-25.5	-175.8	-53.5	0	0	0	0	112.1	D888 L1157	D888-T891 PolarHBondContact O-N 3.36Å; D888-T891 PolarHBondContact OD2-OG1 2.8Å; T891-L1157 WeakPolarHBondContact O-CD1 3.27Å
892	F	38.9	Very low	45.6	Very low	55 Å²	55	75.8 Å²	75.8	24%	0.241	38%	0.378	C	S	.	.	S	Bend	trans	-137.9	55.5	179.4	-55.5	-81.5	0	0	0	113.6	D888 K894 F895 F900 P1156	D888-F892 PolarHBondContact O-N 2.78Å; F892-K894 PolarHBondContact O-N 3.4Å; F892-F895 HydrophobicContact CB-CB 4.04Å; F892-F895 HydrophobicContact CB-CG 4.48Å; F892-F895 WeakPolarHBondContact O-CB 3.21Å; F892-F895 PolarHBondContact O-N 2.99Å; F892-F900 AromaticContact CD2-CD1 3.39Å; F892-F900 HydrophobicContact CD2-CD1 3.39Å; F892-F900 AromaticContact CD2-CE1 3.66Å; F892-F900 HydrophobicContact CD2-CE1 3.66Å; F892-F900 HydrophobicContact CD2-CG 4.24Å; F892-F900 HydrophobicContact CE2-CB 4.1Å; F892-F900 AromaticContact CE2-CD1 3.21Å; F892-F900 HydrophobicContact CE2-CD1 3.21Å; F892-F900 HydrophobicContact CE2-CD2 4.32Å; F892-F900 AromaticContact CE2-CE1 3.56Å; F892-F900 HydrophobicContact CE2-CE1 3.56Å; F892-F900 AromaticContact CE2-CG 3.64Å; F892-F900 HydrophobicContact CE2-CG 3.64Å; F892-F900 HydrophobicContact CE2-CZ 4.24Å; F892-F900 HydrophobicContact CZ-CB 4.34Å; F892-F900 HydrophobicContact CZ-CD1 4.23Å; F892-F900 HydrophobicContact CZ-CG 4.3Å; F892-P1156 HydrophobicContact CD1-CB 4.46Å; F892-P1156 HydrophobicContact CE1-CB 3.96Å
893	P	39.4	Very low	45.5	Very low	60 Å²	60	75.3 Å²	75.3	39%	0.39	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	132.6	175.2	23.8	-34.3	0	0	0	112.4	E889 L1157	E889-P893 WeakPolarHBondContact O-CB 3.28Å; E889-P893 WeakPolarHBondContact O-CD 3.35Å; P893-L1157 HydrophobicContact CG-CD1 3.9Å; P893-L1157 HydrophobicContact CG-CD2 3.93Å
894	K	38.8	Very low	45.1	Very low	172 Å²	172	78.1 Å²	78.1	75%	0.748	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.7	11.5	-174.9	-49.5	-176.8	-178.7	-178.7	0	116.8	F892	F892-K894 PolarHBondContact O-N 3.4Å
895	F	41.2	Very low	44.8	Very low	110 Å²	110	82.3 Å²	82.3	48%	0.482	39%	0.394	S	S	.	.			trans	-55.5	139.4	173.5	-165.4	-103.9	0	0	0	112.2	F892	F892-F895 HydrophobicContact CB-CB 4.04Å; F892-F895 HydrophobicContact CB-CG 4.48Å; F892-F895 WeakPolarHBondContact O-CB 3.21Å; F892-F895 PolarHBondContact O-N 2.99Å
896	S	39.4	Very low	44.3	Very low	33 Å²	33	86.1 Å²	86.1	23%	0.231	42%	0.417	C	S	.	.			trans	-104.9	-16.3	-170	49.3	0	0	0	0	114.6
897	G	47.7	Very low	44.1	Very low	11 Å²	11	87.1 Å²	87.1	11%	0.113	42%	0.423	C	S	.	.	S	Bend	trans	-98	-166.7	179.9	0	0	0	0	0	114.5	G899	G897-G899 VanDerWaalsContact C-N 3.34Å; G897-G899 PolarHBondContact O-N 3.2Å
898	K	46.1	Very low	43.8	Very low	80 Å²	80	84.5 Å²	84.5	35%	0.348	41%	0.408	S	S	.	.	S	Bend	trans	-69.1	-25.4	-171.9	-56.5	-170.9	-166.6	-176.9	0	114.8	E873 D874 Y885 T887	E873-K898 VanDerWaalsContact O-CD 3.24Å; E873-K898 WeakPolarHBondContact O-CD 3.17Å; E873-K898 WeakPolarHBondContact O-CE 3.45Å; D874-K898 IonicContact OD1-NZ 3.13Å; D874-K898 PolarHBondContact OD1-NZ 2.79Å; D874-K898 WeakPolarHBondContact OD2-CE 3.19Å; D874-K898 IonicContact OD2-NZ 2.69Å; D874-K898 PolarHBondContact OD2-NZ 3.21Å; Y885-K898 WeakPolarHBondContact CB-O 3.31Å; Y885-K898 HydrophobicContact CD1-CB 3.93Å; Y885-K898 HydrophobicContact CD2-CB 3.8Å; Y885-K898 HydrophobicContact CD2-CD 4.42Å; Y885-K898 HydrophobicContact CE1-CB 4.16Å; Y885-K898 HydrophobicContact CE2-CB 4.07Å; Y885-K898 HydrophobicContact CE2-CD 4.04Å; Y885-K898 HydrophobicContact CG-CB 3.73Å; T887-K898 WeakPolarHBondContact CG2-O 3.4Å
899	G	50.6	Low	43.5	Very low	12 Å²	12	81.8 Å²	81.8	12%	0.124	39%	0.394	C	S	.	.			trans	141.2	-160.2	176.4	0	0	0	0	0	111.1	Y885 A886 G897	Y885-G899 WeakPolarHBondContact CD1-O 3.03Å; A886-G899 CarbonylContact O-C 3.48Å; A886-G899 VanDerWaalsContact O-CA 3.26Å; A886-G899 WeakPolarHBondContact O-CA 3.42Å; G897-G899 VanDerWaalsContact C-N 3.34Å; G897-G899 PolarHBondContact O-N 3.2Å
900	F	48	Very low	43.8	Very low	67 Å²	67	76.7 Å²	76.7	29%	0.294	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	143.5	172.8	61.8	-85.7	0	0	0	111.5	Y885 A886 D888 F892	Y885-F900 WeakPolarHBondContact CA-O 3.48Å; A886-F900 HydrophobicContact CB-CD1 4.22Å; A886-F900 HydrophobicContact CB-CD2 4.11Å; A886-F900 HydrophobicContact CB-CE1 3.78Å; A886-F900 HydrophobicContact CB-CE2 3.67Å; A886-F900 HydrophobicContact CB-CG 4.38Å; A886-F900 HydrophobicContact CB-CZ 3.49Å; A886-F900 VanDerWaalsContact CB-CZ 3.49Å; A886-F900 PolarHBondContact N-O 2.72Å; A886-F900 WeakPolarHBondContact O-CD1 3.47Å; A886-F900 WeakPolarHBondContact O-CE1 3.36Å; A886-F900 PolarHBondContact O-N 2.87Å; D888-F900 HydrophobicContact CB-CE1 4.05Å; D888-F900 HydrophobicContact CB-CZ 4.46Å; F892-F900 AromaticContact CD2-CD1 3.39Å; F892-F900 HydrophobicContact CD2-CD1 3.39Å; F892-F900 AromaticContact CD2-CE1 3.66Å; F892-F900 HydrophobicContact CD2-CE1 3.66Å; F892-F900 HydrophobicContact CD2-CG 4.24Å; F892-F900 HydrophobicContact CE2-CB 4.1Å; F892-F900 AromaticContact CE2-CD1 3.21Å; F892-F900 HydrophobicContact CE2-CD1 3.21Å; F892-F900 HydrophobicContact CE2-CD2 4.32Å; F892-F900 AromaticContact CE2-CE1 3.56Å; F892-F900 HydrophobicContact CE2-CE1 3.56Å; F892-F900 AromaticContact CE2-CG 3.64Å; F892-F900 HydrophobicContact CE2-CG 3.64Å; F892-F900 HydrophobicContact CE2-CZ 4.24Å; F892-F900 HydrophobicContact CZ-CB 4.34Å; F892-F900 HydrophobicContact CZ-CD1 4.23Å; F892-F900 HydrophobicContact CZ-CG 4.3Å
901	V	46.8	Very low	43.4	Very low	26 Å²	26	69 Å²	69	16%	0.158	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	139.2	175.3	175.3	0	0	0	0	110.1	I883 Y885 F903 V909	I883-V901 HydrophobicContact CD1-CG1 4.36Å; I883-V901 HydrophobicContact CD1-CG2 4.48Å; I883-V901 HydrophobicContact CG2-CG1 3.73Å; I883-V901 HydrophobicContact CG2-CG2 4.44Å; Y885-V901 HydrophobicContact CD1-CG2 4.17Å; Y885-V901 HydrophobicContact CE1-CG2 3.88Å; V901-F903 HydrophobicContact CB-CE2 4.09Å; V901-F903 HydrophobicContact CG1-CD2 4.17Å; V901-F903 HydrophobicContact CG1-CE2 3.82Å; V901-F903 HydrophobicContact CG1-CZ 4.2Å; V901-V909 HydrophobicContact CG1-CG1 4.28Å; V901-V909 HydrophobicContact CG1-CG2 3.92Å
902	R	45.4	Very low	43.4	Very low	168 Å²	168	69.3 Å²	69.3	63%	0.634	33%	0.334	S	S	*	.			trans	-107.5	117.2	179.4	-160.5	176	-170.4	-179.1	1.7	110.3
903	F	43.3	Very low	43.3	Very low	67 Å²	67	69.2 Å²	69.2	29%	0.294	33%	0.334	S	S	.	.			trans	-96.8	140.7	-177.1	-67.4	-103.3	0	0	0	111.5	V901 V909 V922	V901-F903 HydrophobicContact CB-CE2 4.09Å; V901-F903 HydrophobicContact CG1-CD2 4.17Å; V901-F903 HydrophobicContact CG1-CE2 3.82Å; V901-F903 HydrophobicContact CG1-CZ 4.2Å; F903-V909 HydrophobicContact CD1-CG2 3.99Å; F903-V909 HydrophobicContact CE1-CB 3.59Å; F903-V909 HydrophobicContact CE1-CG1 4.24Å; F903-V909 HydrophobicContact CE1-CG2 3.5Å; F903-V909 HydrophobicContact CZ-CB 3.87Å; F903-V909 HydrophobicContact CZ-CG1 3.99Å; F903-V909 HydrophobicContact CZ-CG2 3.91Å; F903-V922 HydrophobicContact CD1-CG1 4.48Å; F903-V922 HydrophobicContact CE1-CB 3.75Å; F903-V922 HydrophobicContact CE1-CG1 3.6Å; F903-V922 HydrophobicContact CZ-CB 3.94Å; F903-V922 HydrophobicContact CZ-CG1 3.79Å
904	N	40.4	Very low	43.1	Very low	89 Å²	89	72.4 Å²	72.4	48%	0.476	34%	0.342	S	S	.	.			trans	-107.6	169.6	160.1	-67.3	-14.5	0	0	0	109	S907	N904-S907 WeakPolarHBondContact CB-OG 3.5Å; N904-S907 PolarHBondContact N-OG 3.33Å; N904-S907 WeakPolarHBondContact O-CB 3.36Å; N904-S907 PolarHBondContact O-N 2.85Å; N904-S907 VanDerWaalsContact O-N 3.15Å; N904-S907 PolarHBondContact O-OG 3.06Å
905	Y	39.7	Very low	42.9	Very low	177 Å²	177	70.7 Å²	70.7	69%	0.694	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	149.9	168.2	-64.3	-74.1	0	0	0	111	S907	Y905-S907 PolarHBondContact O-N 3.28Å
906	D	41.1	Very low	42.5	Very low	115 Å²	115	69 Å²	69	62%	0.615	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	5.9	-169.6	-59.2	-21.8	0	0	0	116.3	S908	D906-S908 PolarHBondContact O-N 3.39Å
907	S	41.1	Very low	42.1	Very low	41 Å²	41	71.8 Å²	71.8	29%	0.287	36%	0.358	S	S	.	.			trans	-77.9	117.6	173.4	-56.6	0	0	0	0	110.9	N904 Y905	N904-S907 WeakPolarHBondContact CB-OG 3.5Å; N904-S907 PolarHBondContact N-OG 3.33Å; N904-S907 WeakPolarHBondContact O-CB 3.36Å; N904-S907 PolarHBondContact O-N 2.85Å; N904-S907 VanDerWaalsContact O-N 3.15Å; N904-S907 PolarHBondContact O-OG 3.06Å; Y905-S907 PolarHBondContact O-N 3.28Å
908	S	41.6	Very low	41.5	Very low	28 Å²	28	75 Å²	75	20%	0.196	37%	0.37	C	S	.	.			trans	-94.9	146	165	19.8	0	0	0	0	110.2	P878 D906 E921	P878-S908 WeakPolarHBondContact CD-O 3.49Å; P878-S908 VanDerWaalsContact CG-OG 3.25Å; P878-S908 WeakPolarHBondContact CG-OG 3.39Å; D906-S908 PolarHBondContact O-N 3.39Å; S908-E921 WeakPolarHBondContact CB-OE1 3.34Å
909	V	43.4	Very low	41.1	Very low	7 Å²	7	75.2 Å²	75.2	4%	0.042	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	122.7	-176.2	158.7	0	0	0	0	107.8	I883 V901 F903 L911 E921 V922	I883-V909 HydrophobicContact CD1-CB 4.04Å; I883-V909 HydrophobicContact CD1-CG1 3.47Å; I883-V909 VanDerWaalsContact CD1-CG1 3.47Å; I883-V909 HydrophobicContact CD1-CG2 3.8Å; V901-V909 HydrophobicContact CG1-CG1 4.28Å; V901-V909 HydrophobicContact CG1-CG2 3.92Å; F903-V909 HydrophobicContact CD1-CG2 3.99Å; F903-V909 HydrophobicContact CE1-CB 3.59Å; F903-V909 HydrophobicContact CE1-CG1 4.24Å; F903-V909 HydrophobicContact CE1-CG2 3.5Å; F903-V909 HydrophobicContact CZ-CB 3.87Å; F903-V909 HydrophobicContact CZ-CG1 3.99Å; F903-V909 HydrophobicContact CZ-CG2 3.91Å; V909-L911 HydrophobicContact CG1-CD2 3.45Å; V909-L911 VanDerWaalsContact CG1-CD2 3.45Å; V909-L911 HydrophobicContact CG1-CG 3.95Å; V909-E921 WeakPolarHBondContact O-CA 3.33Å; V909-V922 PolarHBondContact N-O 3.37Å; V909-V922 PolarHBondContact O-N 3.43Å
910	H	54.4	Low	40.6	Very low	43 Å²	43	76 Å²	76	20%	0.199	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	111.1	169.9	-63.3	-100.7	0	0	0	108.3	G875 F876	G875-H910 CarbonylContact C-O 3.03Å; G875-H910 WeakPolarHBondContact CA-O 3.45Å; F876-H910 PolarHBondContact N-O 2.88Å; F876-H910 WeakPolarHBondContact O-CB 3.04Å; F876-H910 PolarHBondContact O-N 3.22Å
911	L	41.7	Very low	40.3	Very low	25 Å²	25	76.6 Å²	76.6	13%	0.131	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	132.8	172.7	-62.4	-177.7	0	0	0	109.6	A872 V909 I920 V922	A872-L911 HydrophobicContact CB-CB 3.68Å; A872-L911 HydrophobicContact CB-CD1 4.4Å; A872-L911 HydrophobicContact CB-CD2 3.89Å; A872-L911 HydrophobicContact CB-CG 4.19Å; V909-L911 HydrophobicContact CG1-CD2 3.45Å; V909-L911 VanDerWaalsContact CG1-CD2 3.45Å; V909-L911 HydrophobicContact CG1-CG 3.95Å; L911-I920 HydrophobicContact CB-CB 4.23Å; L911-I920 HydrophobicContact CB-CD1 4.01Å; L911-I920 PolarHBondContact N-O 3.14Å; L911-I920 PolarHBondContact O-N 2.84Å; L911-V922 HydrophobicContact CD1-CG2 3.8Å; L911-V922 HydrophobicContact CG-CG2 4.36Å
912	H	42.8	Very low	39.9	Very low	70 Å²	70	77.5 Å²	77.5	32%	0.324	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	119.2	179.6	-131.9	-90.8	0	0	0	110.6	D874 Q919	D874-H912 HydrophobicContact CB-CB 4.37Å; D874-H912 PolarHBondContact O-N 2.72Å; H912-Q919 PolarHBondContact NE2-NE2 3.07Å
913	E	37.4	Very low	39.6	Very low	52 Å²	52	76.8 Å²	76.8	24%	0.243	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-78.2	154.7	174.7	-154.5	-139	-133.7	0	0	111.3	E915 G916 K917	E913-E915 WeakPolarHBondContact OE2-CA 3.4Å; E913-E915 PolarHBondContact OE2-N 3.11Å; E913-E915 VanDerWaalsContact OE2-N 3.1Å; E913-G916 PolarHBondContact OE2-N 3.34Å; E913-K917 WeakPolarHBondContact CB-O 3.14Å; E913-K917 PolarHBondContact OE2-N 2.76Å
914	K	34.9	Very low	39.2	Very low	128 Å²	128	78.3 Å²	78.3	56%	0.557	39%	0.391	S	S	*	.	S	Bend	trans	-95.3	-7	-172.8	-153.5	175.8	178.2	-178.9	0	114.1	E873	E873-K914 WeakPolarHBondContact OE2-CE 3.39Å; E873-K914 IonicContact OE2-NZ 2.64Å; E873-K914 PolarHBondContact OE2-NZ 2.84Å
915	E	34.4	Very low	38.7	Very low	135 Å²	135	79.2 Å²	79.2	63%	0.631	40%	0.402	S	S	*	.	S	Bend	trans	-124.4	13.2	-177.9	-63.9	-173.7	176.3	0	0	113.1	E913 M1183	E913-E915 WeakPolarHBondContact OE2-CA 3.4Å; E913-E915 PolarHBondContact OE2-N 3.11Å; E913-E915 VanDerWaalsContact OE2-N 3.1Å; E915-M1183 WeakPolarHBondContact OE1-CE 2.85Å; E915-M1183 WeakPolarHBondContact OE2-CE 3.33Å
916	G	32	Very low	38.4	Very low	74 Å²	74	74.5 Å²	74.5	76%	0.763	38%	0.383	S	S	*	.	S	Bend	trans	91.1	0.9	168.3	0	0	0	0	0	116.1	E913	E913-G916 PolarHBondContact OE2-N 3.34Å
917	K	32.5	Very low	37.8	Very low	92 Å²	92	73.8 Å²	73.8	40%	0.4	39%	0.392	S	S	.	.			trans	-93.3	105.9	177.1	-55.9	-179.6	-176.3	-178.8	0	111	E913	E913-K917 WeakPolarHBondContact CB-O 3.14Å; E913-K917 PolarHBondContact OE2-N 2.76Å
918	Q	33.8	Very low	37.3	Very low	79 Å²	79	75.9 Å²	75.9	37%	0.369	41%	0.405	S	S	.	.			trans	63.9	129.8	163.5	-51.4	-174.7	-87.8	0	0	117.8	I920 P1014 Y1015	Q918-I920 WeakPolarHBondContact O-CD1 3.23Å; Q918-P1014 VanDerWaalsContact OE1-CB 3.26Å; Q918-P1014 VanDerWaalsContact OE1-CG 3.25Å; Q918-Y1015 HydrophobicContact CG-CD2 4.48Å
919	Q	38.9	Very low	36.7	Very low	84 Å²	84	83.5 Å²	83.5	39%	0.393	44%	0.438	S	S	.	.			trans	-76.1	133.8	155.5	-71	-174.2	-0.4	0	0	109.4	H912	H912-Q919 PolarHBondContact NE2-NE2 3.07Å
920	I	40	Very low	35.9	Very low	28 Å²	28	89.1 Å²	89.1	14%	0.144	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	112.8	177	-44.6	90.3	0	0	0	108.4	Y870 L911 Q918 V922	Y870-I920 HydrophobicContact CD1-CD1 3.39Å; Y870-I920 HydrophobicContact CD1-CG1 3.72Å; Y870-I920 HydrophobicContact CD2-CD1 4.33Å; Y870-I920 HydrophobicContact CD2-CG1 4.05Å; Y870-I920 HydrophobicContact CE1-CD1 3.68Å; Y870-I920 HydrophobicContact CE1-CG1 3.54Å; Y870-I920 HydrophobicContact CE2-CG1 3.89Å; Y870-I920 HydrophobicContact CE2-CG2 4.2Å; Y870-I920 HydrophobicContact CG-CD1 3.74Å; Y870-I920 HydrophobicContact CG-CG1 3.96Å; L911-I920 HydrophobicContact CB-CB 4.23Å; L911-I920 HydrophobicContact CB-CD1 4.01Å; L911-I920 PolarHBondContact N-O 3.14Å; L911-I920 PolarHBondContact O-N 2.84Å; Q918-I920 WeakPolarHBondContact O-CD1 3.23Å; I920-V922 HydrophobicContact CG2-CG2 4.08Å
921	E	41.2	Very low	34.5	Very low	80 Å²	80	92.6 Å²	92.6	37%	0.374	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	107.8	168.3	-167.9	-173.3	-175.1	0	0	109.7	S908 V909 R923	S908-E921 WeakPolarHBondContact CB-OE1 3.34Å; V909-E921 WeakPolarHBondContact O-CA 3.33Å; E921-R923 VanDerWaalsContact CD-NE 3.33Å; E921-R923 HydrophobicContact CG-CG 4.39Å; E921-R923 IonicContact OE1-CZ 3.41Å; E921-R923 IonicContact OE1-NE 2.88Å; E921-R923 PolarHBondContact OE1-NE 2.99Å; E921-R923 IonicContact OE1-NH2 2.7Å; E921-R923 PolarHBondContact OE1-NH2 2.96Å; E921-R923 IonicContact OE2-CZ 3.91Å; E921-R923 IonicContact OE2-NE 3.43Å; E921-R923 IonicContact OE2-NH2 3.9Å; E921-R923 PolarHBondContact OE2-NH2 3.29Å
922	V	38.5	Very low	33.8	Very low	45 Å²	45	96.9 Å²	96.9	27%	0.273	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	118.2	177.1	-179.3	0	0	0	0	109.8	F903 V909 L911 I920	F903-V922 HydrophobicContact CD1-CG1 4.48Å; F903-V922 HydrophobicContact CE1-CB 3.75Å; F903-V922 HydrophobicContact CE1-CG1 3.6Å; F903-V922 HydrophobicContact CZ-CB 3.94Å; F903-V922 HydrophobicContact CZ-CG1 3.79Å; V909-V922 PolarHBondContact N-O 3.37Å; V909-V922 PolarHBondContact O-N 3.43Å; L911-V922 HydrophobicContact CD1-CG2 3.8Å; L911-V922 HydrophobicContact CG-CG2 4.36Å; I920-V922 HydrophobicContact CG2-CG2 4.08Å
923	R	39.5	Very low	33	Very low	153 Å²	153	100.1 Å²	100.1	58%	0.577	56%	0.555	S	S	*	*			trans	-127.2	155.5	171.5	-66.6	-171.9	-170.7	161.2	12.9	111	E921	E921-R923 VanDerWaalsContact CD-NE 3.33Å; E921-R923 HydrophobicContact CG-CG 4.39Å; E921-R923 IonicContact OE1-CZ 3.41Å; E921-R923 IonicContact OE1-NE 2.88Å; E921-R923 PolarHBondContact OE1-NE 2.99Å; E921-R923 IonicContact OE1-NH2 2.7Å; E921-R923 PolarHBondContact OE1-NH2 2.96Å; E921-R923 IonicContact OE2-CZ 3.91Å; E921-R923 IonicContact OE2-NE 3.43Å; E921-R923 IonicContact OE2-NH2 3.9Å; E921-R923 PolarHBondContact OE2-NH2 3.29Å
924	L	33.4	Very low	32.5	Very low	99 Å²	99	104.9 Å²	104.9	52%	0.518	58%	0.582	S	S	.	*			trans	-112.2	115.9	178.6	-68.2	168.3	0	0	0	110.8
925	P	29.9	Very low	32.2	Very low	109 Å²	109	105.4 Å²	105.4	71%	0.708	59%	0.59	S	S	*	*			trans	-89.9	166.4	-177.7	35.3	-35.5	0	0	0	114.1
926	R	33.5	Very low	31.9	Very low	78 Å²	78	105.5 Å²	105.5	29%	0.294	59%	0.588	S	S	.	*			trans	-110.4	152.5	176.4	-162.6	178.8	-101.9	82.3	-1	111.5	D1001 P1002 L1003	R926-D1001 PolarHBondContact NE-O 2.66Å; R926-D1001 PolarHBondContact NH2-O 3.28Å; R926-P1002 WeakPolarHBondContact CD-O 3.05Å; R926-P1002 VanDerWaalsContact NE-C 3.31Å; R926-L1003 VanDerWaalsContact CB-O 3.3Å; R926-L1003 WeakPolarHBondContact CB-O 3.47Å; R926-L1003 WeakPolarHBondContact CD-O 3.12Å; R926-L1003 VanDerWaalsContact NH1-N 3.19Å; R926-L1003 PolarHBondContact NH1-O 3.23Å
927	A	28.3	Very low	31.9	Very low	99 Å²	99	103.4 Å²	103.4	82%	0.818	56%	0.56	S	S	*	*			trans	-73.3	144.1	-165	0	0	0	0	0	115.9
928	P	32.5	Very low	31.8	Very low	86 Å²	86	105.8 Å²	105.8	56%	0.558	59%	0.586	S	S	*	*			trans	-115.9	166.3	178	41	-32.9	0	0	0	116.3
929	E	27.7	Very low	31.4	Very low	187 Å²	187	106.2 Å²	106.2	87%	0.874	60%	0.597	S	S	*	*			trans	-94.8	166.4	176.1	-77.2	-179.7	160.2	0	0	113.5
930	P	26.6	Very low	31	Very low	126 Å²	126	103.8 Å²	103.8	82%	0.818	60%	0.595	S	S	*	*			trans	-91.1	147.1	-167.6	35.3	-35.6	0	0	0	115.8
931	V	26.2	Very low	30.5	Very low	116 Å²	116	108.5 Å²	108.5	70%	0.703	62%	0.616	S	S	*	*			trans	-144.2	148.8	173.7	-176.1	0	0	0	0	109.9	L1352	V931-L1352 HydrophobicContact CG2-CD2 4.18Å
932	S	25	Very low	29.9	Very low	115 Å²	115	109.6 Å²	109.6	80%	0.804	63%	0.63	S	S	*	*			trans	-95.4	159.2	179.3	55.1	0	0	0	0	113.6
933	T	26.7	Very low	29.5	Very low	138 Å²	138	114.5 Å²	114.5	85%	0.847	65%	0.645	S	S	*	*			trans	-142	136.2	-179.5	-60.4	0	0	0	0	111.8
934	L	26.7	Very low	28.9	Very low	152 Å²	152	111.5 Å²	111.5	80%	0.796	65%	0.645	S	S	*	*			trans	-100.2	139.1	169.5	-82.3	160.8	0	0	0	110.3	K936	L934-K936 PolarHBondContact O-N 3.29Å
935	L	28.8	Very low	28.8	Very low	138 Å²	138	110.3 Å²	110.3	72%	0.723	64%	0.639	S	S	*	*			trans	-64.2	132.1	177.4	-78.8	166.9	0	0	0	111.8
936	K	28.9	Very low	29	Very low	137 Å²	137	109 Å²	109	60%	0.596	63%	0.629	S	S	*	*			trans	-137.4	150.3	176	-74.7	179.4	164.4	-149.2	0	110.4	L934 G940 Q941	L934-K936 PolarHBondContact O-N 3.29Å; K936-G940 VanDerWaalsContact CD-O 3.24Å; K936-G940 WeakPolarHBondContact CD-O 3.47Å; K936-G940 VanDerWaalsContact CE-O 3.25Å; K936-G940 WeakPolarHBondContact CE-O 3.27Å; K936-G940 PolarHBondContact NZ-O 3Å; K936-G940 VanDerWaalsContact NZ-O 3.09Å; K936-Q941 CarbonylContact C-O 3.48Å; K936-Q941 VanDerWaalsContact CA-O 3.26Å; K936-Q941 WeakPolarHBondContact CA-O 3.41Å
937	T	31.8	Very low	29.3	Very low	30 Å²	30	108.2 Å²	108.2	18%	0.184	63%	0.63	C	S	.	*			trans	-60.3	166.5	166.7	57.8	0	0	0	0	111.3	S939 G940 Q941 Y943	T937-S939 PolarHBondContact O-N 3.08Å; T937-S939 PolarHBondContact OG1-N 2.87Å; T937-S939 PolarHBondContact OG1-OG 3.16Å; T937-G940 PolarHBondContact O-N 2.99Å; T937-G940 PolarHBondContact OG1-N 2.95Å; T937-Q941 WeakPolarHBondContact CG2-O 3.06Å; T937-Q941 PolarHBondContact N-O 3.43Å; T937-Q941 PolarHBondContact OG1-N 3.31Å; T937-Q941 PolarHBondContact OG1-O 2.95Å; T937-Y943 HydrophobicContact CG2-CD2 4.21Å; T937-Y943 HydrophobicContact CG2-CE2 3.95Å
938	P	29.3	Very low	29.7	Very low	143 Å²	143	108.8 Å²	108.8	93%	0.929	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.7	-18.4	166.4	-26.7	36.1	0	0	0	114.6
939	S	27	Very low	30.4	Very low	88 Å²	88	109 Å²	109	62%	0.615	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	-0.4	174	59.2	0	0	0	0	114.8	T937	T937-S939 PolarHBondContact O-N 3.08Å; T937-S939 PolarHBondContact OG1-N 2.87Å; T937-S939 PolarHBondContact OG1-OG 3.16Å
940	G	28.9	Very low	31.5	Very low	33 Å²	33	101.6 Å²	101.6	34%	0.34	59%	0.594	S	S	.	*	S	Bend	trans	86.3	10.5	176	0	0	0	0	0	116.5	K936 T937	K936-G940 VanDerWaalsContact CD-O 3.24Å; K936-G940 WeakPolarHBondContact CD-O 3.47Å; K936-G940 VanDerWaalsContact CE-O 3.25Å; K936-G940 WeakPolarHBondContact CE-O 3.27Å; K936-G940 PolarHBondContact NZ-O 3Å; K936-G940 VanDerWaalsContact NZ-O 3.09Å; T937-G940 PolarHBondContact O-N 2.99Å; T937-G940 PolarHBondContact OG1-N 2.95Å
941	Q	29.3	Very low	33	Very low	127 Å²	127	100 Å²	100	59%	0.593	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-98.7	153.2	179.1	-67	-179.2	-57.7	0	0	112.1	K936 T937	K936-Q941 CarbonylContact C-O 3.48Å; K936-Q941 VanDerWaalsContact CA-O 3.26Å; K936-Q941 WeakPolarHBondContact CA-O 3.41Å; T937-Q941 WeakPolarHBondContact CG2-O 3.06Å; T937-Q941 PolarHBondContact N-O 3.43Å; T937-Q941 PolarHBondContact OG1-N 3.31Å; T937-Q941 PolarHBondContact OG1-O 2.95Å
942	P	28.8	Very low	34.7	Very low	102 Å²	102	96 Å²	96	66%	0.662	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-77.8	151.8	173.4	32.6	-34.7	0	0	0	112.4
943	Y	30.6	Very low	36.6	Very low	148 Å²	148	91.1 Å²	91.1	58%	0.58	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-80	130	172.9	-83.3	-88.2	0	0	0	111.7	T937 M1029	T937-Y943 HydrophobicContact CG2-CD2 4.21Å; T937-Y943 HydrophobicContact CG2-CE2 3.95Å; Y943-M1029 HydrophobicContact CD1-CE 4.33Å; Y943-M1029 HydrophobicContact CG-CE 4.41Å
944	P	28.2	Very low	38.1	Very low	90 Å²	90	85 Å²	85	58%	0.584	47%	0.474	S	S	*	.	P	Polyproline II helix	trans	-80.5	149.7	164.5	33.2	-32.6	0	0	0	111.3
945	L	30.5	Very low	39.6	Very low	74 Å²	74	79.5 Å²	79.5	39%	0.387	44%	0.443	S	S	.	.			trans	-130	125.6	-178.9	-114.4	172.2	0	0	0	109.1	M1029	L945-M1029 HydrophobicContact CD1-SD 3.68Å; L945-M1029 HydrophobicContact CD2-SD 4.19Å; L945-M1029 HydrophobicContact CG-SD 3.87Å
946	V	34.1	Very low	40.9	Very low	82 Å²	82	73 Å²	73	50%	0.497	41%	0.41	S	S	.	.			trans	-111.7	122.6	-175.9	-179.2	0	0	0	0	109.9	Y978	V946-Y978 HydrophobicContact CG1-CD2 4.36Å
947	L	38.8	Very low	41.9	Very low	61 Å²	61	68.4 Å²	68.4	32%	0.319	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-103.8	134.3	171.6	-69.9	173.8	0	0	0	109.7	W952 F1102	L947-W952 HydrophobicContact CD2-CH2 3.93Å; L947-W952 HydrophobicContact CD2-CZ2 4.32Å; L947-W952 HydrophobicContact CD2-CZ3 4.28Å; L947-F1102 HydrophobicContact CD1-CE1 4.04Å; L947-F1102 HydrophobicContact CD1-CZ 4.21Å
948	N	38.3	Very low	42.7	Very low	112 Å²	112	67.1 Å²	67.1	60%	0.599	38%	0.381	S	S	*	.	P	Polyproline II helix	trans	-95	144	177.2	-71.6	-49.5	0	0	0	111.1	W952	N948-W952 VanDerWaalsContact O-CZ2 3.27Å; N948-W952 WeakPolarHBondContact O-CZ2 3.18Å; N948-W952 PolarHBondContact O-NE1 3.46Å; N948-W952 VanDerWaalsContact O-NE1 3.12Å
949	P	46.2	Very low	43.2	Very low	91 Å²	91	61.3 Å²	61.3	59%	0.591	35%	0.345	S	S	*	.	S	Bend	trans	-64.8	142.3	174.8	26.1	-33.6	0	0	0	112	I1098	P949-I1098 CarbonylContact C-O 3.27Å; P949-I1098 WeakPolarHBondContact CA-O 3.39Å; P949-I1098 WeakPolarHBondContact CB-O 3.33Å
950	G	50.1	Low	44	Very low	30 Å²	30	65.3 Å²	65.3	31%	0.309	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	153	-165.6	-177.6	0	0	0	0	0	114.1	D1097 I1098	G950-D1097 WeakPolarHBondContact O-CA 3.04Å; G950-I1098 PolarHBondContact N-O 2.64Å; G950-I1098 PolarHBondContact O-N 2.77Å
951	K	59.6	Low	44.5	Very low	94 Å²	94	67.4 Å²	67.4	41%	0.409	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	129.8	176.1	-74.5	-171	178.7	-65.9	0	112.9	A1095 F1096 D1097 L1126	K951-A1095 HydrophobicContact CD-CB 4.5Å; K951-F1096 CarbonylContact C-O 3.49Å; K951-F1096 WeakPolarHBondContact CA-O 3.45Å; K951-D1097 WeakPolarHBondContact CG-OD1 3.32Å; K951-D1097 IonicContact NZ-OD1 2.78Å; K951-D1097 IonicContact NZ-OD2 3.99Å; K951-D1097 PolarHBondContact NZ-OD2 3.19Å; K951-L1126 HydrophobicContact CB-CB 3.94Å; K951-L1126 HydrophobicContact CB-CD2 3.85Å; K951-L1126 HydrophobicContact CD-CD2 3.76Å; K951-L1126 HydrophobicContact CG-CD2 4.44Å; K951-L1126 WeakPolarHBondContact O-CB 3.32Å; K951-L1126 PolarHBondContact O-N 2.96Å
952	W	61.3	Low	44.5	Very low	31 Å²	31	69.1 Å²	69.1	12%	0.117	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	154.9	-179.8	-59.7	84.4	0	0	0	111	L947 N948 A1095 F1096 I1098 V1123 I1124 P1125	L947-W952 HydrophobicContact CD2-CH2 3.93Å; L947-W952 HydrophobicContact CD2-CZ2 4.32Å; L947-W952 HydrophobicContact CD2-CZ3 4.28Å; N948-W952 VanDerWaalsContact O-CZ2 3.27Å; N948-W952 WeakPolarHBondContact O-CZ2 3.18Å; N948-W952 PolarHBondContact O-NE1 3.46Å; N948-W952 VanDerWaalsContact O-NE1 3.12Å; W952-A1095 WeakPolarHBondContact O-CA 3.34Å; W952-F1096 PolarHBondContact N-O 3.41Å; W952-F1096 PolarHBondContact O-N 3.32Å; W952-I1098 HydrophobicContact CB-CD1 4.18Å; W952-I1098 HydrophobicContact CG-CD1 3.94Å; W952-I1098 HydrophobicContact CG-CG1 4.48Å; W952-V1123 HydrophobicContact CB-CG1 4Å; W952-V1123 HydrophobicContact CD2-CG1 4.07Å; W952-V1123 HydrophobicContact CE3-CG1 3.72Å; W952-V1123 HydrophobicContact CG-CG1 4.2Å; W952-V1123 HydrophobicContact CZ3-CG1 4.49Å; W952-I1124 CarbonylContact C-O 3.5Å; W952-I1124 VanDerWaalsContact CA-O 3.26Å; W952-I1124 WeakPolarHBondContact CA-O 3.4Å; W952-I1124 VanDerWaalsContact CE3-C 3.47Å; W952-P1125 HydrophobicContact CE3-CB 4.28Å; W952-P1125 HydrophobicContact CE3-CG 4Å; W952-P1125 VanDerWaalsContact CE3-N 3.32Å; W952-P1125 HydrophobicContact CH2-CG 4.03Å; W952-P1125 HydrophobicContact CZ3-CB 4.23Å; W952-P1125 HydrophobicContact CZ3-CG 3.53Å
953	M	64.4	Low	44.5	Very low	12 Å²	12	67.7 Å²	67.7	6%	0.059	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	149.5	165.9	-52.7	-154.6	-35.6	0	0	111	A1094 I1124 L1126 Y1129	M953-A1094 WeakPolarHBondContact CA-O 3.45Å; M953-A1094 WeakPolarHBondContact CB-O 3.24Å; M953-A1094 HydrophobicContact CG-CB 4.5Å; M953-A1094 WeakPolarHBondContact CG-O 3.32Å; M953-A1094 HydrophobicContact SD-CB 3.77Å; M953-I1124 PolarHBondContact N-O 3.08Å; M953-I1124 PolarHBondContact O-N 3.45Å; M953-L1126 HydrophobicContact CG-CD1 3.75Å; M953-L1126 HydrophobicContact SD-CD1 3.92Å; M953-Y1129 HydrophobicContact CE-CD1 3.91Å; M953-Y1129 HydrophobicContact CE-CD2 3.21Å; M953-Y1129 HydrophobicContact CE-CE1 4.18Å; M953-Y1129 HydrophobicContact CE-CE2 3.51Å; M953-Y1129 HydrophobicContact CE-CG 3.43Å; M953-Y1129 VanDerWaalsContact CE-CG 3.43Å; M953-Y1129 HydrophobicContact SD-CD1 4.33Å; M953-Y1129 HydrophobicContact SD-CG 4.22Å
954	L	59.6	Low	44.4	Very low	11 Å²	11	63.9 Å²	63.9	6%	0.058	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	117.9	178.5	-62.5	175.6	0	0	0	110.2	A1085 F1096 L1104 L1121 F1122 V1123	L954-A1085 HydrophobicContact CB-CB 3.96Å; L954-A1085 PolarHBondContact O-N 2.94Å; L954-F1096 HydrophobicContact CB-CD2 4.46Å; L954-F1096 HydrophobicContact CB-CE2 4.15Å; L954-F1096 HydrophobicContact CD1-CD2 3.95Å; L954-F1096 HydrophobicContact CD1-CE2 3.99Å; L954-F1096 HydrophobicContact CD1-CG 4.45Å; L954-F1096 HydrophobicContact CG-CD2 3.86Å; L954-F1096 HydrophobicContact CG-CE2 4Å; L954-L1104 HydrophobicContact CD1-CD1 4.4Å; L954-L1121 HydrophobicContact CB-CD1 4.43Å; L954-L1121 HydrophobicContact CD2-CD2 4.2Å; L954-L1121 HydrophobicContact CD2-CG 4.4Å; L954-F1122 WeakPolarHBondContact CA-O 3.03Å; L954-V1123 HydrophobicContact CD2-CB 4.33Å; L954-V1123 HydrophobicContact CD2-CG1 4.01Å; L954-V1123 HydrophobicContact CD2-CG2 3.85Å
955	K	57.6	Low	44.4	Very low	35 Å²	35	64 Å²	64	15%	0.152	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	120	175.1	-179	-179.7	-176.2	176	0	109.6	S1083 F1122 I1124 L1133	K955-S1083 CarbonylContact C-O 3.44Å; K955-S1083 WeakPolarHBondContact CA-O 3.36Å; K955-F1122 HydrophobicContact CB-CB 3.84Å; K955-F1122 PolarHBondContact N-O 2.88Å; K955-F1122 PolarHBondContact O-N 3.29Å; K955-I1124 HydrophobicContact CB-CD1 4.31Å; K955-I1124 HydrophobicContact CD-CD1 4.39Å; K955-L1133 PolarHBondContact NZ-O 3.34Å
956	V	55.9	Low	44.5	Very low	3 Å²	3	65.9 Å²	65.9	2%	0.018	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	133.9	-177.3	179	0	0	0	0	110	T958 I1049 A1070 L1072 R1082 S1083 L1118 L1121	V956-T958 HydrophobicContact CG1-CG2 4.01Å; V956-I1049 HydrophobicContact CG1-CD1 3.68Å; V956-A1070 HydrophobicContact CG2-CB 3.78Å; V956-L1072 HydrophobicContact CG1-CD2 4.41Å; V956-R1082 WeakPolarHBondContact O-CA 3.41Å; V956-S1083 PolarHBondContact N-O 3.24Å; V956-S1083 PolarHBondContact O-N 3.25Å; V956-L1118 HydrophobicContact CG1-CD1 3.76Å; V956-L1121 HydrophobicContact CG2-CD1 3.98Å
957	K	50.3	Low	44.4	Very low	39 Å²	39	65.9 Å²	65.9	17%	0.17	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	141.3	157.1	-172.4	-170.6	168.7	-153.5	0	109.4	S1079 C1081 R1082 D1119 Y1120	K957-S1079 WeakPolarHBondContact CE-O 3.32Å; K957-C1081 CarbonylContact C-O 3.57Å; K957-C1081 VanDerWaalsContact CA-O 3.24Å; K957-C1081 WeakPolarHBondContact CA-O 3.42Å; K957-R1082 HydrophobicContact CG-CG 4.36Å; K957-D1119 HydrophobicContact CB-CB 4.28Å; K957-D1119 HydrophobicContact CD-CB 4.18Å; K957-D1119 VanDerWaalsContact CD-OD2 3.24Å; K957-D1119 WeakPolarHBondContact CD-OD2 3.44Å; K957-D1119 WeakPolarHBondContact CE-OD2 3.36Å; K957-D1119 HydrophobicContact CG-CB 4.06Å; K957-D1119 IonicContact NZ-OD2 3.81Å; K957-D1119 PolarHBondContact NZ-OD2 3.2Å; K957-D1119 PolarHBondContact O-N 3.34Å; K957-Y1120 HydrophobicContact CB-CD1 4.44Å; K957-Y1120 HydrophobicContact CB-CD2 4Å; K957-Y1120 HydrophobicContact CB-CE1 4.28Å; K957-Y1120 HydrophobicContact CB-CE2 3.8Å; K957-Y1120 HydrophobicContact CB-CG 4.32Å; K957-Y1120 HydrophobicContact CD-CD1 3.94Å; K957-Y1120 HydrophobicContact CD-CE1 3.31Å; K957-Y1120 HydrophobicContact CD-CE2 4.21Å; K957-Y1120 VanDerWaalsContact CD-CZ 3.46Å; K957-Y1120 HydrophobicContact CG-CE1 4.42Å; K957-Y1120 PolarHBondContact N-O 2.03Å; K957-Y1120 PolarHBondContact O-N 2.04Å
958	T	47.9	Very low	44.3	Very low	3 Å²	3	66.7 Å²	66.7	2%	0.018	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	155.8	177.8	70.7	0	0	0	0	112.8	V956 L1072 G1080 C1081 T1116 Y1117	V956-T958 HydrophobicContact CG1-CG2 4.01Å; T958-L1072 HydrophobicContact CG2-CD1 3.96Å; T958-L1072 HydrophobicContact CG2-CD2 4.08Å; T958-G1080 WeakPolarHBondContact O-CA 3.47Å; T958-C1081 HydrophobicContact CG2-CB 4.16Å; T958-C1081 PolarHBondContact N-O 2.88Å; T958-C1081 WeakPolarHBondContact OG1-CB 3.49Å; T958-C1081 PolarHBondContact OG1-N 3.37Å; T958-C1081 PolarHBondContact OG1-SG 3.11Å; T958-C1081 VanDerWaalsContact OG1-SG 3.38Å; T958-T1116 HydrophobicContact CG2-CG2 3.95Å; T958-Y1117 CarbonylContact C-O 3.53Å; T958-Y1117 VanDerWaalsContact CA-O 3.32Å; T958-Y1117 WeakPolarHBondContact CA-O 3.44Å; T958-Y1117 VanDerWaalsContact CB-O 3.27Å; T958-Y1117 WeakPolarHBondContact CB-O 3.2Å
959	A	40.5	Very low	44.1	Very low	21 Å²	21	67.1 Å²	67.1	17%	0.174	33%	0.333	C	S	.	.			trans	-109.4	-166.5	-172	0	0	0	0	0	112.6	Y1117 D1119	A959-Y1117 HydrophobicContact CB-CD2 4.39Å; A959-Y1117 PolarHBondContact N-O 3.35Å; A959-Y1117 WeakPolarHBondContact O-CD2 3.1Å; A959-D1119 HydrophobicContact CB-CB 3.82Å; A959-D1119 WeakPolarHBondContact CB-OD1 2.11Å
960	R	42.7	Very low	43.7	Very low	173 Å²	173	64 Å²	64	65%	0.653	31%	0.31	S	S	*	.	S	Bend	trans	-104.4	13.8	177	-114	-179.5	177.8	165.5	3.3	116.1	S1077 Y1117	R960-S1077 PolarHBondContact NH1-O 3.15Å; R960-S1077 VanDerWaalsContact NH1-O 3.11Å; R960-S1077 PolarHBondContact NH2-O 3.1Å; R960-S1077 VanDerWaalsContact NH2-O 3.14Å; R960-Y1117 VanDerWaalsContact C-CD2 3.45Å; R960-Y1117 VanDerWaalsContact O-CE2 3.29Å; R960-Y1117 WeakPolarHBondContact O-CE2 2.12Å
961	R	40.8	Very low	43	Very low	76 Å²	76	64.3 Å²	64.3	29%	0.287	31%	0.305	S	S	.	.			trans	-86.3	0	164.3	-62.1	-179.8	-171.9	115.1	2	126.6	I1033 S1035 T1115 T1116 Y1117	R961-I1033 VanDerWaalsContact CZ-O 3.26Å; R961-I1033 PolarHBondContact NH1-O 2.82Å; R961-I1033 PolarHBondContact NH2-O 3.01Å; R961-S1035 PolarHBondContact NH2-OG 3.42Å; R961-T1115 CarbonylContact O-C 3.51Å; R961-T1116 PolarHBondContact O-N 3.49Å; R961-Y1117 VanDerWaalsContact CA-CZ 3.48Å; R961-Y1117 HydrophobicContact CB-CD1 4.12Å; R961-Y1117 HydrophobicContact CB-CD2 3.37Å; R961-Y1117 HydrophobicContact CB-CE2 4.2Å; R961-Y1117 HydrophobicContact CB-CG 3.27Å; R961-Y1117 WeakPolarHBondContact O-CB 2.13Å; R961-Y1117 WeakPolarHBondContact O-CD1 2.12Å; R961-Y1117 WeakPolarHBondContact O-CD2 3.27Å; R961-Y1117 WeakPolarHBondContact O-CE1 3.32Å; R961-Y1117 WeakPolarHBondContact O-CE2 3.29Å; R961-Y1117 PolarHBondContact O-N 2.99Å; R961-Y1117 PolarHBondContact O-OH 3.21Å
962	F	28.6	Very low	41.6	Very low	164 Å²	164	60.8 Å²	60.8	72%	0.719	30%	0.296	S	S	*	.				0	126.7	0	-77.6	-85.6	0	0	0	114.4	Y966 Y1117	F962-Y966 PolarHBondContact O-OH 2.83Å; F962-Y966 VanDerWaalsContact O-OH 3.14Å; F962-Y1117 HydrophobicContact CB-CE1 4.13Å; F962-Y1117 HydrophobicContact CG-CE1 4.49Å; F962-Y1117 WeakPolarHBondContact O-CD1 3.24Å
963	F	29.4	Very low	40	Very low	72 Å²	72	63.8 Å²	63.8	32%	0.316	31%	0.313	S	S	.	.			trans	-116.3	130.6	-161.4	-136.9	-76.9	0	0	0	112.4	Y966 Y1117	F963-Y966 HydrophobicContact CD1-CD2 4.03Å; F963-Y966 AromaticContact CD1-CE2 3.68Å; F963-Y966 HydrophobicContact CD1-CE2 3.68Å; F963-Y966 HydrophobicContact CD2-CE2 4.07Å; F963-Y966 AromaticContact CE1-CD2 3.44Å; F963-Y966 HydrophobicContact CE1-CD2 3.44Å; F963-Y966 VanDerWaalsContact CE1-CD2 3.44Å; F963-Y966 AromaticContact CE1-CE2 3.56Å; F963-Y966 HydrophobicContact CE1-CE2 3.56Å; F963-Y966 HydrophobicContact CE1-CG 4.39Å; F963-Y966 HydrophobicContact CE2-CD2 4.25Å; F963-Y966 AromaticContact CE2-CE2 3.96Å; F963-Y966 HydrophobicContact CE2-CE2 3.96Å; F963-Y966 AromaticContact CG-CE2 3.92Å; F963-Y966 HydrophobicContact CG-CE2 3.92Å; F963-Y966 AromaticContact CZ-CD2 3.57Å; F963-Y966 HydrophobicContact CZ-CD2 3.57Å; F963-Y966 AromaticContact CZ-CE2 3.7Å; F963-Y966 HydrophobicContact CZ-CE2 3.7Å; F963-Y1117 HydrophobicContact CB-CD1 3.54Å; F963-Y1117 HydrophobicContact CB-CE1 4.32Å; F963-Y1117 AromaticContact CD2-CD1 3.57Å; F963-Y1117 HydrophobicContact CD2-CD1 3.57Å; F963-Y1117 HydrophobicContact CD2-CG 4.38Å; F963-Y1117 AromaticContact CG-CD1 3.97Å; F963-Y1117 HydrophobicContact CG-CD1 3.97Å
964	L	27.1	Very low	38.3	Very low	67 Å²	67	67.5 Å²	67.5	35%	0.351	34%	0.34	S	S	.	.			trans	-119	150.1	148.8	-78.6	172.1	0	0	0	106.3	Y966 F987	L964-Y966 VanDerWaalsContact O-CD1 3.31Å; L964-Y966 WeakPolarHBondContact O-CD1 3.47Å; L964-Y966 WeakPolarHBondContact O-CD2 3.38Å; L964-Y966 WeakPolarHBondContact O-CE1 3.46Å; L964-Y966 WeakPolarHBondContact O-CE2 3.32Å; L964-Y966 PolarHBondContact O-N 3.06Å; L964-F987 HydrophobicContact CD2-CB 4.11Å
965	A	28.5	Very low	36.8	Very low	93 Å²	93	73.7 Å²	73.7	77%	0.769	38%	0.381	S	S	*	.			trans	-60.7	127.1	-170.8	0	0	0	0	0	112.1
966	Y	32.8	Very low	35.4	Very low	114 Å²	114	74.5 Å²	74.5	45%	0.447	40%	0.4	S	S	.	.			trans	-107.8	125.2	-178.7	-45.4	-68	0	0	0	110.9	F962 F963 L964	F962-Y966 PolarHBondContact O-OH 2.83Å; F962-Y966 VanDerWaalsContact O-OH 3.14Å; F963-Y966 HydrophobicContact CD1-CD2 4.03Å; F963-Y966 AromaticContact CD1-CE2 3.68Å; F963-Y966 HydrophobicContact CD1-CE2 3.68Å; F963-Y966 HydrophobicContact CD2-CE2 4.07Å; F963-Y966 AromaticContact CE1-CD2 3.44Å; F963-Y966 HydrophobicContact CE1-CD2 3.44Å; F963-Y966 VanDerWaalsContact CE1-CD2 3.44Å; F963-Y966 AromaticContact CE1-CE2 3.56Å; F963-Y966 HydrophobicContact CE1-CE2 3.56Å; F963-Y966 HydrophobicContact CE1-CG 4.39Å; F963-Y966 HydrophobicContact CE2-CD2 4.25Å; F963-Y966 AromaticContact CE2-CE2 3.96Å; F963-Y966 HydrophobicContact CE2-CE2 3.96Å; F963-Y966 AromaticContact CG-CE2 3.92Å; F963-Y966 HydrophobicContact CG-CE2 3.92Å; F963-Y966 AromaticContact CZ-CD2 3.57Å; F963-Y966 HydrophobicContact CZ-CD2 3.57Å; F963-Y966 AromaticContact CZ-CE2 3.7Å; F963-Y966 HydrophobicContact CZ-CE2 3.7Å; L964-Y966 VanDerWaalsContact O-CD1 3.31Å; L964-Y966 WeakPolarHBondContact O-CD1 3.47Å; L964-Y966 WeakPolarHBondContact O-CD2 3.38Å; L964-Y966 WeakPolarHBondContact O-CE1 3.46Å; L964-Y966 WeakPolarHBondContact O-CE2 3.32Å; L964-Y966 PolarHBondContact O-N 3.06Å
967	T	32.9	Very low	33.9	Very low	82 Å²	82	79.2 Å²	79.2	50%	0.503	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	118.2	168.5	-57.1	0	0	0	0	108.4
968	L	34.9	Very low	33.1	Very low	77 Å²	77	80.6 Å²	80.6	40%	0.403	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	96.7	-176.8	-159.3	139.6	0	0	0	110	I970 L1104	L968-I970 HydrophobicContact CD2-CD1 4.25Å; L968-I970 HydrophobicContact CD2-CG1 4.3Å; L968-L1104 PolarHBondContact O-N 3.14Å; L968-L1104 VanDerWaalsContact O-N 3.13Å
969	R	36	Very low	32.1	Very low	122 Å²	122	83.1 Å²	83.1	46%	0.46	45%	0.445	S	S	.	.			trans	-97.2	137.4	-169.8	179.9	177.8	172.2	92	18.5	112.1	D971 D1103	R969-D971 IonicContact CZ-OD1 2.76Å; R969-D971 IonicContact CZ-OD2 3.47Å; R969-D971 VanDerWaalsContact CZ-OD2 3.22Å; R969-D971 IonicContact NE-OD2 3.67Å; R969-D971 PolarHBondContact NE-OD2 3.11Å; R969-D971 VanDerWaalsContact NH2-CG 3.34Å; R969-D971 IonicContact NH2-OD1 2.94Å; R969-D971 PolarHBondContact NH2-OD1 3.09Å; R969-D971 IonicContact NH2-OD2 2.7Å; R969-D971 PolarHBondContact NH2-OD2 3.17Å; R969-D1103 VanDerWaalsContact CA-OD1 3.24Å; R969-D1103 WeakPolarHBondContact CA-OD1 3.12Å; R969-D1103 WeakPolarHBondContact CG-OD1 3.14Å
970	I	37.8	Very low	31.6	Very low	24 Å²	24	86.1 Å²	86.1	12%	0.123	46%	0.457	C	S	.	.			trans	-127.2	88.6	-174.6	-54.4	177.6	0	0	0	111.1	L968 F1102 D1103	L968-I970 HydrophobicContact CD2-CD1 4.25Å; L968-I970 HydrophobicContact CD2-CG1 4.3Å; I970-F1102 HydrophobicContact CD1-CD1 4.39Å; I970-F1102 HydrophobicContact CD1-CD2 4.45Å; I970-F1102 HydrophobicContact CD1-CE1 3.73Å; I970-F1102 HydrophobicContact CD1-CE2 3.8Å; I970-F1102 HydrophobicContact CD1-CZ 3.4Å; I970-F1102 VanDerWaalsContact CD1-CZ 3.4Å; I970-D1103 PolarHBondContact N-OD1 2.79Å; I970-D1103 VanDerWaalsContact N-OD1 3.1Å
971	D	33.5	Very low	31	Very low	37 Å²	37	82.3 Å²	82.3	20%	0.198	45%	0.449	C	S	.	.			trans	-87.7	108.9	179.5	-88.6	-52.2	0	0	0	113.3	R969 K1101	R969-D971 IonicContact CZ-OD1 2.76Å; R969-D971 IonicContact CZ-OD2 3.47Å; R969-D971 VanDerWaalsContact CZ-OD2 3.22Å; R969-D971 IonicContact NE-OD2 3.67Å; R969-D971 PolarHBondContact NE-OD2 3.11Å; R969-D971 VanDerWaalsContact NH2-CG 3.34Å; R969-D971 IonicContact NH2-OD1 2.94Å; R969-D971 PolarHBondContact NH2-OD1 3.09Å; R969-D971 IonicContact NH2-OD2 2.7Å; R969-D971 PolarHBondContact NH2-OD2 3.17Å; D971-K1101 IonicContact OD1-NZ 2.77Å; D971-K1101 PolarHBondContact OD1-NZ 2.03Å
972	G	30.9	Very low	30.4	Very low	21 Å²	21	82.8 Å²	82.8	22%	0.216	46%	0.461	C	S	.	.	B	Isolated β-bridge	trans	-69.7	132.9	166	0	0	0	0	0	112.9
973	I	28.3	Very low	30.2	Very low	93 Å²	93	78.9 Å²	78.9	48%	0.477	45%	0.454	S	S	.	.			trans	-118.9	91.9	-176.9	-52.3	179.2	0	0	0	109.9	N977	I973-N977 CarbonylContact C-O 3.57Å; I973-N977 PolarHBondContact N-O 2.93Å
974	S	28.5	Very low	30.1	Very low	90 Å²	90	83.4 Å²	83.4	63%	0.629	47%	0.47	S	S	*	.	S	Bend	trans	67	159.6	-178.9	85.7	0	0	0	0	114.5	G976	S974-G976 PolarHBondContact O-N 2.81Å
975	P	27.2	Very low	30	Very low	141 Å²	141	87.2 Å²	87.2	92%	0.916	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	101.7	-171.3	28.8	-33.5	0	0	0	111.3
976	G	29.2	Very low	29.9	Very low	53 Å²	53	88.5 Å²	88.5	55%	0.546	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	138	-22.4	174.1	0	0	0	0	0	115	S974	S974-G976 PolarHBondContact O-N 2.81Å
977	N	25	Very low	29.4	Very low	101 Å²	101	89.2 Å²	89.2	54%	0.54	49%	0.485	S	S	.	.			trans	-127.7	106.6	-177	-77	-45.4	0	0	0	112	I973	I973-N977 CarbonylContact C-O 3.57Å; I973-N977 PolarHBondContact N-O 2.93Å
978	Y	33.3	Very low	29.2	Very low	69 Å²	69	93.4 Å²	93.4	27%	0.271	50%	0.499	S	S	.	.	B	Isolated β-bridge	trans	-91.7	136.8	168.4	-61	-90.4	0	0	0	109.3	V946 D1100	V946-Y978 HydrophobicContact CG1-CD2 4.36Å; Y978-D1100 PolarHBondContact OH-OD1 2.98Å
979	T	27	Very low	28.9	Very low	56 Å²	56	95 Å²	95	34%	0.344	52%	0.515	S	S	.	.			trans	-126.9	124.2	-175.6	-56.3	0	0	0	0	109.9	L981	T979-L981 PolarHBondContact O-N 3.41Å
980	L	30.1	Very low	28.4	Very low	83 Å²	83	96 Å²	96	44%	0.435	53%	0.529	S	S	.	.			trans	-77.5	112.5	178.8	-162.3	81.7	0	0	0	110.5	V982	L980-V982 HydrophobicContact CD2-CG2 4.23Å
981	L	28.3	Very low	27.8	Very low	93 Å²	93	103 Å²	103	49%	0.487	56%	0.563	S	S	.	*			trans	-111	91.5	179.5	-82.1	169	0	0	0	111.1	T979 S983	T979-L981 PolarHBondContact O-N 3.41Å; L981-S983 PolarHBondContact O-N 2.81Å
982	V	28.2	Very low	27.5	Very low	86 Å²	86	107.9 Å²	107.9	52%	0.521	59%	0.594	S	S	.	*			trans	-76.4	105.5	174	-176	0	0	0	0	109.6	L980 Y984	L980-V982 HydrophobicContact CD2-CG2 4.23Å; V982-Y984 HydrophobicContact CB-CE2 4.42Å; V982-Y984 HydrophobicContact CG1-CD2 4.24Å; V982-Y984 HydrophobicContact CG1-CE2 3.69Å
983	S	25.7	Very low	27.3	Very low	83 Å²	83	112.9 Å²	112.9	58%	0.58	62%	0.623	S	S	*	*			trans	-88.4	127.7	175.5	-173.6	0	0	0	0	110.8	L981	L981-S983 PolarHBondContact O-N 2.81Å
984	Y	26.5	Very low	27.1	Very low	167 Å²	167	112.7 Å²	112.7	66%	0.655	64%	0.635	S	S	*	*			trans	-105.8	131.1	174.1	-68.9	-93	0	0	0	110.1	V982	V982-Y984 HydrophobicContact CB-CE2 4.42Å; V982-Y984 HydrophobicContact CG1-CD2 4.24Å; V982-Y984 HydrophobicContact CG1-CE2 3.69Å
985	Q	24.6	Very low	26.9	Very low	147 Å²	147	116.2 Å²	116.2	69%	0.687	65%	0.647	S	S	*	*			trans	-122.8	114.8	166.2	-71.8	-170.5	-12.9	0	0	109.5
986	N	26.8	Very low	26.9	Very low	120 Å²	120	116.5 Å²	116.5	64%	0.642	65%	0.646	S	S	*	*			trans	-95.4	132.2	175.9	-75.9	-9.4	0	0	0	110.6
987	F	23.6	Very low	27	Very low	128 Å²	128	123.2 Å²	123.2	56%	0.561	66%	0.66	S	S	*	*			trans	-113.9	119.5	162.1	-88.6	-102.4	0	0	0	107.7	L964 V1490	L964-F987 HydrophobicContact CD2-CB 4.11Å; F987-V1490 HydrophobicContact CD1-CB 4.47Å; F987-V1490 HydrophobicContact CD1-CG2 3.81Å; F987-V1490 HydrophobicContact CE1-CB 4.34Å; F987-V1490 HydrophobicContact CE1-CG2 3.99Å
988	E	28.7	Very low	27.4	Very low	170 Å²	170	123.3 Å²	123.3	79%	0.794	67%	0.666	S	S	*	*			trans	-91.9	150.5	174.6	-64.2	-165	152.7	0	0	112.3
989	P	27.8	Very low	27	Very low	112 Å²	112	127 Å²	127	73%	0.727	69%	0.69	S	S	*	*			trans	-147.6	117.5	135.5	32	-12.9	0	0	0	116.2
990	N	26.1	Very low	27	Very low	142 Å²	142	131.9 Å²	131.9	76%	0.759	71%	0.714	S	S	*	*				69.7	140.2	121.2	-70.4	-45	0	0	0	124.8
991	M	25.1	Very low	26.8	Very low	172 Å²	172	134.1 Å²	134.1	85%	0.847	73%	0.727	S	S	*	*			trans	76	112.2	149.1	-71	174.7	-176.1	0	0	122.2
992	V	26.8	Very low	27.1	Very low	138 Å²	138	134.2 Å²	134.2	84%	0.836	73%	0.733	S	S	*	*				-179.8	143.2	108.5	147.7	0	0	0	0	110.2
993	P	26	Very low	26.9	Very low	126 Å²	126	134.4 Å²	134.4	82%	0.818	73%	0.731	S	S	*	*			trans	-98.5	177.9	-165.3	38.7	-37.8	0	0	0	116.6
994	A	25.9	Very low	26.8	Very low	90 Å²	90	134 Å²	134	74%	0.744	73%	0.727	S	S	*	*			trans	-89	151.7	-171.9	0	0	0	0	0	115.8
995	D	24.1	Very low	26.7	Very low	164 Å²	164	130.1 Å²	130.1	88%	0.877	73%	0.725	S	S	*	*			trans	178.1	86.6	138.5	-104.4	-22.1	0	0	0	113.4
996	V	26.9	Very low	26.7	Very low	146 Å²	146	124.5 Å²	124.5	89%	0.885	71%	0.707	S	S	*	*			trans	-149.3	136.6	159.3	-171.6	0	0	0	0	111.6
997	K	31.5	Very low	26.6	Very low	194 Å²	194	122.6 Å²	122.6	84%	0.843	70%	0.703	S	S	*	*			trans	-135.1	163.3	159.8	-76.7	-173	176.3	-178.1	0	107
998	P	32.5	Very low	26.6	Very low	103 Å²	103	123.1 Å²	123.1	67%	0.669	71%	0.71	S	S	*	*			cis	-143.3	-164.9	22.1	40.3	-17.8	0	0	0	116.4
999	D	24.7	Very low	26.4	Very low	147 Å²	147	119.6 Å²	119.6	79%	0.786	70%	0.696	S	S	*	*			trans	81.6	152.4	154.5	-57.1	-23	0	0	0	122.8
1000	D	26.4	Very low	26.2	Very low	158 Å²	158	123.1 Å²	123.1	85%	0.845	70%	0.7	S	S	*	*			trans	68.7	94.4	171.5	-63.1	-11.8	0	0	0	123.5
1001	D	26.5	Very low	26	Very low	130 Å²	130	123 Å²	123	70%	0.695	70%	0.695	S	S	*	*			trans	61.7	141.8	143.3	-89.5	-7.4	0	0	0	125.3	R926	R926-D1001 PolarHBondContact NE-O 2.66Å; R926-D1001 PolarHBondContact NH2-O 3.28Å
1002	P	34.2	Very low	26	Very low	95 Å²	95	123.2 Å²	123.2	62%	0.617	69%	0.693	S	S	*	*			trans	-122.9	-24	-133.8	16.1	7.5	0	0	0	120.5	R926 S1004	R926-P1002 WeakPolarHBondContact CD-O 3.05Å; R926-P1002 VanDerWaalsContact NE-C 3.31Å; P1002-S1004 PolarHBondContact O-N 2.84Å
1003	L	24.4	Very low	25.8	Very low	91 Å²	91	122.9 Å²	122.9	48%	0.476	70%	0.696	S	S	.	*			trans	-80.2	117.4	-154.3	-70.3	129.8	0	0	0	118.8	R926	R926-L1003 VanDerWaalsContact CB-O 3.3Å; R926-L1003 WeakPolarHBondContact CB-O 3.47Å; R926-L1003 WeakPolarHBondContact CD-O 3.12Å; R926-L1003 VanDerWaalsContact NH1-N 3.19Å; R926-L1003 PolarHBondContact NH1-O 3.23Å
1004	S	24.1	Very low	25.8	Very low	73 Å²	73	119.4 Å²	119.4	51%	0.51	67%	0.673	S	S	.	*			trans	52.7	130.3	132.8	67.8	0	0	0	0	124.6	P1002	P1002-S1004 PolarHBondContact O-N 2.84Å
1005	S	24	Very low	25.8	Very low	86 Å²	86	123.5 Å²	123.5	60%	0.601	67%	0.67	S	S	*	*				63.5	131.4	129.9	67.5	0	0	0	0	122.8
1006	G	24.5	Very low	25.8	Very low	30 Å²	30	119 Å²	119	31%	0.309	65%	0.652	S	S	.	*			trans	152.7	81.4	166.7	0	0	0	0	0	110.8
1007	S	24.6	Very low	25.6	Very low	80 Å²	80	115.1 Å²	115.1	56%	0.559	63%	0.63	S	S	*	*				51.1	70.5	92.3	-58.2	0	0	0	0	113.3	I1009	S1007-I1009 VanDerWaalsContact C-N 3.29Å; S1007-I1009 PolarHBondContact O-N 2.04Å
1008	I	23.6	Very low	25.3	Very low	139 Å²	139	114.1 Å²	114.1	71%	0.713	63%	0.626	S	S	*	*			trans	-78.4	84.4	168.5	-53.6	176.6	0	0	0	108
1009	I	24.1	Very low	24.9	Very low	96 Å²	96	112.3 Å²	112.3	49%	0.492	63%	0.626	S	S	.	*			trans	-114.7	127.4	167.4	-56.5	179.2	0	0	0	106	S1007 E1011	S1007-I1009 VanDerWaalsContact C-N 3.29Å; S1007-I1009 PolarHBondContact O-N 2.04Å; I1009-E1011 HydrophobicContact CG2-CB 4.31Å; I1009-E1011 HydrophobicContact CG2-CG 3.81Å; I1009-E1011 PolarHBondContact O-N 3.4Å
1010	F	23.9	Very low	24.8	Very low	185 Å²	185	111.8 Å²	111.8	81%	0.811	62%	0.615	S	S	*	*			trans	-75.8	69.4	-179.8	-80.7	-95.1	0	0	0	110.8
1011	E	23	Very low	24.7	Very low	139 Å²	139	109.3 Å²	109.3	65%	0.65	61%	0.61	S	S	*	*			trans	-118.3	138	-179.3	-88.8	175.5	-160.8	0	0	111.5	I1009	I1009-E1011 HydrophobicContact CG2-CB 4.31Å; I1009-E1011 HydrophobicContact CG2-CG 3.81Å; I1009-E1011 PolarHBondContact O-N 3.4Å
1012	H	23.5	Very low	24.7	Very low	177 Å²	177	112.3 Å²	112.3	82%	0.819	62%	0.617	S	S	*	*			trans	67.7	91.3	176.3	-58.7	75	0	0	0	116.9
1013	C	23.5	Very low	24.2	Very low	132 Å²	132	114.7 Å²	114.7	89%	0.892	62%	0.623	S	S	*	*			trans	-132.3	134.5	148.4	-151.9	0	0	0	0	108.7
1014	P	26.8	Very low	24.3	Very low	52 Å²	52	115.5 Å²	115.5	34%	0.338	63%	0.634	S	S	.	*			trans	-119.3	155.8	-142.6	1.8	24.7	0	0	0	116.6	Q918	Q918-P1014 VanDerWaalsContact OE1-CB 3.26Å; Q918-P1014 VanDerWaalsContact OE1-CG 3.25Å
1015	Y	25.1	Very low	24.3	Very low	176 Å²	176	117.5 Å²	117.5	69%	0.69	64%	0.638	S	S	*	*			trans	50.6	129.2	158.8	-69.7	-75.8	0	0	0	121.9	Q918	Q918-Y1015 HydrophobicContact CG-CD2 4.48Å
1016	S	24.1	Very low	24.4	Very low	69 Å²	69	117.5 Å²	117.5	48%	0.483	64%	0.636	S	S	.	*			trans	57.1	114.2	152.5	63.9	0	0	0	0	119.7
1017	C	23.1	Very low	24.4	Very low	65 Å²	65	121.9 Å²	121.9	44%	0.439	65%	0.649	S	S	.	*				-160.6	179.1	115.3	-125.9	0	0	0	0	115.3	D1177 F1178	C1017-D1177 PolarHBondContact SG-O 2.71Å; C1017-F1178 PolarHBondContact SG-O 2.69Å
1018	F	24.4	Very low	24.5	Very low	173 Å²	173	120.7 Å²	120.7	76%	0.759	64%	0.64	S	S	*	*			trans	-78.5	154.6	-164.3	-78.7	-107	0	0	0	114.4	A1180	F1018-A1180 HydrophobicContact CD2-CB 3.84Å; F1018-A1180 HydrophobicContact CE2-CB 4.19Å
1019	G	24.1	Very low	24.5	Very low	65 Å²	65	119.2 Å²	119.2	67%	0.67	63%	0.632	S	S	*	*			trans	-95	160.2	-161.6	0	0	0	0	0	117.7
1020	Y	24.2	Very low	24.6	Very low	137 Å²	137	119.6 Å²	119.6	54%	0.537	63%	0.634	S	S	.	*			trans	-131.2	156.1	157.8	-79	-71.6	0	0	0	111.2	Y831	Y831-Y1020 VanDerWaalsContact CA-OH 3.24Å; Y831-Y1020 WeakPolarHBondContact CA-OH 3.43Å; Y831-Y1020 WeakPolarHBondContact CD1-OH 3.15Å; Y831-Y1020 WeakPolarHBondContact O-CE1 3.14Å; Y831-Y1020 VanDerWaalsContact O-CZ 3.3Å; Y831-Y1020 PolarHBondContact O-OH 2.6Å; Y831-Y1020 VanDerWaalsContact O-OH 3.11Å
1021	S	24.1	Very low	24.7	Very low	106 Å²	106	115 Å²	115	74%	0.741	62%	0.617	S	S	*	*			trans	-82.4	121.2	-174.6	53.7	0	0	0	0	113.2
1022	F	24.7	Very low	24.8	Very low	192 Å²	192	116.1 Å²	116.1	84%	0.842	62%	0.622	S	S	*	*			trans	-140.9	164.8	158.2	-89.4	-75.4	0	0	0	111.4
1023	L	25.2	Very low	24.9	Very low	145 Å²	145	112.6 Å²	112.6	76%	0.759	61%	0.608	S	S	*	*			trans	-78.4	157.9	-158.3	-71.9	159	0	0	0	115.2
1024	P	25.3	Very low	25	Very low	108 Å²	108	114.2 Å²	114.2	70%	0.701	60%	0.603	S	S	*	*			trans	-80.4	136	173.9	33.1	-33.7	0	0	0	112.3
1025	I	25.5	Very low	25	Very low	115 Å²	115	116.4 Å²	116.4	59%	0.59	62%	0.619	S	S	*	*			trans	-138.2	129.8	164.7	-61.5	178.9	0	0	0	108.6	L1133	I1025-L1133 HydrophobicContact CD1-CD2 4.47Å
1026	P	25.4	Very low	25	Very low	87 Å²	87	111.5 Å²	111.5	57%	0.565	62%	0.622	S	S	*	*			trans	-137.4	70.6	141.5	36.8	-22.2	0	0	0	112.2
1027	E	25.3	Very low	25.1	Very low	122 Å²	122	119.8 Å²	119.8	57%	0.57	64%	0.644	S	S	*	*	S	Bend	trans	-122.3	43.9	166.3	-75.9	-155.9	145.4	0	0	111.9	S1128	E1027-S1128 VanDerWaalsContact OE2-CB 3.32Å; E1027-S1128 WeakPolarHBondContact OE2-CB 3.37Å; E1027-S1128 PolarHBondContact OE2-OG 3.1Å
1028	S	25	Very low	25.3	Very low	54 Å²	54	127.2 Å²	127.2	38%	0.378	66%	0.663	S	S	.	*	S	Bend	trans	-168.1	137	167.1	40.7	0	0	0	0	111.5	F1122	S1028-F1122 WeakPolarHBondContact OG-CE1 3.4Å; S1028-F1122 WeakPolarHBondContact OG-CZ 3.46Å
1029	M	25.2	Very low	25.4	Very low	109 Å²	109	125.1 Å²	125.1	54%	0.537	66%	0.66	S	S	.	*			trans	-90.4	128.7	176.1	-115.3	179.8	179.3	0	0	110.6	Y943 L945	Y943-M1029 HydrophobicContact CD1-CE 4.33Å; Y943-M1029 HydrophobicContact CG-CE 4.41Å; L945-M1029 HydrophobicContact CD1-SD 3.68Å; L945-M1029 HydrophobicContact CD2-SD 4.19Å; L945-M1029 HydrophobicContact CG-SD 3.87Å
1030	L	25.5	Very low	25.4	Very low	104 Å²	104	131 Å²	131	55%	0.545	67%	0.67	S	S	.	*			trans	-84.1	141.9	170	-89.1	154.2	0	0	0	110.5	Y1120	L1030-Y1120 HydrophobicContact CD2-CD1 4.32Å; L1030-Y1120 HydrophobicContact CD2-CE1 3.9Å
1031	I	26.1	Very low	25.6	Very low	89 Å²	89	129.9 Å²	129.9	46%	0.456	68%	0.682	S	S	.	*			trans	-127.5	120.6	168.6	-57.8	176.7	0	0	0	106.1	I1033	I1031-I1033 HydrophobicContact CG2-CG1 4.38Å
1032	E	24.4	Very low	25.8	Very low	161 Å²	161	130.4 Å²	130.4	75%	0.752	68%	0.681	S	S	*	*			trans	-117.4	135.4	-179.7	-65.4	-171.7	142.2	0	0	110.5
1033	I	26.2	Very low	25.9	Very low	103 Å²	103	127.5 Å²	127.5	53%	0.528	68%	0.679	S	S	.	*			trans	-140.4	81	-180	-50.5	179	0	0	0	108.9	R961 I1031	R961-I1033 VanDerWaalsContact CZ-O 3.26Å; R961-I1033 PolarHBondContact NH1-O 2.82Å; R961-I1033 PolarHBondContact NH2-O 3.01Å; I1031-I1033 HydrophobicContact CG2-CG1 4.38Å
1034	E	26	Very low	25.9	Very low	167 Å²	167	124 Å²	124	78%	0.78	68%	0.677	S	S	*	*			trans	-89.9	136.3	179.5	-72.5	-139	130.3	0	0	114
1035	S	26.1	Very low	26.1	Very low	98 Å²	98	125 Å²	125	69%	0.685	67%	0.673	S	S	*	*			trans	-158.4	141.1	158.8	61.6	0	0	0	0	107.8	R961	R961-S1035 PolarHBondContact NH2-OG 3.42Å
1036	G	26	Very low	26.4	Very low	72 Å²	72	126.1 Å²	126.1	74%	0.742	68%	0.68	S	S	*	*			trans	-146.5	143.9	-165.3	0	0	0	0	0	115.8
1037	Y	26	Very low	27	Very low	243 Å²	243	122.9 Å²	122.9	95%	0.953	66%	0.659	S	S	*	*			trans	-143	166.7	163.7	-120.7	-97.1	0	0	0	110.2
1038	R	25.8	Very low	27.8	Very low	222 Å²	222	118.1 Å²	118.1	84%	0.838	64%	0.642	S	S	*	*			trans	-87.3	144.3	-157.9	-87.6	-176.8	174.2	176.4	-1.6	117.3
1039	N	26.7	Very low	28.9	Very low	128 Å²	128	116 Å²	116	68%	0.684	63%	0.627	S	S	*	*			trans	55.7	104.8	143	-62.3	6.5	0	0	0	120.3
1040	Q	25.3	Very low	30.1	Very low	189 Å²	189	112.4 Å²	112.4	88%	0.883	61%	0.609	S	S	*	*				-154.5	165.6	124.2	-112.1	166.2	55.4	0	0	111.1
1041	S	28.8	Very low	31.1	Very low	114 Å²	114	108 Å²	108	80%	0.797	59%	0.587	S	S	*	*			trans	-116.9	127.9	-170.5	55.4	0	0	0	0	112
1042	V	26.7	Very low	32.2	Very low	117 Å²	117	106.2 Å²	106.2	71%	0.709	57%	0.574	S	S	*	*			trans	-135.6	141	173.6	-176	0	0	0	0	109.7
1043	T	26.4	Very low	33.2	Very low	130 Å²	130	101.9 Å²	101.9	80%	0.798	56%	0.556	S	S	*	*			trans	-100.4	133.5	-179.4	49.4	0	0	0	0	111.9
1044	G	25.8	Very low	34	Very low	71 Å²	71	102.1 Å²	102.1	73%	0.732	56%	0.555	S	S	*	*			trans	12.3	129.5	165.9	0	0	0	0	0	121.8
1045	H	29.4	Very low	34.8	Very low	131 Å²	131	97.7 Å²	97.7	61%	0.606	54%	0.543	S	S	*	.			trans	-150.5	153.8	148.3	-103.4	-65.1	0	0	0	110.5	S1047	H1045-S1047 PolarHBondContact O-N 3.34Å; H1045-S1047 PolarHBondContact O-OG 2.89Å
1046	D	32.8	Very low	35.1	Very low	138 Å²	138	99.8 Å²	99.8	74%	0.738	55%	0.546	S	S	*	.			trans	-57.6	118.7	-178	-53.2	-89.7	0	0	0	111.6
1047	S	37.9	Very low	35.4	Very low	19 Å²	19	102.2 Å²	102.2	13%	0.133	55%	0.548	C	S	.	.			trans	-131.7	121	175.1	34.2	0	0	0	0	108.5	H1045 L1072	H1045-S1047 PolarHBondContact O-N 3.34Å; H1045-S1047 PolarHBondContact O-OG 2.89Å; S1047-L1072 WeakPolarHBondContact O-CG 3.01Å; S1047-L1072 PolarHBondContact O-N 3.07Å
1048	G	40.9	Very low	35.5	Very low	21 Å²	21	101.1 Å²	101.1	22%	0.216	54%	0.544	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	141.3	178.5	0	0	0	0	0	110.7	A1070 N1109	G1048-A1070 WeakPolarHBondContact CA-O 3.03Å; G1048-N1109 PolarHBondContact O-N 3.36Å
1049	I	48.7	Very low	35.7	Very low	11 Å²	11	97.5 Å²	97.5	6%	0.056	54%	0.541	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	125	170.8	-76.9	158.1	0	0	0	108.4	V956 V1051 I1069 A1070 L1072 V1106 F1107	V956-I1049 HydrophobicContact CG1-CD1 3.68Å; I1049-V1051 HydrophobicContact CG2-CG2 4.34Å; I1049-I1069 WeakPolarHBondContact O-CA 3.33Å; I1049-A1070 HydrophobicContact CB-CB 4.32Å; I1049-A1070 PolarHBondContact N-O 3.27Å; I1049-A1070 PolarHBondContact O-N 3.06Å; I1049-A1070 VanDerWaalsContact O-N 3.1Å; I1049-L1072 HydrophobicContact CD1-CD1 4.37Å; I1049-V1106 HydrophobicContact CG2-CG1 3.87Å; I1049-F1107 WeakPolarHBondContact CA-O 3.2Å
1050	E	49.9	Very low	35.8	Very low	32 Å²	32	99.4 Å²	99.4	15%	0.15	55%	0.551	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.1	141.8	171.2	-71.2	-168.7	121	0	0	111.1	Y1052 A1066 A1068 K1088 F1107	E1050-Y1052 HydrophobicContact CB-CE2 3.87Å; E1050-A1066 HydrophobicContact CB-CB 3.8Å; E1050-A1066 HydrophobicContact CG-CB 4.05Å; E1050-A1068 WeakPolarHBondContact CA-O 3.47Å; E1050-K1088 IonicContact OE1-NZ 3.72Å; E1050-K1088 PolarHBondContact OE1-NZ 3.38Å; E1050-F1107 PolarHBondContact N-O 3.32Å; E1050-F1107 PolarHBondContact O-N 3.03Å
1051	V	46.4	Very low	36	Very low	13 Å²	13	96.7 Å²	96.7	8%	0.079	55%	0.548	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	134.8	-178	179.9	0	0	0	0	109.7	I1049 N1067 A1068 L1104	I1049-V1051 HydrophobicContact CG2-CG2 4.34Å; V1051-N1067 PolarHBondContact O-N 2.93Å; V1051-A1068 HydrophobicContact CB-CB 3.91Å; V1051-A1068 HydrophobicContact CG2-CB 4.07Å; V1051-A1068 PolarHBondContact N-O 3.41Å; V1051-L1104 HydrophobicContact CG1-CD1 3.59Å; V1051-L1104 HydrophobicContact CG1-CG 3.94Å
1052	Y	50.2	Low	36	Very low	50 Å²	50	94.3 Å²	94.3	20%	0.196	54%	0.535	C	S	.	.			trans	-119.1	166.4	-178.4	-66.1	-105.8	0	0	0	111.3	E1050 S1065 A1066 S1105 F1107	E1050-Y1052 HydrophobicContact CB-CE2 3.87Å; Y1052-S1065 WeakPolarHBondContact CD1-O 3.48Å; Y1052-S1065 WeakPolarHBondContact CE1-O 3.37Å; Y1052-A1066 HydrophobicContact CD1-CB 4.45Å; Y1052-A1066 HydrophobicContact CD2-CB 4.29Å; Y1052-A1066 HydrophobicContact CE1-CB 4.01Å; Y1052-A1066 HydrophobicContact CE2-CB 3.81Å; Y1052-S1105 PolarHBondContact N-O 3Å; Y1052-F1107 AromaticContact CD2-CD2 3.38Å; Y1052-F1107 HydrophobicContact CD2-CD2 3.38Å; Y1052-F1107 AromaticContact CD2-CE2 3.53Å; Y1052-F1107 HydrophobicContact CD2-CE2 3.53Å; Y1052-F1107 HydrophobicContact CE2-CB 4.48Å; Y1052-F1107 AromaticContact CE2-CD2 3.35Å; Y1052-F1107 HydrophobicContact CE2-CD2 3.35Å; Y1052-F1107 AromaticContact CE2-CE2 3.81Å; Y1052-F1107 HydrophobicContact CE2-CE2 3.81Å; Y1052-F1107 HydrophobicContact CE2-CG 4.19Å; Y1052-F1107 HydrophobicContact CG-CD2 4.46Å; Y1052-F1107 HydrophobicContact CG-CE2 4.21Å
1053	D	44.5	Very low	36.4	Very low	70 Å²	70	93.9 Å²	93.9	37%	0.374	53%	0.534	S	S	.	.			trans	-129.8	117.2	173.5	176.1	-2.9	0	0	0	108.2	S1055 N1067	D1053-S1055 VanDerWaalsContact CG-OG 3.29Å; D1053-S1055 WeakPolarHBondContact OD1-CB 3.41Å; D1053-S1055 PolarHBondContact OD1-N 3.26Å; D1053-S1055 PolarHBondContact OD1-OG 2.86Å; D1053-S1055 PolarHBondContact OD2-OG 3.08Å; D1053-N1067 VanDerWaalsContact CB-ND2 3.32Å; D1053-N1067 WeakPolarHBondContact CB-ND2 3.49Å
1054	E	44.2	Very low	36.9	Very low	108 Å²	108	95.9 Å²	95.9	51%	0.505	54%	0.535	S	S	.	.			trans	-91.8	9.6	-175.7	-60.1	-177.4	-161.4	0	0	113.4	L1056 D1103 S1105	E1054-L1056 PolarHBondContact O-N 3.49Å; E1054-D1103 HydrophobicContact CB-CB 4.32Å; E1054-S1105 WeakPolarHBondContact OE1-CB 2.92Å; E1054-S1105 PolarHBondContact OE1-OG 3.06Å
1055	S	41.4	Very low	37.7	Very low	75 Å²	75	96.7 Å²	96.7	52%	0.524	53%	0.529	S	S	.	.			trans	-73.9	-3	-177.1	67.1	0	0	0	0	115.7	D1053	D1053-S1055 VanDerWaalsContact CG-OG 3.29Å; D1053-S1055 WeakPolarHBondContact OD1-CB 3.41Å; D1053-S1055 PolarHBondContact OD1-N 3.26Å; D1053-S1055 PolarHBondContact OD1-OG 2.86Å; D1053-S1055 PolarHBondContact OD2-OG 3.08Å
1056	L	34.3	Very low	38.2	Very low	142 Å²	142	90.7 Å²	90.7	74%	0.743	50%	0.502	S	S	*	.	S	Bend	trans	-100.1	137	180	-66.8	173.8	0	0	0	112.3	E1054	E1054-L1056 PolarHBondContact O-N 3.49Å
1057	P	31.8	Very low	39.4	Very low	123 Å²	123	87.4 Å²	87.4	80%	0.799	48%	0.484	S	S	*	.			trans	-70.9	141.4	-173.3	28.7	-35.2	0	0	0	113.3	D1059	P1057-D1059 PolarHBondContact O-N 3.49Å
1058	Y	28.3	Very low	40.3	Very low	219 Å²	219	86.5 Å²	86.5	86%	0.859	48%	0.478	S	S	*	.			trans	-90.4	101.8	-165.5	-163.1	-80.2	0	0	0	113.1
1059	D	29.4	Very low	41.4	Very low	147 Å²	147	88.3 Å²	88.3	79%	0.786	48%	0.482	S	S	*	.			trans	-137	119.9	164.6	-87.5	-43.4	0	0	0	110.5	P1057 V1061	P1057-D1059 PolarHBondContact O-N 3.49Å; D1059-V1061 PolarHBondContact O-N 3.16Å
1060	D	29.2	Very low	41.9	Very low	167 Å²	167	87.8 Å²	87.8	89%	0.893	48%	0.48	S	S	*	.	S	Bend	trans	59.1	20.6	155	-77.4	-9.3	0	0	0	122.9
1061	V	28.6	Very low	42.6	Very low	133 Å²	133	89.1 Å²	89.1	81%	0.806	49%	0.488	S	S	*	.			trans	-125.9	148.1	175.6	-169.9	0	0	0	0	114.6	D1059	D1059-V1061 PolarHBondContact O-N 3.16Å
1062	A	30.4	Very low	43.1	Very low	64 Å²	64	89.2 Å²	89.2	53%	0.529	49%	0.488	S	S	.	.			trans	-87.2	164	-171.5	0	0	0	0	0	114.8	E1064	A1062-E1064 VanDerWaalsContact C-N 3.29Å; A1062-E1064 PolarHBondContact O-N 2.83Å
1063	P	34	Very low	43.1	Very low	107 Å²	107	96.9 Å²	96.9	70%	0.695	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	29.4	-161.7	-17.6	33.5	0	0	0	118.3
1064	E	37.9	Very low	43.2	Very low	173 Å²	173	99.9 Å²	99.9	81%	0.808	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-17.6	-167.5	-60.9	-169.5	151.1	0	0	115	A1062 K1088	A1062-E1064 VanDerWaalsContact C-N 3.29Å; A1062-E1064 PolarHBondContact O-N 2.83Å; E1064-K1088 PolarHBondContact O-NZ 3.27Å
1065	S	40.9	Very low	43.3	Very low	88 Å²	88	97.9 Å²	97.9	62%	0.615	52%	0.523	S	S	*	.			trans	-96.4	108.3	-179.5	55.8	0	0	0	0	112.6	Y1052	Y1052-S1065 WeakPolarHBondContact CD1-O 3.48Å; Y1052-S1065 WeakPolarHBondContact CE1-O 3.37Å
1066	A	41.2	Very low	43.2	Very low	5 Å²	5	95.9 Å²	95.9	4%	0.041	51%	0.509	C	S	.	.			trans	-108.2	153.9	164.4	0	0	0	0	0	108.8	E1050 Y1052 K1088	E1050-A1066 HydrophobicContact CB-CB 3.8Å; E1050-A1066 HydrophobicContact CG-CB 4.05Å; Y1052-A1066 HydrophobicContact CD1-CB 4.45Å; Y1052-A1066 HydrophobicContact CD2-CB 4.29Å; Y1052-A1066 HydrophobicContact CE1-CB 4.01Å; Y1052-A1066 HydrophobicContact CE2-CB 3.81Å; A1066-K1088 HydrophobicContact CB-CD 4.06Å; A1066-K1088 WeakPolarHBondContact O-CB 3.41Å; A1066-K1088 WeakPolarHBondContact O-CD 3.45Å
1067	N	57	Low	43.3	Very low	68 Å²	68	91.7 Å²	91.7	36%	0.364	49%	0.491	S	S	.	.	S	Bend	trans	-95.4	-21.8	-171.6	-61.9	-11.8	0	0	0	112.9	V1051 D1053 S1087 K1088	V1051-N1067 PolarHBondContact O-N 2.93Å; D1053-N1067 VanDerWaalsContact CB-ND2 3.32Å; D1053-N1067 WeakPolarHBondContact CB-ND2 3.49Å; N1067-S1087 WeakPolarHBondContact O-CA 3.15Å; N1067-K1088 PolarHBondContact O-N 2.87Å
1068	A	58	Low	43.5	Very low	1 Å²	1	89.7 Å²	89.7	1%	0.008	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	156.7	177.7	0	0	0	0	0	113.7	E1050 V1051 A1085 Y1086 F1096	E1050-A1068 WeakPolarHBondContact CA-O 3.47Å; V1051-A1068 HydrophobicContact CB-CB 3.91Å; V1051-A1068 HydrophobicContact CG2-CB 4.07Å; V1051-A1068 PolarHBondContact N-O 3.41Å; A1068-A1085 HydrophobicContact CB-CB 4.15Å; A1068-Y1086 CarbonylContact C-O 3.6Å; A1068-Y1086 WeakPolarHBondContact CA-O 3.04Å; A1068-Y1086 WeakPolarHBondContact CB-O 3.06Å; A1068-F1096 HydrophobicContact CB-CE1 3.47Å; A1068-F1096 VanDerWaalsContact CB-CE1 3.47Å; A1068-F1096 HydrophobicContact CB-CZ 3.58Å
1069	I	63.3	Low	44	Very low	58 Å²	58	80.2 Å²	80.2	30%	0.297	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	124.5	173.7	-59.1	178.5	0	0	0	109.8	I1049 A1085 Y1086 K1088	I1049-I1069 WeakPolarHBondContact O-CA 3.33Å; I1069-A1085 WeakPolarHBondContact O-CA 3.3Å; I1069-Y1086 PolarHBondContact N-O 3.43Å; I1069-Y1086 PolarHBondContact O-N 2.82Å; I1069-K1088 HydrophobicContact CD1-CD 4.32Å; I1069-K1088 HydrophobicContact CD1-CG 3.95Å; I1069-K1088 HydrophobicContact CG1-CG 4.3Å
1070	A	60.1	Low	44.7	Very low	0 Å²	0	74 Å²	74	0%	0	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	138.9	167.5	0	0	0	0	0	111.7	V956 G1048 I1049 I1084 A1085	V956-A1070 HydrophobicContact CG2-CB 3.78Å; G1048-A1070 WeakPolarHBondContact CA-O 3.03Å; I1049-A1070 HydrophobicContact CB-CB 4.32Å; I1049-A1070 PolarHBondContact N-O 3.27Å; I1049-A1070 PolarHBondContact O-N 3.06Å; I1049-A1070 VanDerWaalsContact O-N 3.1Å; A1070-I1084 WeakPolarHBondContact CA-O 3.4Å; A1070-A1085 HydrophobicContact CB-CB 3.97Å
1071	N	63.4	Low	45.8	Very low	61 Å²	61	66.6 Å²	66.6	33%	0.326	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	108.1	-166.6	-156.6	-65.5	0	0	0	111.7	R1073 S1083	N1071-R1073 PolarHBondContact O-N 3.14Å; N1071-R1073 VanDerWaalsContact OD1-CG 3.25Å; N1071-R1073 WeakPolarHBondContact OD1-CG 3.22Å; N1071-R1073 PolarHBondContact OD1-NE 2.7Å; N1071-S1083 PolarHBondContact N-OG 3.02Å; N1071-S1083 VanDerWaalsContact N-OG 3.13Å; N1071-S1083 WeakPolarHBondContact O-CB 3.26Å; N1071-S1083 PolarHBondContact O-OG 3.18Å
1072	L	57.7	Low	47.1	Very low	15 Å²	15	64.5 Å²	64.5	8%	0.079	35%	0.352	C	S	.	.			trans	-87.1	64.4	-164	-57.9	-178.5	0	0	0	114.3	V956 T958 S1047 I1049 C1081 T1116	V956-L1072 HydrophobicContact CG1-CD2 4.41Å; T958-L1072 HydrophobicContact CG2-CD1 3.96Å; T958-L1072 HydrophobicContact CG2-CD2 4.08Å; S1047-L1072 WeakPolarHBondContact O-CG 3.01Å; S1047-L1072 PolarHBondContact O-N 3.07Å; I1049-L1072 HydrophobicContact CD1-CD1 4.37Å; L1072-C1081 HydrophobicContact CB-CB 4.14Å; L1072-C1081 HydrophobicContact CD2-CB 3.96Å; L1072-C1081 HydrophobicContact CG-CB 4.43Å; L1072-T1116 HydrophobicContact CD1-CG2 3.86Å
1073	R	49.7	Very low	48.7	Very low	211 Å²	211	62.3 Å²	62.3	80%	0.796	33%	0.333	S	S	*	.			trans	-81.7	-16	-172.1	-63	-174	-179.1	174.1	-0.9	116.8	N1071	N1071-R1073 PolarHBondContact O-N 3.14Å; N1071-R1073 VanDerWaalsContact OD1-CG 3.25Å; N1071-R1073 WeakPolarHBondContact OD1-CG 3.22Å; N1071-R1073 PolarHBondContact OD1-NE 2.7Å
1074	F	47.2	Very low	50.2	Low	133 Å²	133	57.9 Å²	57.9	58%	0.583	30%	0.303	S	S	*	.			trans	-139.4	120	-176.2	-178.2	-107.9	0	0	0	110.8	P1076 C1081 R1082	F1074-P1076 HydrophobicContact CD1-CG 4.09Å; F1074-P1076 HydrophobicContact CE1-CG 3.45Å; F1074-P1076 VanDerWaalsContact CE1-CG 3.45Å; F1074-P1076 HydrophobicContact CZ-CG 3.71Å; F1074-C1081 VanDerWaalsContact O-CA 3.31Å; F1074-C1081 WeakPolarHBondContact O-CA 3.37Å; F1074-R1082 PolarHBondContact O-N 3.26Å
1075	C	45.6	Very low	51.7	Low	65 Å²	65	49.7 Å²	49.7	44%	0.439	27%	0.265	S	S	.	.			trans	-140.9	82.1	-168.2	-52.1	0	0	0	0	112.4	C1081	C1075-C1081 HydrophobicContact CB-CB 3.96Å; C1075-C1081 WeakPolarHBondContact CB-SG 3.24Å; C1075-C1081 WeakPolarHBondContact SG-CB 3.44Å; C1075-C1081 CovalentContact SG-SG 2.03Å; C1075-C1081 PolarHBondContact SG-SG 2.82Å
1076	P	39.4	Very low	53.1	Low	33 Å²	33	49.8 Å²	49.8	21%	0.214	25%	0.252	C	S	.	.			trans	-62	144.4	175.3	-23.8	35.2	0	0	0	113	F1074 V1078 S1079 G1080	F1074-P1076 HydrophobicContact CD1-CG 4.09Å; F1074-P1076 HydrophobicContact CE1-CG 3.45Å; F1074-P1076 VanDerWaalsContact CE1-CG 3.45Å; F1074-P1076 HydrophobicContact CZ-CG 3.71Å; P1076-V1078 PolarHBondContact O-N 2.84Å; P1076-S1079 WeakPolarHBondContact CB-OG 3.39Å; P1076-S1079 PolarHBondContact O-N 3.24Å; P1076-G1080 VanDerWaalsContact CD-O 3.26Å; P1076-G1080 WeakPolarHBondContact CD-O 3.34Å; P1076-G1080 PolarHBondContact O-N 2.81Å
1077	S	37.2	Very low	54.1	Low	54 Å²	54	50.5 Å²	50.5	38%	0.378	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-6.6	-171.4	55.2	0	0	0	0	116	R960	R960-S1077 PolarHBondContact NH1-O 3.15Å; R960-S1077 VanDerWaalsContact NH1-O 3.11Å; R960-S1077 PolarHBondContact NH2-O 3.1Å; R960-S1077 VanDerWaalsContact NH2-O 3.14Å
1078	V	34.3	Very low	54.3	Low	82 Å²	82	51 Å²	51	50%	0.497	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.5	-17.3	-177.3	-82.4	0	0	0	0	113.7	P1076 Q1143	P1076-V1078 PolarHBondContact O-N 2.84Å; V1078-Q1143 HydrophobicContact CG2-CB 3.97Å; V1078-Q1143 VanDerWaalsContact CG2-OE1 3.25Å
1079	S	39.5	Very low	54.5	Low	20 Å²	20	58.3 Å²	58.3	14%	0.14	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.1	-0.4	-177.6	60.6	0	0	0	0	114.9	K957 P1076	K957-S1079 WeakPolarHBondContact CE-O 3.32Å; P1076-S1079 WeakPolarHBondContact CB-OG 3.39Å; P1076-S1079 PolarHBondContact O-N 3.24Å
1080	G	45.1	Very low	54.4	Low	17 Å²	17	59.1 Å²	59.1	18%	0.175	30%	0.3	C	S	.	.			trans	72.4	-178.7	173.3	0	0	0	0	0	114.3	T958 P1076	T958-G1080 WeakPolarHBondContact O-CA 3.47Å; P1076-G1080 VanDerWaalsContact CD-O 3.26Å; P1076-G1080 WeakPolarHBondContact CD-O 3.34Å; P1076-G1080 PolarHBondContact O-N 2.81Å
1081	C	51.3	Low	54.3	Low	10 Å²	10	67.2 Å²	67.2	7%	0.068	34%	0.338	C	S	.	.			trans	-73.9	140.2	-179.4	-49.1	0	0	0	0	110.8	K957 T958 L1072 F1074 C1075	K957-C1081 CarbonylContact C-O 3.57Å; K957-C1081 VanDerWaalsContact CA-O 3.24Å; K957-C1081 WeakPolarHBondContact CA-O 3.42Å; T958-C1081 HydrophobicContact CG2-CB 4.16Å; T958-C1081 PolarHBondContact N-O 2.88Å; T958-C1081 WeakPolarHBondContact OG1-CB 3.49Å; T958-C1081 PolarHBondContact OG1-N 3.37Å; T958-C1081 PolarHBondContact OG1-SG 3.11Å; T958-C1081 VanDerWaalsContact OG1-SG 3.38Å; L1072-C1081 HydrophobicContact CB-CB 4.14Å; L1072-C1081 HydrophobicContact CD2-CB 3.96Å; L1072-C1081 HydrophobicContact CG-CB 4.43Å; F1074-C1081 VanDerWaalsContact O-CA 3.31Å; F1074-C1081 WeakPolarHBondContact O-CA 3.37Å; C1075-C1081 HydrophobicContact CB-CB 3.96Å; C1075-C1081 WeakPolarHBondContact CB-SG 3.24Å; C1075-C1081 WeakPolarHBondContact SG-CB 3.44Å; C1075-C1081 CovalentContact SG-SG 2.03Å; C1075-C1081 PolarHBondContact SG-SG 2.82Å
1082	R	56.6	Low	53.8	Low	89 Å²	89	69.3 Å²	69.3	34%	0.336	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	137.4	167.3	-69.7	-178.7	-179.4	147.6	3.7	110	V956 K957 F1074 E1140	V956-R1082 WeakPolarHBondContact O-CA 3.41Å; K957-R1082 HydrophobicContact CG-CG 4.36Å; F1074-R1082 PolarHBondContact O-N 3.26Å; R1082-E1140 IonicContact CZ-OE1 2.76Å; R1082-E1140 IonicContact NH1-OE1 3.82Å; R1082-E1140 PolarHBondContact NH1-OE1 3.16Å; R1082-E1140 IonicContact NH1-OE2 2.78Å; R1082-E1140 PolarHBondContact NH1-OE2 2.88Å; R1082-E1140 IonicContact NH2-OE1 3.9Å; R1082-E1140 PolarHBondContact NH2-OE1 3.18Å
1083	S	63	Low	53.6	Low	18 Å²	18	70 Å²	70	13%	0.126	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	165.1	176.2	-162.1	0	0	0	0	112.3	K955 V956 N1071	K955-S1083 CarbonylContact C-O 3.44Å; K955-S1083 WeakPolarHBondContact CA-O 3.36Å; V956-S1083 PolarHBondContact N-O 3.24Å; V956-S1083 PolarHBondContact O-N 3.25Å; N1071-S1083 PolarHBondContact N-OG 3.02Å; N1071-S1083 VanDerWaalsContact N-OG 3.13Å; N1071-S1083 WeakPolarHBondContact O-CB 3.26Å; N1071-S1083 PolarHBondContact O-OG 3.18Å
1084	I	66.7	Low	54.3	Low	14 Å²	14	60.8 Å²	60.8	7%	0.072	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	143.7	167.3	-66.2	163.4	0	0	0	107.5	A1070 Y1086 A1094 L1134	A1070-I1084 WeakPolarHBondContact CA-O 3.4Å; I1084-Y1086 HydrophobicContact CB-CE2 4.03Å; I1084-Y1086 HydrophobicContact CG2-CE1 4.45Å; I1084-Y1086 HydrophobicContact CG2-CE2 4.24Å; I1084-Y1086 WeakPolarHBondContact O-CD2 3.46Å; I1084-Y1086 WeakPolarHBondContact O-CE2 3.1Å; I1084-A1094 HydrophobicContact CG2-CB 3.55Å; I1084-L1134 HydrophobicContact CD1-CD1 3.92Å; I1084-L1134 HydrophobicContact CD1-CD2 3.82Å; I1084-L1134 HydrophobicContact CD1-CG 4.45Å; I1084-L1134 HydrophobicContact CG1-CD2 4.25Å
1085	A	67.8	Low	54.9	Low	1 Å²	1	55.4 Å²	55.4	1%	0.008	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	130.6	165.3	0	0	0	0	0	110.3	L954 A1068 I1069 A1070 F1096	L954-A1085 HydrophobicContact CB-CB 3.96Å; L954-A1085 PolarHBondContact O-N 2.94Å; A1068-A1085 HydrophobicContact CB-CB 4.15Å; I1069-A1085 WeakPolarHBondContact O-CA 3.3Å; A1070-A1085 HydrophobicContact CB-CB 3.97Å; A1085-F1096 HydrophobicContact CB-CE2 4.42Å; A1085-F1096 HydrophobicContact CB-CZ 4.26Å; A1085-F1096 WeakPolarHBondContact O-CE2 3.45Å; A1085-F1096 WeakPolarHBondContact O-CZ 3.36Å
1086	Y	71	Confident	55.8	Low	90 Å²	90	54 Å²	54	35%	0.353	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	152.9	176.1	-58.3	-94.4	0	0	0	109.1	A1068 I1069 I1084 E1091 S1093 A1094	A1068-Y1086 CarbonylContact C-O 3.6Å; A1068-Y1086 WeakPolarHBondContact CA-O 3.04Å; A1068-Y1086 WeakPolarHBondContact CB-O 3.06Å; I1069-Y1086 PolarHBondContact N-O 3.43Å; I1069-Y1086 PolarHBondContact O-N 2.82Å; I1084-Y1086 HydrophobicContact CB-CE2 4.03Å; I1084-Y1086 HydrophobicContact CG2-CE1 4.45Å; I1084-Y1086 HydrophobicContact CG2-CE2 4.24Å; I1084-Y1086 WeakPolarHBondContact O-CD2 3.46Å; I1084-Y1086 WeakPolarHBondContact O-CE2 3.1Å; Y1086-E1091 VanDerWaalsContact CD1-O 3.32Å; Y1086-E1091 WeakPolarHBondContact CD1-O 3.04Å; Y1086-S1093 CarbonylContact C-O 3.48Å; Y1086-S1093 WeakPolarHBondContact CA-O 3.38Å; Y1086-A1094 HydrophobicContact CD1-CB 4.42Å
1087	S	63	Low	56.8	Low	21 Å²	21	57.2 Å²	57.2	15%	0.147	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	141.3	174.1	177.8	0	0	0	0	111.1	N1067 D1089 D1090 S1093	N1067-S1087 WeakPolarHBondContact O-CA 3.15Å; S1087-D1089 PolarHBondContact O-N 2.79Å; S1087-D1089 PolarHBondContact OG-N 3.11Å; S1087-D1089 VanDerWaalsContact OG-N 3.15Å; S1087-D1090 CarbonylContact O-C 2.78Å; S1087-D1090 VanDerWaalsContact O-C 3.27Å; S1087-D1090 PolarHBondContact O-N 2.76Å; S1087-D1090 PolarHBondContact OG-N 2.93Å; S1087-S1093 PolarHBondContact N-O 2.04Å
1088	K	61.1	Low	57.8	Low	79 Å²	79	55.7 Å²	55.7	34%	0.343	30%	0.302	S	S	.	.	S	Bend	trans	-71.9	-22.2	172.4	-160.2	172.7	-170.1	176.3	0	111.9	E1050 E1064 A1066 N1067 I1069	E1050-K1088 IonicContact OE1-NZ 3.72Å; E1050-K1088 PolarHBondContact OE1-NZ 3.38Å; E1064-K1088 PolarHBondContact O-NZ 3.27Å; A1066-K1088 HydrophobicContact CB-CD 4.06Å; A1066-K1088 WeakPolarHBondContact O-CB 3.41Å; A1066-K1088 WeakPolarHBondContact O-CD 3.45Å; N1067-K1088 PolarHBondContact O-N 2.87Å; I1069-K1088 HydrophobicContact CD1-CD 4.32Å; I1069-K1088 HydrophobicContact CD1-CG 3.95Å; I1069-K1088 HydrophobicContact CG1-CG 4.3Å
1089	D	61.5	Low	58.4	Low	154 Å²	154	57.6 Å²	57.6	82%	0.824	31%	0.313	S	S	*	.	S	Bend	trans	-85.4	-21.3	174.8	-65.4	-46.1	0	0	0	113.3	S1087	S1087-D1089 PolarHBondContact O-N 2.79Å; S1087-D1089 PolarHBondContact OG-N 3.11Å; S1087-D1089 VanDerWaalsContact OG-N 3.15Å
1090	D	61.7	Low	58.8	Low	74 Å²	74	61.8 Å²	61.8	40%	0.396	33%	0.334	S	S	.	.			trans	-150.7	97.2	-179.8	-178.2	2.4	0	0	0	111	S1087 S1092 S1093	S1087-D1090 CarbonylContact O-C 2.78Å; S1087-D1090 VanDerWaalsContact O-C 3.27Å; S1087-D1090 PolarHBondContact O-N 2.76Å; S1087-D1090 PolarHBondContact OG-N 2.93Å; D1090-S1092 PolarHBondContact O-N 2.82Å; D1090-S1092 WeakPolarHBondContact OD1-CA 3.25Å; D1090-S1092 WeakPolarHBondContact OD1-CB 3.48Å; D1090-S1092 PolarHBondContact OD1-N 3.29Å; D1090-S1092 PolarHBondContact OD1-OG 2.81Å; D1090-S1092 PolarHBondContact OD2-OG 3.41Å; D1090-S1093 PolarHBondContact O-N 3.46Å; D1090-S1093 WeakPolarHBondContact OD2-CB 3.28Å
1091	E	56.7	Low	58.5	Low	171 Å²	171	66 Å²	66	80%	0.799	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-13.1	176.3	-63.5	-170.9	142.7	0	0	113.7	Y1086	Y1086-E1091 VanDerWaalsContact CD1-O 3.32Å; Y1086-E1091 WeakPolarHBondContact CD1-O 3.04Å
1092	S	54.1	Low	58.1	Low	104 Å²	104	67.1 Å²	67.1	73%	0.727	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-10.5	174.7	77.5	0	0	0	0	114.2	D1090	D1090-S1092 PolarHBondContact O-N 2.82Å; D1090-S1092 WeakPolarHBondContact OD1-CA 3.25Å; D1090-S1092 WeakPolarHBondContact OD1-CB 3.48Å; D1090-S1092 PolarHBondContact OD1-N 3.29Å; D1090-S1092 PolarHBondContact OD1-OG 2.81Å; D1090-S1092 PolarHBondContact OD2-OG 3.41Å
1093	S	53.6	Low	57.3	Low	31 Å²	31	64.5 Å²	64.5	22%	0.217	34%	0.344	C	S	.	.			trans	-103.2	116.9	177.5	-177.5	0	0	0	0	112	Y1086 S1087 D1090 A1095	Y1086-S1093 CarbonylContact C-O 3.48Å; Y1086-S1093 WeakPolarHBondContact CA-O 3.38Å; S1087-S1093 PolarHBondContact N-O 2.04Å; D1090-S1093 PolarHBondContact O-N 3.46Å; D1090-S1093 WeakPolarHBondContact OD2-CB 3.28Å; S1093-A1095 VanDerWaalsContact C-N 3.32Å; S1093-A1095 PolarHBondContact OG-N 3.34Å; S1093-A1095 PolarHBondContact OG-O 3.08Å
1094	A	64.5	Low	56.5	Low	17 Å²	17	64.3 Å²	64.3	14%	0.14	34%	0.341	C	S	.	.			trans	-92.5	12.4	166.4	0	0	0	0	0	113	M953 I1084 Y1086 F1096	M953-A1094 WeakPolarHBondContact CA-O 3.45Å; M953-A1094 WeakPolarHBondContact CB-O 3.24Å; M953-A1094 HydrophobicContact CG-CB 4.5Å; M953-A1094 WeakPolarHBondContact CG-O 3.32Å; M953-A1094 HydrophobicContact SD-CB 3.77Å; I1084-A1094 HydrophobicContact CG2-CB 3.55Å; Y1086-A1094 HydrophobicContact CD1-CB 4.42Å; A1094-F1096 WeakPolarHBondContact O-CE2 3.31Å
1095	A	60.2	Low	55.4	Low	19 Å²	19	63.8 Å²	63.8	16%	0.157	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	121.2	-170.5	0	0	0	0	0	112.8	K951 W952 S1093 L1126	K951-A1095 HydrophobicContact CD-CB 4.5Å; W952-A1095 WeakPolarHBondContact O-CA 3.34Å; S1093-A1095 VanDerWaalsContact C-N 3.32Å; S1093-A1095 PolarHBondContact OG-N 3.34Å; S1093-A1095 PolarHBondContact OG-O 3.08Å; A1095-L1126 HydrophobicContact CB-CD1 4.05Å; A1095-L1126 HydrophobicContact CB-CD2 3.87Å
1096	F	64.5	Low	54.3	Low	35 Å²	35	65 Å²	65	15%	0.154	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	135.8	-178.1	-51.4	-83.2	0	0	0	110	K951 W952 L954 A1068 A1085 A1094	K951-F1096 CarbonylContact C-O 3.49Å; K951-F1096 WeakPolarHBondContact CA-O 3.45Å; W952-F1096 PolarHBondContact N-O 3.41Å; W952-F1096 PolarHBondContact O-N 3.32Å; L954-F1096 HydrophobicContact CB-CD2 4.46Å; L954-F1096 HydrophobicContact CB-CE2 4.15Å; L954-F1096 HydrophobicContact CD1-CD2 3.95Å; L954-F1096 HydrophobicContact CD1-CE2 3.99Å; L954-F1096 HydrophobicContact CD1-CG 4.45Å; L954-F1096 HydrophobicContact CG-CD2 3.86Å; L954-F1096 HydrophobicContact CG-CE2 4Å; A1068-F1096 HydrophobicContact CB-CE1 3.47Å; A1068-F1096 VanDerWaalsContact CB-CE1 3.47Å; A1068-F1096 HydrophobicContact CB-CZ 3.58Å; A1085-F1096 HydrophobicContact CB-CE2 4.42Å; A1085-F1096 HydrophobicContact CB-CZ 4.26Å; A1085-F1096 WeakPolarHBondContact O-CE2 3.45Å; A1085-F1096 WeakPolarHBondContact O-CZ 3.36Å; A1094-F1096 WeakPolarHBondContact O-CE2 3.31Å
1097	D	59.1	Low	53.1	Low	101 Å²	101	65.8 Å²	65.8	54%	0.54	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	125.6	172.5	-75	-70.9	0	0	0	110.3	G950 K951	G950-D1097 WeakPolarHBondContact O-CA 3.04Å; K951-D1097 WeakPolarHBondContact CG-OD1 3.32Å; K951-D1097 IonicContact NZ-OD1 2.78Å; K951-D1097 IonicContact NZ-OD2 3.99Å; K951-D1097 PolarHBondContact NZ-OD2 3.19Å
1098	I	57.6	Low	52.2	Low	23 Å²	23	67 Å²	67	12%	0.118	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	126.4	175.2	-56.6	-179.3	0	0	0	107.7	P949 G950 W952 F1102 V1123	P949-I1098 CarbonylContact C-O 3.27Å; P949-I1098 WeakPolarHBondContact CA-O 3.39Å; P949-I1098 WeakPolarHBondContact CB-O 3.33Å; G950-I1098 PolarHBondContact N-O 2.64Å; G950-I1098 PolarHBondContact O-N 2.77Å; W952-I1098 HydrophobicContact CB-CD1 4.18Å; W952-I1098 HydrophobicContact CG-CD1 3.94Å; W952-I1098 HydrophobicContact CG-CG1 4.48Å; I1098-F1102 HydrophobicContact CD1-CE1 4.16Å; I1098-F1102 HydrophobicContact CD1-CZ 4.18Å; I1098-F1102 HydrophobicContact CG2-CD1 3.53Å; I1098-F1102 HydrophobicContact CG2-CE1 3.82Å; I1098-F1102 HydrophobicContact CG2-CG 4.3Å; I1098-V1123 HydrophobicContact CD1-CG1 4.46Å
1099	V	48.4	Very low	51.3	Low	122 Å²	122	67.6 Å²	67.6	74%	0.739	36%	0.362	S	S	*	.			trans	-117.4	-35.6	-164.9	-89.4	0	0	0	0	116.7
1100	D	48.3	Very low	50	Low	107 Å²	107	66.8 Å²	66.8	57%	0.572	36%	0.358	S	S	*	.	S	Bend	trans	-157.4	-86.4	167.3	-163.1	-7.7	0	0	0	110.8	Y978	Y978-D1100 PolarHBondContact OH-OD1 2.98Å
1101	K	38.5	Very low	48.9	Very low	107 Å²	107	69.1 Å²	69.1	47%	0.465	37%	0.374	S	S	.	.			trans	-92.2	139.9	169	-66.2	-164.1	173	-158.4	0	111.1	D971	D971-K1101 IonicContact OD1-NZ 2.77Å; D971-K1101 PolarHBondContact OD1-NZ 2.03Å
1102	F	42.2	Very low	47.8	Very low	32 Å²	32	63.5 Å²	63.5	14%	0.14	35%	0.354	C	S	.	.			trans	-142.6	137.9	167.6	74.5	-78.3	0	0	0	109.2	L947 I970 I1098 L1104	L947-F1102 HydrophobicContact CD1-CE1 4.04Å; L947-F1102 HydrophobicContact CD1-CZ 4.21Å; I970-F1102 HydrophobicContact CD1-CD1 4.39Å; I970-F1102 HydrophobicContact CD1-CD2 4.45Å; I970-F1102 HydrophobicContact CD1-CE1 3.73Å; I970-F1102 HydrophobicContact CD1-CE2 3.8Å; I970-F1102 HydrophobicContact CD1-CZ 3.4Å; I970-F1102 VanDerWaalsContact CD1-CZ 3.4Å; I1098-F1102 HydrophobicContact CD1-CE1 4.16Å; I1098-F1102 HydrophobicContact CD1-CZ 4.18Å; I1098-F1102 HydrophobicContact CG2-CD1 3.53Å; I1098-F1102 HydrophobicContact CG2-CE1 3.82Å; I1098-F1102 HydrophobicContact CG2-CG 4.3Å; F1102-L1104 HydrophobicContact CD2-CB 4.07Å; F1102-L1104 HydrophobicContact CD2-CD1 4.24Å; F1102-L1104 HydrophobicContact CE2-CB 3.98Å; F1102-L1104 HydrophobicContact CE2-CD1 3.97Å
1103	D	40	Very low	46.9	Very low	34 Å²	34	61.6 Å²	61.6	18%	0.182	35%	0.35	C	S	.	.			trans	-108.6	127.2	170.7	-73.7	-49.7	0	0	0	107.8	R969 I970 E1054	R969-D1103 VanDerWaalsContact CA-OD1 3.24Å; R969-D1103 WeakPolarHBondContact CA-OD1 3.12Å; R969-D1103 WeakPolarHBondContact CG-OD1 3.14Å; I970-D1103 PolarHBondContact N-OD1 2.79Å; I970-D1103 VanDerWaalsContact N-OD1 3.1Å; E1054-D1103 HydrophobicContact CB-CB 4.32Å
1104	L	45.8	Very low	46.2	Very low	14 Å²	14	63.8 Å²	63.8	7%	0.073	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	84.9	-167.3	-170.5	116.5	0	0	0	111.2	L954 L968 V1051 F1102 V1106 L1121	L954-L1104 HydrophobicContact CD1-CD1 4.4Å; L968-L1104 PolarHBondContact O-N 3.14Å; L968-L1104 VanDerWaalsContact O-N 3.13Å; V1051-L1104 HydrophobicContact CG1-CD1 3.59Å; V1051-L1104 HydrophobicContact CG1-CG 3.94Å; F1102-L1104 HydrophobicContact CD2-CB 4.07Å; F1102-L1104 HydrophobicContact CD2-CD1 4.24Å; F1102-L1104 HydrophobicContact CE2-CB 3.98Å; F1102-L1104 HydrophobicContact CE2-CD1 3.97Å; L1104-V1106 HydrophobicContact CD2-CG2 3.77Å; L1104-L1121 HydrophobicContact CD2-CD2 3.38Å
1105	S	43.7	Very low	45	Very low	3 Å²	3	66 Å²	66	2%	0.021	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	122	178.9	-67.7	0	0	0	0	111.2	Y1052 E1054	Y1052-S1105 PolarHBondContact N-O 3Å; E1054-S1105 WeakPolarHBondContact OE1-CB 2.92Å; E1054-S1105 PolarHBondContact OE1-OG 3.06Å
1106	V	45.3	Very low	44.1	Very low	27 Å²	27	66.1 Å²	66.1	16%	0.164	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	115.9	-171.2	167.8	0	0	0	0	110.3	I1049 L1104	I1049-V1106 HydrophobicContact CG2-CG1 3.87Å; L1104-V1106 HydrophobicContact CD2-CG2 3.77Å
1107	F	45.7	Very low	43.4	Very low	107 Å²	107	66.4 Å²	66.4	47%	0.469	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	138.1	-177.1	-60.8	-91.9	0	0	0	112.3	I1049 E1050 Y1052	I1049-F1107 WeakPolarHBondContact CA-O 3.2Å; E1050-F1107 PolarHBondContact N-O 3.32Å; E1050-F1107 PolarHBondContact O-N 3.03Å; Y1052-F1107 AromaticContact CD2-CD2 3.38Å; Y1052-F1107 HydrophobicContact CD2-CD2 3.38Å; Y1052-F1107 AromaticContact CD2-CE2 3.53Å; Y1052-F1107 HydrophobicContact CD2-CE2 3.53Å; Y1052-F1107 HydrophobicContact CE2-CB 4.48Å; Y1052-F1107 AromaticContact CE2-CD2 3.35Å; Y1052-F1107 HydrophobicContact CE2-CD2 3.35Å; Y1052-F1107 AromaticContact CE2-CE2 3.81Å; Y1052-F1107 HydrophobicContact CE2-CE2 3.81Å; Y1052-F1107 HydrophobicContact CE2-CG 4.19Å; Y1052-F1107 HydrophobicContact CG-CD2 4.46Å; Y1052-F1107 HydrophobicContact CG-CE2 4.21Å
1108	Q	44.3	Very low	42.8	Very low	47 Å²	47	64.3 Å²	64.3	22%	0.22	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	122.7	173.6	-176.2	174.8	6.7	0	0	110.1	N1110 N1114 T1116	Q1108-N1110 PolarHBondContact O-N 2.69Å; Q1108-N1114 PolarHBondContact NE2-O 2.77Å; Q1108-T1116 PolarHBondContact NE2-OG1 3.47Å
1109	N	40.9	Very low	42.3	Very low	90 Å²	90	65.8 Å²	65.8	48%	0.481	37%	0.368	S	S	.	.			trans	-73.8	112	-176.3	-155.6	-37.4	0	0	0	111.3	G1048 V1111	G1048-N1109 PolarHBondContact O-N 3.36Å; N1109-V1111 PolarHBondContact O-N 2.73Å
1110	N	36	Very low	42	Very low	137 Å²	137	62.3 Å²	62.3	73%	0.733	34%	0.341	S	S	*	.			trans	-89.8	56.5	-154.6	-163.4	8.1	0	0	0	114.2	Q1108	Q1108-N1110 PolarHBondContact O-N 2.69Å
1111	V	37.8	Very low	42.1	Very low	124 Å²	124	59.7 Å²	59.7	75%	0.752	33%	0.327	S	S	*	.	S	Bend	trans	-92.4	-20.9	-170.4	-175	0	0	0	0	113.7	N1109	N1109-V1111 PolarHBondContact O-N 2.73Å
1112	S	32.7	Very low	42.7	Very low	53 Å²	53	56.6 Å²	56.6	37%	0.371	31%	0.314	S	S	.	.	S	Bend	trans	-141.6	14.3	-163	59.5	0	0	0	0	116.5	N1114	S1112-N1114 PolarHBondContact O-N 3.44Å
1113	G	37	Very low	43.3	Very low	63 Å²	63	56.9 Å²	56.9	65%	0.649	32%	0.318	S	S	*	.	S	Bend	trans	69.6	-9.6	169	0	0	0	0	0	117.3	T1115	G1113-T1115 PolarHBondContact O-N 3.37Å
1114	N	37.2	Very low	43.9	Very low	77 Å²	77	55.8 Å²	55.8	41%	0.412	31%	0.312	S	S	.	.			trans	-88	104.3	174.8	-72.7	-30.6	0	0	0	110.1	Q1108 S1112 T1116	Q1108-N1114 PolarHBondContact NE2-O 2.77Å; S1112-N1114 PolarHBondContact O-N 3.44Å; N1114-T1116 PolarHBondContact O-OG1 3.43Å
1115	T	40.4	Very low	44.1	Very low	63 Å²	63	56.3 Å²	56.3	39%	0.387	32%	0.316	S	S	.	.			trans	-77.5	145.5	178.2	36.9	0	0	0	0	112.2	R961 G1113 Y1117	R961-T1115 CarbonylContact O-C 3.51Å; G1113-T1115 PolarHBondContact O-N 3.37Å; T1115-Y1117 HydrophobicContact CG2-CE1 4.42Å; T1115-Y1117 WeakPolarHBondContact OG1-CE1 3.36Å; T1115-Y1117 PolarHBondContact OG1-OH 2.86Å
1116	T	41.5	Very low	44.7	Very low	23 Å²	23	59.6 Å²	59.6	14%	0.141	33%	0.333	C	S	.	.			trans	-148.7	77.3	-167.9	-44.5	0	0	0	0	111.3	T958 R961 L1072 Q1108 N1114	T958-T1116 HydrophobicContact CG2-CG2 3.95Å; R961-T1116 PolarHBondContact O-N 3.49Å; L1072-T1116 HydrophobicContact CD1-CG2 3.86Å; Q1108-T1116 PolarHBondContact NE2-OG1 3.47Å; N1114-T1116 PolarHBondContact O-OG1 3.43Å
1117	Y	48.4	Very low	44.8	Very low	41 Å²	41	68 Å²	68	16%	0.161	37%	0.368	C	S	.	.			trans	-62.4	148	176.8	0.8	-92.3	0	0	0	113.2	T958 A959 R960 R961 F962 F963 T1115	T958-Y1117 CarbonylContact C-O 3.53Å; T958-Y1117 VanDerWaalsContact CA-O 3.32Å; T958-Y1117 WeakPolarHBondContact CA-O 3.44Å; T958-Y1117 VanDerWaalsContact CB-O 3.27Å; T958-Y1117 WeakPolarHBondContact CB-O 3.2Å; A959-Y1117 HydrophobicContact CB-CD2 4.39Å; A959-Y1117 PolarHBondContact N-O 3.35Å; A959-Y1117 WeakPolarHBondContact O-CD2 3.1Å; R960-Y1117 VanDerWaalsContact C-CD2 3.45Å; R960-Y1117 VanDerWaalsContact O-CE2 3.29Å; R960-Y1117 WeakPolarHBondContact O-CE2 2.12Å; R961-Y1117 VanDerWaalsContact CA-CZ 3.48Å; R961-Y1117 HydrophobicContact CB-CD1 4.12Å; R961-Y1117 HydrophobicContact CB-CD2 3.37Å; R961-Y1117 HydrophobicContact CB-CE2 4.2Å; R961-Y1117 HydrophobicContact CB-CG 3.27Å; R961-Y1117 WeakPolarHBondContact O-CB 2.13Å; R961-Y1117 WeakPolarHBondContact O-CD1 2.12Å; R961-Y1117 WeakPolarHBondContact O-CD2 3.27Å; R961-Y1117 WeakPolarHBondContact O-CE1 3.32Å; R961-Y1117 WeakPolarHBondContact O-CE2 3.29Å; R961-Y1117 PolarHBondContact O-N 2.99Å; R961-Y1117 PolarHBondContact O-OH 3.21Å; F962-Y1117 HydrophobicContact CB-CE1 4.13Å; F962-Y1117 HydrophobicContact CG-CE1 4.49Å; F962-Y1117 WeakPolarHBondContact O-CD1 3.24Å; F963-Y1117 HydrophobicContact CB-CD1 3.54Å; F963-Y1117 HydrophobicContact CB-CE1 4.32Å; F963-Y1117 AromaticContact CD2-CD1 3.57Å; F963-Y1117 HydrophobicContact CD2-CD1 3.57Å; F963-Y1117 HydrophobicContact CD2-CG 4.38Å; F963-Y1117 AromaticContact CG-CD1 3.97Å; F963-Y1117 HydrophobicContact CG-CD1 3.97Å; T1115-Y1117 HydrophobicContact CG2-CE1 4.42Å; T1115-Y1117 WeakPolarHBondContact OG1-CE1 3.36Å; T1115-Y1117 PolarHBondContact OG1-OH 2.86Å
1118	L	46.5	Very low	44.6	Very low	57 Å²	57	65.4 Å²	65.4	30%	0.298	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	138.2	173.6	-165.1	64.7	0	0	0	110.8	V956 L1121	V956-L1118 HydrophobicContact CG1-CD1 3.76Å; L1118-L1121 HydrophobicContact CD2-CB 4.31Å
1119	D	47.3	Very low	44.6	Very low	54 Å²	54	66.5 Å²	66.5	29%	0.289	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	-55.5	170.5	-165.5	56.5	0	0	0	109.5	K957 A959	K957-D1119 HydrophobicContact CB-CB 4.28Å; K957-D1119 HydrophobicContact CD-CB 4.18Å; K957-D1119 VanDerWaalsContact CD-OD2 3.24Å; K957-D1119 WeakPolarHBondContact CD-OD2 3.44Å; K957-D1119 WeakPolarHBondContact CE-OD2 3.36Å; K957-D1119 HydrophobicContact CG-CB 4.06Å; K957-D1119 IonicContact NZ-OD2 3.81Å; K957-D1119 PolarHBondContact NZ-OD2 3.2Å; K957-D1119 PolarHBondContact O-N 3.34Å; A959-D1119 HydrophobicContact CB-CB 3.82Å; A959-D1119 WeakPolarHBondContact CB-OD1 2.11Å
1120	Y	42.9	Very low	44.8	Very low	49 Å²	49	64.3 Å²	64.3	19%	0.192	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	157.2	165.9	57.7	-111.4	0	0	0	111.1	K957 L1030 F1122	K957-Y1120 HydrophobicContact CB-CD1 4.44Å; K957-Y1120 HydrophobicContact CB-CD2 4Å; K957-Y1120 HydrophobicContact CB-CE1 4.28Å; K957-Y1120 HydrophobicContact CB-CE2 3.8Å; K957-Y1120 HydrophobicContact CB-CG 4.32Å; K957-Y1120 HydrophobicContact CD-CD1 3.94Å; K957-Y1120 HydrophobicContact CD-CE1 3.31Å; K957-Y1120 HydrophobicContact CD-CE2 4.21Å; K957-Y1120 VanDerWaalsContact CD-CZ 3.46Å; K957-Y1120 HydrophobicContact CG-CE1 4.42Å; K957-Y1120 PolarHBondContact N-O 2.03Å; K957-Y1120 PolarHBondContact O-N 2.04Å; L1030-Y1120 HydrophobicContact CD2-CD1 4.32Å; L1030-Y1120 HydrophobicContact CD2-CE1 3.9Å; Y1120-F1122 AromaticContact CD2-CD2 3.64Å; Y1120-F1122 HydrophobicContact CD2-CD2 3.64Å; Y1120-F1122 HydrophobicContact CD2-CE2 4.27Å; Y1120-F1122 AromaticContact CE2-CD2 3.48Å; Y1120-F1122 HydrophobicContact CE2-CD2 3.48Å; Y1120-F1122 VanDerWaalsContact CE2-CD2 3.48Å; Y1120-F1122 AromaticContact CE2-CE2 3.88Å; Y1120-F1122 HydrophobicContact CE2-CE2 3.88Å; Y1120-F1122 HydrophobicContact CE2-CG 4.27Å
1121	L	50.2	Low	45.3	Very low	52 Å²	52	63.1 Å²	63.1	27%	0.272	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	113.7	168.9	-172.8	71.8	0	0	0	108.7	L954 V956 L1104 L1118 V1123	L954-L1121 HydrophobicContact CB-CD1 4.43Å; L954-L1121 HydrophobicContact CD2-CD2 4.2Å; L954-L1121 HydrophobicContact CD2-CG 4.4Å; V956-L1121 HydrophobicContact CG2-CD1 3.98Å; L1104-L1121 HydrophobicContact CD2-CD2 3.38Å; L1118-L1121 HydrophobicContact CD2-CB 4.31Å; L1121-V1123 HydrophobicContact CD2-CG2 4.39Å; L1121-V1123 HydrophobicContact CG-CG2 4.42Å
1122	F	52	Low	45.6	Very low	41 Å²	41	62.3 Å²	62.3	18%	0.18	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	122.1	171.5	-115.5	-129.4	0	0	0	108.9	L954 K955 S1028 Y1120 I1124	L954-F1122 WeakPolarHBondContact CA-O 3.03Å; K955-F1122 HydrophobicContact CB-CB 3.84Å; K955-F1122 PolarHBondContact N-O 2.88Å; K955-F1122 PolarHBondContact O-N 3.29Å; S1028-F1122 WeakPolarHBondContact OG-CE1 3.4Å; S1028-F1122 WeakPolarHBondContact OG-CZ 3.46Å; Y1120-F1122 AromaticContact CD2-CD2 3.64Å; Y1120-F1122 HydrophobicContact CD2-CD2 3.64Å; Y1120-F1122 HydrophobicContact CD2-CE2 4.27Å; Y1120-F1122 AromaticContact CE2-CD2 3.48Å; Y1120-F1122 HydrophobicContact CE2-CD2 3.48Å; Y1120-F1122 VanDerWaalsContact CE2-CD2 3.48Å; Y1120-F1122 AromaticContact CE2-CE2 3.88Å; Y1120-F1122 HydrophobicContact CE2-CE2 3.88Å; Y1120-F1122 HydrophobicContact CE2-CG 4.27Å; F1122-I1124 HydrophobicContact CB-CG1 4.33Å; F1122-I1124 HydrophobicContact CD1-CD1 4.02Å; F1122-I1124 HydrophobicContact CD1-CG1 3.91Å
1123	V	53.7	Low	45.9	Very low	38 Å²	38	62.9 Å²	62.9	23%	0.23	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	104.5	173.5	-167.2	0	0	0	0	106.9	W952 L954 I1098 L1121	W952-V1123 HydrophobicContact CB-CG1 4Å; W952-V1123 HydrophobicContact CD2-CG1 4.07Å; W952-V1123 HydrophobicContact CE3-CG1 3.72Å; W952-V1123 HydrophobicContact CG-CG1 4.2Å; W952-V1123 HydrophobicContact CZ3-CG1 4.49Å; L954-V1123 HydrophobicContact CD2-CB 4.33Å; L954-V1123 HydrophobicContact CD2-CG1 4.01Å; L954-V1123 HydrophobicContact CD2-CG2 3.85Å; I1098-V1123 HydrophobicContact CD1-CG1 4.46Å; L1121-V1123 HydrophobicContact CD2-CG2 4.39Å; L1121-V1123 HydrophobicContact CG-CG2 4.42Å
1124	I	52.4	Low	46	Very low	12 Å²	12	64.1 Å²	64.1	6%	0.062	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	130.4	-171	-48.7	177.4	0	0	0	108.5	W952 M953 K955 F1122 L1126	W952-I1124 CarbonylContact C-O 3.5Å; W952-I1124 VanDerWaalsContact CA-O 3.26Å; W952-I1124 WeakPolarHBondContact CA-O 3.4Å; W952-I1124 VanDerWaalsContact CE3-C 3.47Å; M953-I1124 PolarHBondContact N-O 3.08Å; M953-I1124 PolarHBondContact O-N 3.45Å; K955-I1124 HydrophobicContact CB-CD1 4.31Å; K955-I1124 HydrophobicContact CD-CD1 4.39Å; F1122-I1124 HydrophobicContact CB-CG1 4.33Å; F1122-I1124 HydrophobicContact CD1-CD1 4.02Å; F1122-I1124 HydrophobicContact CD1-CG1 3.91Å; I1124-L1126 PolarHBondContact O-N 2.91Å
1125	P	51.1	Low	46.2	Very low	24 Å²	24	65.8 Å²	65.8	16%	0.156	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	137	170.6	-16.4	26.6	0	0	0	109.3	W952 K1127 S1128	W952-P1125 HydrophobicContact CE3-CB 4.28Å; W952-P1125 HydrophobicContact CE3-CG 4Å; W952-P1125 VanDerWaalsContact CE3-N 3.32Å; W952-P1125 HydrophobicContact CH2-CG 4.03Å; W952-P1125 HydrophobicContact CZ3-CB 4.23Å; W952-P1125 HydrophobicContact CZ3-CG 3.53Å; P1125-K1127 PolarHBondContact O-N 3.17Å; P1125-S1128 PolarHBondContact O-N 3.05Å
1126	L	56	Low	45.9	Very low	73 Å²	73	66.2 Å²	66.2	38%	0.382	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-58.3	-20.8	-179.8	-175.9	64	0	0	0	112.8	K951 M953 A1095 I1124 S1128	K951-L1126 HydrophobicContact CB-CB 3.94Å; K951-L1126 HydrophobicContact CB-CD2 3.85Å; K951-L1126 HydrophobicContact CD-CD2 3.76Å; K951-L1126 HydrophobicContact CG-CD2 4.44Å; K951-L1126 WeakPolarHBondContact O-CB 3.32Å; K951-L1126 PolarHBondContact O-N 2.96Å; M953-L1126 HydrophobicContact CG-CD1 3.75Å; M953-L1126 HydrophobicContact SD-CD1 3.92Å; A1095-L1126 HydrophobicContact CB-CD1 4.05Å; A1095-L1126 HydrophobicContact CB-CD2 3.87Å; I1124-L1126 PolarHBondContact O-N 2.91Å; L1126-S1128 VanDerWaalsContact C-N 3.35Å
1127	K	47.2	Very low	45.4	Very low	204 Å²	204	70.9 Å²	70.9	89%	0.887	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-75.2	-18.8	176.6	-53.8	173.3	-171.4	169.9	0	113.9	P1125	P1125-K1127 PolarHBondContact O-N 3.17Å
1128	S	40.9	Very low	44.8	Very low	51 Å²	51	73 Å²	73	36%	0.357	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-115.7	19.1	-168.5	-45.1	0	0	0	0	112.6	E1027 P1125 L1126	E1027-S1128 VanDerWaalsContact OE2-CB 3.32Å; E1027-S1128 WeakPolarHBondContact OE2-CB 3.37Å; E1027-S1128 PolarHBondContact OE2-OG 3.1Å; P1125-S1128 PolarHBondContact O-N 3.05Å; L1126-S1128 VanDerWaalsContact C-N 3.35Å
1129	Y	45.1	Very low	44.2	Very low	70 Å²	70	74.4 Å²	74.4	28%	0.275	40%	0.395	S	S	.	.			trans	-96.3	140.4	179.1	170.5	-105.9	0	0	0	112.4	M953 D1131 L1133 L1134	M953-Y1129 HydrophobicContact CE-CD1 3.91Å; M953-Y1129 HydrophobicContact CE-CD2 3.21Å; M953-Y1129 HydrophobicContact CE-CE1 4.18Å; M953-Y1129 HydrophobicContact CE-CE2 3.51Å; M953-Y1129 HydrophobicContact CE-CG 3.43Å; M953-Y1129 VanDerWaalsContact CE-CG 3.43Å; M953-Y1129 HydrophobicContact SD-CD1 4.33Å; M953-Y1129 HydrophobicContact SD-CG 4.22Å; Y1129-D1131 WeakPolarHBondContact CE1-OD1 3.12Å; Y1129-D1131 PolarHBondContact OH-OD1 3.34Å; Y1129-L1133 HydrophobicContact CD2-CD1 4.28Å; Y1129-L1134 WeakPolarHBondContact OH-CD1 2.93Å
1130	S	44.3	Very low	43.5	Very low	45 Å²	45	74.4 Å²	74.4	32%	0.315	39%	0.394	S	S	.	.			trans	-133.2	146	165	178.8	0	0	0	0	110.3	D1132 L1133	S1130-D1132 PolarHBondContact O-N 3.04Å; S1130-D1132 PolarHBondContact OG-N 2.92Å; S1130-D1132 PolarHBondContact OG-OD2 3.19Å; S1130-L1133 VanDerWaalsContact O-CB 3.29Å; S1130-L1133 WeakPolarHBondContact O-CB 3.48Å; S1130-L1133 WeakPolarHBondContact O-CG 3.3Å; S1130-L1133 PolarHBondContact O-N 2.62Å; S1130-L1133 VanDerWaalsContact O-N 3.1Å
1131	D	47.5	Very low	43.2	Very low	112 Å²	112	78.5 Å²	78.5	60%	0.599	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-60.9	-21.6	172.2	-67.2	-37.9	0	0	0	112.9	Y1129 L1133 L1134	Y1129-D1131 WeakPolarHBondContact CE1-OD1 3.12Å; Y1129-D1131 PolarHBondContact OH-OD1 3.34Å; D1131-L1133 PolarHBondContact O-N 3.1Å; D1131-L1133 VanDerWaalsContact O-N 3.14Å; D1131-L1134 WeakPolarHBondContact O-CB 3.47Å; D1131-L1134 PolarHBondContact O-N 3.15Å
1132	D	42.9	Very low	42.7	Very low	106 Å²	106	79 Å²	79	57%	0.567	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-56.7	-28.5	172.8	-58.4	-57.8	0	0	0	112.2	S1130 L1134 I1135	S1130-D1132 PolarHBondContact O-N 3.04Å; S1130-D1132 PolarHBondContact OG-N 2.92Å; S1130-D1132 PolarHBondContact OG-OD2 3.19Å; D1132-L1134 PolarHBondContact O-N 3.13Å; D1132-I1135 PolarHBondContact O-N 3.28Å; D1132-I1135 VanDerWaalsContact O-N 3.1Å
1133	L	38.6	Very low	41.9	Very low	65 Å²	65	81.7 Å²	81.7	34%	0.34	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	-68.3	-2.5	177.3	-60	172.8	0	0	0	113.3	K955 I1025 Y1129 S1130 D1131	K955-L1133 PolarHBondContact NZ-O 3.34Å; I1025-L1133 HydrophobicContact CD1-CD2 4.47Å; Y1129-L1133 HydrophobicContact CD2-CD1 4.28Å; S1130-L1133 VanDerWaalsContact O-CB 3.29Å; S1130-L1133 WeakPolarHBondContact O-CB 3.48Å; S1130-L1133 WeakPolarHBondContact O-CG 3.3Å; S1130-L1133 PolarHBondContact O-N 2.62Å; S1130-L1133 VanDerWaalsContact O-N 3.1Å; D1131-L1133 PolarHBondContact O-N 3.1Å; D1131-L1133 VanDerWaalsContact O-N 3.14Å
1134	L	41	Very low	41.2	Very low	90 Å²	90	84.5 Å²	84.5	47%	0.471	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-106.1	-5.4	174.7	-57	179.9	0	0	0	113.5	I1084 Y1129 D1131 D1132	I1084-L1134 HydrophobicContact CD1-CD1 3.92Å; I1084-L1134 HydrophobicContact CD1-CD2 3.82Å; I1084-L1134 HydrophobicContact CD1-CG 4.45Å; I1084-L1134 HydrophobicContact CG1-CD2 4.25Å; Y1129-L1134 WeakPolarHBondContact OH-CD1 2.93Å; D1131-L1134 WeakPolarHBondContact O-CB 3.47Å; D1131-L1134 PolarHBondContact O-N 3.15Å; D1132-L1134 PolarHBondContact O-N 3.13Å
1135	I	39.6	Very low	40.5	Very low	111 Å²	111	85.7 Å²	85.7	57%	0.569	45%	0.45	S	S	*	.	S	Bend	trans	-91.4	126.3	-176.8	-53.3	179.7	0	0	0	110	D1132	D1132-I1135 PolarHBondContact O-N 3.28Å; D1132-I1135 VanDerWaalsContact O-N 3.1Å
1136	P	34.5	Very low	40.2	Very low	73 Å²	73	88.1 Å²	88.1	47%	0.474	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-67	143.8	178	-20.8	33.1	0	0	0	113.3
1137	Q	32.4	Very low	39.6	Very low	121 Å²	121	87.1 Å²	87.1	57%	0.565	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-94.1	157.9	178.1	-69.7	-168.8	-4.3	0	0	113.4	V1139 E1140	Q1137-V1139 VanDerWaalsContact C-N 3.26Å; Q1137-V1139 PolarHBondContact O-N 3.2Å; Q1137-E1140 HydrophobicContact CB-CG 4.43Å; Q1137-E1140 PolarHBondContact N-OE2 2.73Å; Q1137-E1140 WeakPolarHBondContact O-CB 3.43Å; Q1137-E1140 PolarHBondContact O-N 3.44Å
1138	S	35	Very low	39.5	Very low	84 Å²	84	82 Å²	82	59%	0.587	45%	0.445	S	S	*	.	H	α-helix	trans	-57	-34.1	-178.8	51.4	0	0	0	0	114	E1140 H1141 L1142	S1138-E1140 PolarHBondContact O-N 2.82Å; S1138-H1141 PolarHBondContact O-N 3.14Å; S1138-L1142 PolarHBondContact O-N 2.76Å; S1138-L1142 VanDerWaalsContact O-N 3.13Å
1139	V	33.7	Very low	40.1	Very low	88 Å²	88	79.7 Å²	79.7	53%	0.533	43%	0.429	S	S	.	.	H	α-helix	trans	-63.2	-30	176.6	-175.1	0	0	0	0	111.9	Q1137 L1142 Q1143	Q1137-V1139 VanDerWaalsContact C-N 3.26Å; Q1137-V1139 PolarHBondContact O-N 3.2Å; V1139-L1142 VanDerWaalsContact O-CB 3.31Å; V1139-L1142 WeakPolarHBondContact O-CB 3.31Å; V1139-L1142 PolarHBondContact O-N 2.62Å; V1139-Q1143 PolarHBondContact O-N 3.04Å
1140	E	32.5	Very low	40	Very low	54 Å²	54	79.4 Å²	79.4	25%	0.252	44%	0.438	S	S	.	.	H	α-helix	trans	-76.3	-27.5	-179.8	-50.4	-170.2	121.8	0	0	111.8	R1082 Q1137 S1138	R1082-E1140 IonicContact CZ-OE1 2.76Å; R1082-E1140 IonicContact NH1-OE1 3.82Å; R1082-E1140 PolarHBondContact NH1-OE1 3.16Å; R1082-E1140 IonicContact NH1-OE2 2.78Å; R1082-E1140 PolarHBondContact NH1-OE2 2.88Å; R1082-E1140 IonicContact NH2-OE1 3.9Å; R1082-E1140 PolarHBondContact NH2-OE1 3.18Å; Q1137-E1140 HydrophobicContact CB-CG 4.43Å; Q1137-E1140 PolarHBondContact N-OE2 2.73Å; Q1137-E1140 WeakPolarHBondContact O-CB 3.43Å; Q1137-E1140 PolarHBondContact O-N 3.44Å; S1138-E1140 PolarHBondContact O-N 2.82Å
1141	H	37.4	Very low	40.1	Very low	135 Å²	135	84.3 Å²	84.3	63%	0.625	46%	0.456	S	S	*	.	H	α-helix	trans	-71.7	-38.3	164.9	-77.4	163.6	0	0	0	112.2	S1138 Q1143 H1144 S1145	S1138-H1141 PolarHBondContact O-N 3.14Å; H1141-Q1143 VanDerWaalsContact C-N 3.33Å; H1141-Q1143 PolarHBondContact O-N 3.28Å; H1141-H1144 PolarHBondContact O-N 3.13Å; H1141-H1144 VanDerWaalsContact O-N 3.12Å; H1141-S1145 PolarHBondContact O-N 2.88Å; H1141-S1145 VanDerWaalsContact O-N 3.08Å
1142	L	37.8	Very low	40.1	Very low	61 Å²	61	82.6 Å²	82.6	32%	0.319	44%	0.444	S	S	.	.	H	α-helix	trans	-53	-48.5	-178.5	-118.9	81.2	0	0	0	111.9	S1138 V1139 H1144 S1145 L1146 L1170 L1174	S1138-L1142 PolarHBondContact O-N 2.76Å; S1138-L1142 VanDerWaalsContact O-N 3.13Å; V1139-L1142 VanDerWaalsContact O-CB 3.31Å; V1139-L1142 WeakPolarHBondContact O-CB 3.31Å; V1139-L1142 PolarHBondContact O-N 2.62Å; L1142-H1144 VanDerWaalsContact C-N 3.33Å; L1142-H1144 PolarHBondContact O-N 2.64Å; L1142-S1145 PolarHBondContact O-N 3.42Å; L1142-L1146 HydrophobicContact CB-CD1 4.36Å; L1142-L1146 HydrophobicContact CD2-CD1 4.34Å; L1142-L1146 HydrophobicContact CG-CD1 4.26Å; L1142-L1146 WeakPolarHBondContact O-CB 3.05Å; L1142-L1146 VanDerWaalsContact O-CD1 3.23Å; L1142-L1146 WeakPolarHBondContact O-CD1 3.38Å; L1142-L1146 PolarHBondContact O-N 2.96Å; L1142-L1170 HydrophobicContact CD1-CD1 4.44Å; L1142-L1170 HydrophobicContact CG-CD1 4.23Å; L1142-L1174 HydrophobicContact CD2-CD1 4.01Å; L1142-L1174 HydrophobicContact CD2-CG 4.29Å
1143	Q	37.1	Very low	40.1	Very low	98 Å²	98	80.1 Å²	80.1	46%	0.458	43%	0.43	S	S	.	.	H	α-helix	trans	-61.3	-38.5	-179.2	-68.3	-176.9	-24.6	0	0	113	V1078 V1139 H1141 A1147	V1078-Q1143 HydrophobicContact CG2-CB 3.97Å; V1078-Q1143 VanDerWaalsContact CG2-OE1 3.25Å; V1139-Q1143 PolarHBondContact O-N 3.04Å; H1141-Q1143 VanDerWaalsContact C-N 3.33Å; H1141-Q1143 PolarHBondContact O-N 3.28Å; Q1143-A1147 PolarHBondContact O-N 3Å; Q1143-A1147 VanDerWaalsContact O-N 3.15Å
1144	H	37.8	Very low	40.1	Very low	98 Å²	98	81.3 Å²	81.3	45%	0.454	44%	0.444	S	S	.	.	H	α-helix	trans	-72.9	-37.1	-178.6	-151.2	-78.3	0	0	0	112	H1141 L1142	H1141-H1144 PolarHBondContact O-N 3.13Å; H1141-H1144 VanDerWaalsContact O-N 3.12Å; L1142-H1144 VanDerWaalsContact C-N 3.33Å; L1142-H1144 PolarHBondContact O-N 2.64Å
1145	S	38.3	Very low	40.1	Very low	37 Å²	37	82.9 Å²	82.9	26%	0.259	45%	0.449	S	S	.	.	H	α-helix	trans	-74.6	-34.6	172.8	-63.6	0	0	0	0	112.6	H1141 L1142 A1147 N1148 C1149	H1141-S1145 PolarHBondContact O-N 2.88Å; H1141-S1145 VanDerWaalsContact O-N 3.08Å; L1142-S1145 PolarHBondContact O-N 3.42Å; S1145-A1147 PolarHBondContact O-N 3.37Å; S1145-N1148 PolarHBondContact O-N 2.95Å; S1145-C1149 PolarHBondContact O-N 2.82Å
1146	L	44.3	Very low	40.1	Very low	75 Å²	75	80.9 Å²	80.9	39%	0.393	44%	0.443	S	S	.	.	H	α-helix	trans	-60.2	-36.3	173.4	-105.1	107.4	0	0	0	111.4	L1142 C1149 S1150 L1170 L1174	L1142-L1146 HydrophobicContact CB-CD1 4.36Å; L1142-L1146 HydrophobicContact CD2-CD1 4.34Å; L1142-L1146 HydrophobicContact CG-CD1 4.26Å; L1142-L1146 WeakPolarHBondContact O-CB 3.05Å; L1142-L1146 VanDerWaalsContact O-CD1 3.23Å; L1142-L1146 WeakPolarHBondContact O-CD1 3.38Å; L1142-L1146 PolarHBondContact O-N 2.96Å; L1146-C1149 PolarHBondContact O-N 3.47Å; L1146-S1150 WeakPolarHBondContact O-CB 3.38Å; L1146-S1150 PolarHBondContact O-N 2.02Å; L1146-L1170 HydrophobicContact CB-CD2 4.39Å; L1146-L1170 HydrophobicContact CD1-CD2 4.05Å; L1146-L1170 HydrophobicContact CG-CD2 4.05Å; L1146-L1174 HydrophobicContact CD1-CD1 4.05Å
1147	A	43.1	Very low	40.3	Very low	52 Å²	52	81.1 Å²	81.1	43%	0.43	44%	0.44	S	S	.	.	H	α-helix	trans	-61.6	-44.4	176.5	0	0	0	0	0	112.3	Q1143 S1145 S1150	Q1143-A1147 PolarHBondContact O-N 3Å; Q1143-A1147 VanDerWaalsContact O-N 3.15Å; S1145-A1147 PolarHBondContact O-N 3.37Å; A1147-S1150 WeakPolarHBondContact O-CB 3.13Å; A1147-S1150 PolarHBondContact O-N 2.69Å; A1147-S1150 PolarHBondContact O-OG 3.32Å
1148	N	46.5	Very low	40.7	Very low	95 Å²	95	77.7 Å²	77.7	51%	0.508	43%	0.425	S	S	.	.	H	α-helix	trans	-68.6	-43.9	174.7	-77.9	-3.5	0	0	0	111.8	S1145 S1150	S1145-N1148 PolarHBondContact O-N 2.95Å; N1148-S1150 PolarHBondContact O-N 3.24Å
1149	C	52.7	Low	41.5	Very low	3 Å²	3	77.9 Å²	77.9	2%	0.02	42%	0.417	C	S	.	.	H	α-helix	trans	-58.4	-31.8	172.6	-87.1	0	0	0	0	113.2	S1145 L1146 Q1151 H1152 L1153 C1167 L1170	S1145-C1149 PolarHBondContact O-N 2.82Å; L1146-C1149 PolarHBondContact O-N 3.47Å; C1149-Q1151 PolarHBondContact O-N 2.82Å; C1149-Q1151 VanDerWaalsContact O-N 3.08Å; C1149-H1152 CarbonylContact O-C 3.57Å; C1149-H1152 WeakPolarHBondContact O-CA 3.12Å; C1149-H1152 PolarHBondContact O-N 3.47Å; C1149-L1153 HydrophobicContact CB-CD1 3.74Å; C1149-L1153 HydrophobicContact CB-CG 4.2Å; C1149-L1153 WeakPolarHBondContact O-CG 3.02Å; C1149-L1153 PolarHBondContact O-N 2.9Å; C1149-C1167 VanDerWaalsContact CA-SG 3.55Å; C1149-C1167 HydrophobicContact CB-CB 4.34Å; C1149-C1167 WeakPolarHBondContact CB-SG 3.41Å; C1149-C1167 WeakPolarHBondContact SG-CA 3.09Å; C1149-C1167 WeakPolarHBondContact SG-CB 3.5Å; C1149-C1167 CovalentContact SG-SG 2.04Å; C1149-C1167 PolarHBondContact SG-SG 2.97Å; C1149-L1170 HydrophobicContact CB-CD2 4.15Å; C1149-L1170 WeakPolarHBondContact SG-CD2 3.47Å
1150	S	42.8	Very low	42.4	Very low	65 Å²	65	75.2 Å²	75.2	46%	0.455	40%	0.399	S	S	.	.	H	α-helix	trans	-58.3	-29.4	-170.9	73.8	0	0	0	0	113.8	L1146 A1147 N1148 H1152 L1153 S1154	L1146-S1150 WeakPolarHBondContact O-CB 3.38Å; L1146-S1150 PolarHBondContact O-N 2.02Å; A1147-S1150 WeakPolarHBondContact O-CB 3.13Å; A1147-S1150 PolarHBondContact O-N 2.69Å; A1147-S1150 PolarHBondContact O-OG 3.32Å; N1148-S1150 PolarHBondContact O-N 3.24Å; S1150-H1152 VanDerWaalsContact C-N 3.31Å; S1150-H1152 PolarHBondContact O-N 2.69Å; S1150-L1153 PolarHBondContact O-N 2.88Å; S1150-S1154 PolarHBondContact O-OG 3.03Å
1151	Q	46.5	Very low	43.5	Very low	148 Å²	148	79.1 Å²	79.1	69%	0.692	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-23.6	176.3	-58.9	-173.3	12.2	0	0	113.1	C1149 S1154	C1149-Q1151 PolarHBondContact O-N 2.82Å; C1149-Q1151 VanDerWaalsContact O-N 3.08Å; Q1151-S1154 PolarHBondContact O-OG 2.87Å
1152	H	47.8	Very low	44.5	Very low	75 Å²	75	76.5 Å²	76.5	35%	0.347	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-22.6	175.4	-68.9	-73.6	0	0	0	112.9	C1149 S1150 S1154 L1158	C1149-H1152 CarbonylContact O-C 3.57Å; C1149-H1152 WeakPolarHBondContact O-CA 3.12Å; C1149-H1152 PolarHBondContact O-N 3.47Å; S1150-H1152 VanDerWaalsContact C-N 3.31Å; S1150-H1152 PolarHBondContact O-N 2.69Å; H1152-S1154 VanDerWaalsContact C-N 3.32Å; H1152-L1158 HydrophobicContact CB-CD2 3.82Å; H1152-L1158 WeakPolarHBondContact ND1-CD2 3.38Å
1153	L	42.6	Very low	45.6	Very low	55 Å²	55	74.6 Å²	74.6	29%	0.288	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-0.7	179.8	-66.9	174.6	0	0	0	114.4	L865 C1149 S1150 I1171	L865-L1153 HydrophobicContact CD1-CD1 3.65Å; L865-L1153 HydrophobicContact CD1-CD2 3.65Å; L865-L1153 HydrophobicContact CD1-CG 4.32Å; C1149-L1153 HydrophobicContact CB-CD1 3.74Å; C1149-L1153 HydrophobicContact CB-CG 4.2Å; C1149-L1153 WeakPolarHBondContact O-CG 3.02Å; C1149-L1153 PolarHBondContact O-N 2.9Å; S1150-L1153 PolarHBondContact O-N 2.88Å; L1153-I1171 HydrophobicContact CD2-CD1 4.32Å
1154	S	37.8	Very low	46.9	Very low	90 Å²	90	74 Å²	74	63%	0.629	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-8.5	174.9	51.7	0	0	0	0	114.6	S1150 Q1151 H1152	S1150-S1154 PolarHBondContact O-OG 3.03Å; Q1151-S1154 PolarHBondContact O-OG 2.87Å; H1152-S1154 VanDerWaalsContact C-N 3.32Å
1155	E	41.9	Very low	48.2	Very low	122 Å²	122	74.9 Å²	74.9	57%	0.57	40%	0.403	S	S	*	.			trans	-93.1	118	-179.1	-82	-83.6	133.6	0	0	111	L1157 L1158	E1155-L1157 PolarHBondContact O-N 3.24Å; E1155-L1158 HydrophobicContact CB-CB 4.3Å
1156	P	39.6	Very low	49.3	Very low	70 Å²	70	79.1 Å²	79.1	46%	0.455	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-4.5	-172.9	-23.6	34.4	0	0	0	117.1	F892	F892-P1156 HydrophobicContact CD1-CB 4.46Å; F892-P1156 HydrophobicContact CE1-CB 3.96Å
1157	L	38.3	Very low	50.3	Low	77 Å²	77	75.9 Å²	75.9	40%	0.403	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.7	5.3	-164.5	-71.3	171.4	0	0	0	115	T891 P893 E1155 H1159	T891-L1157 WeakPolarHBondContact O-CD1 3.27Å; P893-L1157 HydrophobicContact CG-CD1 3.9Å; P893-L1157 HydrophobicContact CG-CD2 3.93Å; E1155-L1157 PolarHBondContact O-N 3.24Å; L1157-H1159 PolarHBondContact O-N 3.37Å
1158	L	40.4	Very low	51.5	Low	49 Å²	49	74.5 Å²	74.5	26%	0.257	39%	0.387	S	S	.	.			trans	-72	96.7	-176.4	-154.6	68.2	0	0	0	109.8	H1152 E1155 I1163	H1152-L1158 HydrophobicContact CB-CD2 3.82Å; H1152-L1158 WeakPolarHBondContact ND1-CD2 3.38Å; E1155-L1158 HydrophobicContact CB-CB 4.3Å; L1158-I1163 HydrophobicContact CB-CG1 4.37Å; L1158-I1163 HydrophobicContact CD2-CG1 3.78Å; L1158-I1163 HydrophobicContact CG-CG1 4.07Å
1159	H	51.6	Low	52.4	Low	88 Å²	88	76.2 Å²	76.2	41%	0.407	39%	0.39	S	S	.	.			trans	-44.1	149.1	171.9	-96.1	73.2	0	0	0	110.1	L1157 K1161 T1162 I1163	L1157-H1159 PolarHBondContact O-N 3.37Å; H1159-K1161 HydrophobicContact CB-CB 4.09Å; H1159-K1161 PolarHBondContact O-N 3.01Å; H1159-T1162 PolarHBondContact N-OG1 3.31Å; H1159-T1162 PolarHBondContact O-N 3.14Å; H1159-T1162 PolarHBondContact O-OG1 3.11Å; H1159-I1163 PolarHBondContact O-N 2.05Å
1160	M	54.1	Low	52.9	Low	32 Å²	32	77 Å²	77	16%	0.158	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-5.2	169	-149.4	65.9	160.8	0	0	113.5	I864 I1163 K1168 I1171 Y1200	I864-M1160 HydrophobicContact CG2-CE 4.22Å; I864-M1160 HydrophobicContact CG2-SD 4.3Å; M1160-I1163 HydrophobicContact SD-CB 4.46Å; M1160-I1163 HydrophobicContact SD-CD1 3.69Å; M1160-K1168 HydrophobicContact CE-CB 4.31Å; M1160-K1168 HydrophobicContact CE-CG 3.97Å; M1160-K1168 HydrophobicContact CG-CD 4.43Å; M1160-K1168 HydrophobicContact CG-CG 4.47Å; M1160-K1168 WeakPolarHBondContact O-CE 3.07Å; M1160-K1168 PolarHBondContact O-NZ 3.21Å; M1160-K1168 HydrophobicContact SD-CG 4.26Å; M1160-I1171 HydrophobicContact CE-CB 4.2Å; M1160-I1171 HydrophobicContact CE-CD1 3.95Å; M1160-I1171 HydrophobicContact CE-CG2 3.92Å; M1160-I1171 HydrophobicContact SD-CD1 4.33Å; M1160-Y1200 HydrophobicContact CE-CD1 3.35Å; M1160-Y1200 HydrophobicContact CE-CD2 4.16Å; M1160-Y1200 HydrophobicContact CE-CE1 3.61Å; M1160-Y1200 HydrophobicContact CE-CE2 4.4Å; M1160-Y1200 HydrophobicContact CE-CG 3.64Å; M1160-Y1200 HydrophobicContact CG-CD1 4.47Å; M1160-Y1200 HydrophobicContact CG-CD2 3.76Å; M1160-Y1200 HydrophobicContact CG-CE2 4.46Å; M1160-Y1200 HydrophobicContact CG-CG 3.76Å; M1160-Y1200 HydrophobicContact SD-CG 4.45Å
1161	K	55.8	Low	54	Low	136 Å²	136	74.1 Å²	74.1	59%	0.591	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-11.3	170.9	-59.3	171.7	-175.5	137.3	0	113.1	H1159 E1198	H1159-K1161 HydrophobicContact CB-CB 4.09Å; H1159-K1161 PolarHBondContact O-N 3.01Å; K1161-E1198 IonicContact NZ-OE1 3.68Å; K1161-E1198 PolarHBondContact NZ-OE1 3.41Å; K1161-E1198 IonicContact NZ-OE2 3.93Å
1162	T	57.6	Low	55.2	Low	81 Å²	81	67.2 Å²	67.2	50%	0.497	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.6	-8.5	-173.6	34.3	0	0	0	0	114.5	H1159	H1159-T1162 PolarHBondContact N-OG1 3.31Å; H1159-T1162 PolarHBondContact O-N 3.14Å; H1159-T1162 PolarHBondContact O-OG1 3.11Å
1163	I	60.9	Low	56	Low	20 Å²	20	64.9 Å²	64.9	10%	0.103	33%	0.333	C	S	.	.	S	Bend	trans	-71.2	141.5	162.4	-68.5	166.5	0	0	0	108.3	L1158 H1159 M1160 C1167 K1168 I1171	L1158-I1163 HydrophobicContact CB-CG1 4.37Å; L1158-I1163 HydrophobicContact CD2-CG1 3.78Å; L1158-I1163 HydrophobicContact CG-CG1 4.07Å; H1159-I1163 PolarHBondContact O-N 2.05Å; M1160-I1163 HydrophobicContact SD-CB 4.46Å; M1160-I1163 HydrophobicContact SD-CD1 3.69Å; I1163-C1167 HydrophobicContact CG2-CB 3.77Å; I1163-K1168 HydrophobicContact CB-CG 4.45Å; I1163-K1168 HydrophobicContact CG2-CG 4.01Å; I1163-K1168 WeakPolarHBondContact O-CE 3.38Å; I1163-I1171 HydrophobicContact CD1-CD1 4.16Å; I1163-I1171 HydrophobicContact CG2-CD1 4.18Å
1164	D	64.9	Low	56.8	Low	86 Å²	86	64.9 Å²	64.9	46%	0.46	33%	0.333	S	S	.	.			trans	-65.5	150.3	177.8	176.4	70.7	0	0	0	112.9	E1166 C1167 K1168	D1164-E1166 PolarHBondContact O-N 2.04Å; D1164-E1166 WeakPolarHBondContact OD2-CA 3.1Å; D1164-E1166 WeakPolarHBondContact OD2-CB 3.47Å; D1164-E1166 PolarHBondContact OD2-N 3.09Å; D1164-C1167 HydrophobicContact CB-CB 4.34Å; D1164-C1167 CarbonylContact O-C 3.54Å; D1164-C1167 WeakPolarHBondContact O-CA 3.31Å; D1164-C1167 WeakPolarHBondContact O-CB 3.18Å; D1164-C1167 PolarHBondContact O-N 2.79Å; D1164-C1167 VanDerWaalsContact O-N 3.11Å; D1164-K1168 WeakPolarHBondContact O-CG 3.14Å; D1164-K1168 PolarHBondContact O-N 3.22Å
1165	E	65.3	Low	58	Low	117 Å²	117	60.6 Å²	60.6	55%	0.547	30%	0.303	S	S	.	.	H	α-helix	trans	-65.7	-33.6	-177.4	-71.9	-62.4	150.6	0	0	114	C1167 K1168 K1169	E1165-C1167 VanDerWaalsContact C-N 3.27Å; E1165-C1167 PolarHBondContact O-N 3.34Å; E1165-K1168 PolarHBondContact O-N 3.42Å; E1165-K1168 WeakPolarHBondContact OE1-CE 3.24Å; E1165-K1168 IonicContact OE1-NZ 2.7Å; E1165-K1168 PolarHBondContact OE1-NZ 3.25Å; E1165-K1169 WeakPolarHBondContact O-CG 3.29Å; E1165-K1169 PolarHBondContact O-N 3.13Å; E1165-K1169 VanDerWaalsContact O-N 3.1Å
1166	E	60.4	Low	59.1	Low	125 Å²	125	54.8 Å²	54.8	58%	0.584	28%	0.275	S	S	*	.	H	α-helix	trans	-65	-37.3	172.6	-159.8	171.8	-95.1	0	0	110	D1164 L1170	D1164-E1166 PolarHBondContact O-N 2.04Å; D1164-E1166 WeakPolarHBondContact OD2-CA 3.1Å; D1164-E1166 WeakPolarHBondContact OD2-CB 3.47Å; D1164-E1166 PolarHBondContact OD2-N 3.09Å; E1166-L1170 PolarHBondContact O-N 3.37Å
1167	C	65.4	Low	59.9	Low	7 Å²	7	54.8 Å²	54.8	5%	0.047	27%	0.272	C	S	.	.	H	α-helix	trans	-75.1	-32.5	175.3	-165.6	0	0	0	0	113.7	C1149 I1163 D1164 E1165 L1170 I1171	C1149-C1167 VanDerWaalsContact CA-SG 3.55Å; C1149-C1167 HydrophobicContact CB-CB 4.34Å; C1149-C1167 WeakPolarHBondContact CB-SG 3.41Å; C1149-C1167 WeakPolarHBondContact SG-CA 3.09Å; C1149-C1167 WeakPolarHBondContact SG-CB 3.5Å; C1149-C1167 CovalentContact SG-SG 2.04Å; C1149-C1167 PolarHBondContact SG-SG 2.97Å; I1163-C1167 HydrophobicContact CG2-CB 3.77Å; D1164-C1167 HydrophobicContact CB-CB 4.34Å; D1164-C1167 CarbonylContact O-C 3.54Å; D1164-C1167 WeakPolarHBondContact O-CA 3.31Å; D1164-C1167 WeakPolarHBondContact O-CB 3.18Å; D1164-C1167 PolarHBondContact O-N 2.79Å; D1164-C1167 VanDerWaalsContact O-N 3.11Å; E1165-C1167 VanDerWaalsContact C-N 3.27Å; E1165-C1167 PolarHBondContact O-N 3.34Å; C1167-L1170 PolarHBondContact O-N 3.3Å; C1167-I1171 WeakPolarHBondContact O-CG1 3.41Å; C1167-I1171 PolarHBondContact O-N 2.81Å
1168	K	69.5	Low	60.7	Low	24 Å²	24	54.5 Å²	54.5	10%	0.104	27%	0.267	C	S	.	.	H	α-helix	trans	-63.2	-42.2	171.6	-69.6	179.1	-146.3	179.3	0	111.9	M1160 I1163 D1164 E1165 L1170 I1171 F1172	M1160-K1168 HydrophobicContact CE-CB 4.31Å; M1160-K1168 HydrophobicContact CE-CG 3.97Å; M1160-K1168 HydrophobicContact CG-CD 4.43Å; M1160-K1168 HydrophobicContact CG-CG 4.47Å; M1160-K1168 WeakPolarHBondContact O-CE 3.07Å; M1160-K1168 PolarHBondContact O-NZ 3.21Å; M1160-K1168 HydrophobicContact SD-CG 4.26Å; I1163-K1168 HydrophobicContact CB-CG 4.45Å; I1163-K1168 HydrophobicContact CG2-CG 4.01Å; I1163-K1168 WeakPolarHBondContact O-CE 3.38Å; D1164-K1168 WeakPolarHBondContact O-CG 3.14Å; D1164-K1168 PolarHBondContact O-N 3.22Å; E1165-K1168 PolarHBondContact O-N 3.42Å; E1165-K1168 WeakPolarHBondContact OE1-CE 3.24Å; E1165-K1168 IonicContact OE1-NZ 2.7Å; E1165-K1168 PolarHBondContact OE1-NZ 3.25Å; K1168-L1170 VanDerWaalsContact C-N 3.3Å; K1168-L1170 PolarHBondContact O-N 3.15Å; K1168-I1171 PolarHBondContact O-N 3.37Å; K1168-F1172 WeakPolarHBondContact O-CB 3.47Å; K1168-F1172 PolarHBondContact O-N 3.08Å
1169	K	65.2	Low	61.3	Low	131 Å²	131	54.5 Å²	54.5	57%	0.57	27%	0.268	S	S	*	.	H	α-helix	trans	-58.5	-42.9	172.9	-73.4	177	177.8	-177.8	0	111.6	E1165 F1172 S1173	E1165-K1169 WeakPolarHBondContact O-CG 3.29Å; E1165-K1169 PolarHBondContact O-N 3.13Å; E1165-K1169 VanDerWaalsContact O-N 3.1Å; K1169-F1172 PolarHBondContact O-N 3.12Å; K1169-S1173 WeakPolarHBondContact O-CB 3.06Å; K1169-S1173 PolarHBondContact O-N 3.25Å
1170	L	62.7	Low	61.4	Low	19 Å²	19	51.8 Å²	51.8	10%	0.099	26%	0.26	C	S	.	.	H	α-helix	trans	-63.3	-45	177.7	-162.3	72.8	0	0	0	111.9	L1142 L1146 C1149 E1166 C1167 K1168 L1174	L1142-L1170 HydrophobicContact CD1-CD1 4.44Å; L1142-L1170 HydrophobicContact CG-CD1 4.23Å; L1146-L1170 HydrophobicContact CB-CD2 4.39Å; L1146-L1170 HydrophobicContact CD1-CD2 4.05Å; L1146-L1170 HydrophobicContact CG-CD2 4.05Å; C1149-L1170 HydrophobicContact CB-CD2 4.15Å; C1149-L1170 WeakPolarHBondContact SG-CD2 3.47Å; E1166-L1170 PolarHBondContact O-N 3.37Å; C1167-L1170 PolarHBondContact O-N 3.3Å; K1168-L1170 VanDerWaalsContact C-N 3.3Å; K1168-L1170 PolarHBondContact O-N 3.15Å; L1170-L1174 HydrophobicContact CG-CD1 4.29Å; L1170-L1174 WeakPolarHBondContact O-CB 3.32Å; L1170-L1174 PolarHBondContact O-N 3.34Å
1171	I	66.4	Low	62.1	Low	5 Å²	5	50.4 Å²	50.4	3%	0.026	26%	0.255	C	S	.	.	H	α-helix	trans	-59.5	-49.7	174.6	-67.5	166.1	0	0	0	110.3	L865 L1153 M1160 I1163 C1167 K1168 L1174 T1175	L865-I1171 HydrophobicContact CD1-CG1 4.09Å; L865-I1171 HydrophobicContact CG-CG1 4.5Å; L1153-I1171 HydrophobicContact CD2-CD1 4.32Å; M1160-I1171 HydrophobicContact CE-CB 4.2Å; M1160-I1171 HydrophobicContact CE-CD1 3.95Å; M1160-I1171 HydrophobicContact CE-CG2 3.92Å; M1160-I1171 HydrophobicContact SD-CD1 4.33Å; I1163-I1171 HydrophobicContact CD1-CD1 4.16Å; I1163-I1171 HydrophobicContact CG2-CD1 4.18Å; C1167-I1171 WeakPolarHBondContact O-CG1 3.41Å; C1167-I1171 PolarHBondContact O-N 2.81Å; K1168-I1171 PolarHBondContact O-N 3.37Å; I1171-L1174 PolarHBondContact O-N 3.28Å; I1171-T1175 HydrophobicContact CG2-CG2 4.03Å; I1171-T1175 WeakPolarHBondContact O-CB 3.47Å; I1171-T1175 WeakPolarHBondContact O-CG2 3.01Å; I1171-T1175 PolarHBondContact O-N 3.11Å; I1171-T1175 PolarHBondContact O-OG1 2.87Å; I1171-T1175 VanDerWaalsContact O-OG1 3.14Å
1172	F	72.1	Confident	62.9	Low	3 Å²	3	44.3 Å²	44.3	1%	0.013	23%	0.229	C	C	.	.	H	α-helix	trans	-56.2	-52.9	178.4	166	-107.1	0	0	0	112.5	D826 V848 C853 F862 K1168 K1169 L1174 T1175 V1176 Y1200	D826-F1172 HydrophobicContact CB-CE1 3.93Å; D826-F1172 VanDerWaalsContact CG-CE1 3.47Å; D826-F1172 WeakPolarHBondContact OD1-CE1 3.4Å; V848-F1172 HydrophobicContact CG1-CZ 4.33Å; C853-F1172 VanDerWaalsContact O-CZ 3.25Å; C853-F1172 WeakPolarHBondContact O-CZ 3.49Å; F862-F1172 HydrophobicContact CD1-CD2 4.09Å; F862-F1172 AromaticContact CD1-CE2 3.98Å; F862-F1172 HydrophobicContact CD1-CE2 3.98Å; F862-F1172 AromaticContact CD2-CD2 3.48Å; F862-F1172 HydrophobicContact CD2-CD2 3.48Å; F862-F1172 VanDerWaalsContact CD2-CD2 3.48Å; F862-F1172 AromaticContact CD2-CE2 3.94Å; F862-F1172 HydrophobicContact CD2-CE2 3.94Å; F862-F1172 HydrophobicContact CE1-CD2 4.03Å; F862-F1172 AromaticContact CE1-CE2 3.52Å; F862-F1172 HydrophobicContact CE1-CE2 3.52Å; F862-F1172 AromaticContact CE2-CD2 3.37Å; F862-F1172 HydrophobicContact CE2-CD2 3.37Å; F862-F1172 AromaticContact CE2-CE2 3.42Å; F862-F1172 HydrophobicContact CE2-CE2 3.42Å; F862-F1172 VanDerWaalsContact CE2-CE2 3.42Å; F862-F1172 HydrophobicContact CE2-CG 4.41Å; F862-F1172 HydrophobicContact CE2-CZ 4.48Å; F862-F1172 AromaticContact CG-CD2 3.82Å; F862-F1172 HydrophobicContact CG-CD2 3.82Å; F862-F1172 HydrophobicContact CG-CE2 4.17Å; F862-F1172 AromaticContact CZ-CD2 3.65Å; F862-F1172 HydrophobicContact CZ-CD2 3.65Å; F862-F1172 AromaticContact CZ-CE2 3.17Å; F862-F1172 HydrophobicContact CZ-CE2 3.17Å; F862-F1172 HydrophobicContact CZ-CZ 4.14Å; K1168-F1172 WeakPolarHBondContact O-CB 3.47Å; K1168-F1172 PolarHBondContact O-N 3.08Å; K1169-F1172 PolarHBondContact O-N 3.12Å; F1172-L1174 VanDerWaalsContact C-N 3.32Å; F1172-L1174 PolarHBondContact O-N 3.03Å; F1172-T1175 PolarHBondContact O-N 2.79Å; F1172-V1176 HydrophobicContact CD2-CB 4.43Å; F1172-V1176 HydrophobicContact CD2-CG2 3.72Å; F1172-V1176 HydrophobicContact CE2-CB 4.06Å; F1172-V1176 HydrophobicContact CE2-CG1 4.37Å; F1172-V1176 HydrophobicContact CE2-CG2 3.51Å; F1172-V1176 HydrophobicContact CZ-CG2 4.44Å; F1172-V1176 WeakPolarHBondContact O-CB 3.34Å; F1172-V1176 PolarHBondContact O-N 3.21Å; F1172-Y1200 HydrophobicContact CB-CE1 4.34Å
1173	S	62.8	Low	63.7	Low	26 Å²	26	42.1 Å²	42.1	18%	0.182	21%	0.214	C	C	.	.	H	α-helix	trans	-63.9	-38.5	-177.6	-114	0	0	0	0	111.3	D826 G828 K1169 D1177	D826-S1173 PolarHBondContact OD1-OG 3.36Å; G828-S1173 WeakPolarHBondContact CA-OG 3Å; G828-S1173 PolarHBondContact N-OG 2.92Å; G828-S1173 VanDerWaalsContact N-OG 3.08Å; K1169-S1173 WeakPolarHBondContact O-CB 3.06Å; K1169-S1173 PolarHBondContact O-N 3.25Å; S1173-D1177 WeakPolarHBondContact O-CB 3.15Å; S1173-D1177 PolarHBondContact O-N 3.29Å
1174	L	60.7	Low	64.5	Low	54 Å²	54	42.7 Å²	42.7	28%	0.283	22%	0.22	S	C	.	.	H	α-helix	trans	-64.9	-47.3	172.9	-106.9	130.3	0	0	0	112.9	L1142 L1146 L1170 I1171 F1172 F1178	L1142-L1174 HydrophobicContact CD2-CD1 4.01Å; L1142-L1174 HydrophobicContact CD2-CG 4.29Å; L1146-L1174 HydrophobicContact CD1-CD1 4.05Å; L1170-L1174 HydrophobicContact CG-CD1 4.29Å; L1170-L1174 WeakPolarHBondContact O-CB 3.32Å; L1170-L1174 PolarHBondContact O-N 3.34Å; I1171-L1174 PolarHBondContact O-N 3.28Å; F1172-L1174 VanDerWaalsContact C-N 3.32Å; F1172-L1174 PolarHBondContact O-N 3.03Å; L1174-F1178 WeakPolarHBondContact O-CB 3.3Å; L1174-F1178 PolarHBondContact O-N 3.37Å
1175	T	62.6	Low	65.2	Low	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-82.1	-27.5	-166.5	69.2	0	0	0	0	113.3	P863 I868 I1171 F1172 N1179	P863-T1175 WeakPolarHBondContact O-CB 3.31Å; P863-T1175 WeakPolarHBondContact O-CG2 3.19Å; P863-T1175 PolarHBondContact O-OG1 3.08Å; I868-T1175 HydrophobicContact CD1-CG2 3.46Å; I868-T1175 VanDerWaalsContact CD1-CG2 3.46Å; I868-T1175 HydrophobicContact CG1-CG2 4.3Å; I1171-T1175 HydrophobicContact CG2-CG2 4.03Å; I1171-T1175 WeakPolarHBondContact O-CB 3.47Å; I1171-T1175 WeakPolarHBondContact O-CG2 3.01Å; I1171-T1175 PolarHBondContact O-N 3.11Å; I1171-T1175 PolarHBondContact O-OG1 2.87Å; I1171-T1175 VanDerWaalsContact O-OG1 3.14Å; F1172-T1175 PolarHBondContact O-N 2.79Å; T1175-N1179 WeakPolarHBondContact O-CB 3.48Å; T1175-N1179 PolarHBondContact O-N 2.97Å; T1175-N1179 PolarHBondContact O-ND2 3.25Å
1176	V	65.8	Low	65.9	Low	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-83.8	-25.6	174	175.7	0	0	0	0	112.1	G828 K845 V848 F862 F1172 A1180 G1181	G828-V1176 WeakPolarHBondContact O-CG1 3.47Å; K845-V1176 HydrophobicContact CD-CG1 4.41Å; V848-V1176 HydrophobicContact CG2-CG1 3.59Å; F862-V1176 HydrophobicContact CD1-CG2 3.58Å; F862-V1176 HydrophobicContact CE1-CG2 3.99Å; F862-V1176 HydrophobicContact CG-CG2 4.19Å; F1172-V1176 HydrophobicContact CD2-CB 4.43Å; F1172-V1176 HydrophobicContact CD2-CG2 3.72Å; F1172-V1176 HydrophobicContact CE2-CB 4.06Å; F1172-V1176 HydrophobicContact CE2-CG1 4.37Å; F1172-V1176 HydrophobicContact CE2-CG2 3.51Å; F1172-V1176 HydrophobicContact CZ-CG2 4.44Å; F1172-V1176 WeakPolarHBondContact O-CB 3.34Å; F1172-V1176 PolarHBondContact O-N 3.21Å; V1176-A1180 WeakPolarHBondContact O-CA 3.34Å; V1176-A1180 PolarHBondContact O-N 3.46Å; V1176-A1180 VanDerWaalsContact O-N 3.17Å; V1176-G1181 PolarHBondContact O-N 3.42Å; V1176-G1181 VanDerWaalsContact O-N 3.1Å
1177	D	55.3	Low	66.9	Low	71 Å²	71	32 Å²	32	38%	0.38	17%	0.171	S	C	.	.	H	α-helix	trans	-70	-47.7	168.2	-154.4	46.4	0	0	0	110.8	K845 C1017 S1173 N1179 A1180	K845-D1177 IonicContact NZ-OD1 2.71Å; K845-D1177 PolarHBondContact NZ-OD1 2.88Å; C1017-D1177 PolarHBondContact SG-O 2.71Å; S1173-D1177 WeakPolarHBondContact O-CB 3.15Å; S1173-D1177 PolarHBondContact O-N 3.29Å; D1177-N1179 PolarHBondContact O-N 3.32Å; D1177-A1180 PolarHBondContact O-N 2.04Å
1178	F	56.3	Low	67.5	Low	70 Å²	70	34 Å²	34	31%	0.307	18%	0.181	S	C	.	.	H	α-helix	trans	-65.9	-26.2	178	-176.7	-101.6	0	0	0	115.3	I868 C1017 L1174	I868-F1178 HydrophobicContact CD1-CB 4.18Å; I868-F1178 HydrophobicContact CD1-CD1 3.84Å; I868-F1178 HydrophobicContact CD1-CG 4.19Å; I868-F1178 HydrophobicContact CG1-CD1 4.03Å; I868-F1178 HydrophobicContact CG1-CE1 4.37Å; I868-F1178 HydrophobicContact CG2-CD1 4.38Å; I868-F1178 HydrophobicContact CG2-CE1 4.24Å; C1017-F1178 PolarHBondContact SG-O 2.69Å; L1174-F1178 WeakPolarHBondContact O-CB 3.3Å; L1174-F1178 PolarHBondContact O-N 3.37Å
1179	N	52.9	Low	67.9	Low	50 Å²	50	39.5 Å²	39.5	27%	0.267	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107	8.7	178.9	-66.4	-77.7	0	0	0	113.7	P863 T1175 D1177 G1181	P863-N1179 HydrophobicContact CG-CB 4.45Å; P863-N1179 VanDerWaalsContact CG-ND2 3.33Å; P863-N1179 WeakPolarHBondContact CG-ND2 3.25Å; T1175-N1179 WeakPolarHBondContact O-CB 3.48Å; T1175-N1179 PolarHBondContact O-N 2.97Å; T1175-N1179 PolarHBondContact O-ND2 3.25Å; D1177-N1179 PolarHBondContact O-N 3.32Å; N1179-G1181 PolarHBondContact O-N 3.22Å
1180	A	53.6	Low	68.7	Low	30 Å²	30	39.1 Å²	39.1	25%	0.248	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.6	24.9	-176	0	0	0	0	0	115	P846 F1018 V1176 D1177	P846-A1180 WeakPolarHBondContact CD-O 3.5Å; F1018-A1180 HydrophobicContact CD2-CB 3.84Å; F1018-A1180 HydrophobicContact CE2-CB 4.19Å; V1176-A1180 WeakPolarHBondContact O-CA 3.34Å; V1176-A1180 PolarHBondContact O-N 3.46Å; V1176-A1180 VanDerWaalsContact O-N 3.17Å; D1177-A1180 PolarHBondContact O-N 2.04Å
1181	G	68.2	Low	69.5	Low	4 Å²	4	38.2 Å²	38.2	4%	0.041	21%	0.207	C	C	.	.	S	Bend	trans	155.1	-165	-171.5	0	0	0	0	0	114.3	P846 V1176 N1179	P846-G1181 CarbonylContact O-C 3.59Å; P846-G1181 WeakPolarHBondContact O-CA 3.47Å; V1176-G1181 PolarHBondContact O-N 3.42Å; V1176-G1181 VanDerWaalsContact O-N 3.1Å; N1179-G1181 PolarHBondContact O-N 3.22Å
1182	A	73.5	Confident	70.2	Confident	7 Å²	7	38.4 Å²	38.4	6%	0.058	21%	0.209	C	C	.	.			trans	-104.1	153.2	173.6	0	0	0	0	0	112.1	P846 R847 P856 F861 F862	P846-A1182 PolarHBondContact O-N 2.94Å; R847-A1182 HydrophobicContact CB-CB 4.05Å; R847-A1182 VanDerWaalsContact CD-O 3.31Å; R847-A1182 WeakPolarHBondContact CD-O 3.44Å; P856-A1182 HydrophobicContact CB-CB 4.3Å; F861-A1182 WeakPolarHBondContact O-CB 3.48Å; F862-A1182 HydrophobicContact CD1-CB 3.78Å; F862-A1182 HydrophobicContact CE1-CB 3.94Å
1183	M	73	Confident	70.6	Confident	36 Å²	36	42.7 Å²	42.7	18%	0.177	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	162.1	-175.5	-64.6	-178.8	87.5	0	0	112.6	H860 F861 P863 E915	H860-M1183 CarbonylContact C-O 3.44Å; H860-M1183 WeakPolarHBondContact CA-O 3.34Å; H860-M1183 VanDerWaalsContact CB-O 3.3Å; H860-M1183 WeakPolarHBondContact CB-O 3.09Å; H860-M1183 PolarHBondContact CD2-O 2.03Å; H860-M1183 VanDerWaalsContact CD2-O 3.31Å; F861-M1183 HydrophobicContact CD1-CB 4.03Å; F861-M1183 WeakPolarHBondContact CD1-O 3.39Å; F861-M1183 HydrophobicContact CE1-CB 3.49Å; F861-M1183 VanDerWaalsContact CE1-CB 3.49Å; F861-M1183 HydrophobicContact CE2-CB 4.22Å; F861-M1183 HydrophobicContact CE2-SD 4.4Å; F861-M1183 HydrophobicContact CZ-CB 3.6Å; F861-M1183 HydrophobicContact CZ-CG 4.39Å; F861-M1183 HydrophobicContact CZ-SD 4.01Å; F861-M1183 PolarHBondContact N-O 3.32Å; F861-M1183 PolarHBondContact O-N 3Å; P863-M1183 HydrophobicContact CB-SD 3.92Å; P863-M1183 HydrophobicContact CG-CG 4.1Å; P863-M1183 HydrophobicContact CG-SD 3.78Å; E915-M1183 WeakPolarHBondContact OE1-CE 2.85Å; E915-M1183 WeakPolarHBondContact OE2-CE 3.33Å
1184	S	78.8	Confident	71.2	Confident	31 Å²	31	42.5 Å²	42.5	22%	0.217	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	142	-175.2	-173	0	0	0	0	113.9	F861 D1186 R1213	F861-S1184 VanDerWaalsContact CE1-O 3.28Å; F861-S1184 WeakPolarHBondContact CE1-O 3.22Å; S1184-D1186 WeakPolarHBondContact CB-OD1 3.01Å; S1184-D1186 PolarHBondContact OG-OD1 2.9Å; S1184-R1213 PolarHBondContact O-NH1 3.3Å; S1184-R1213 PolarHBondContact O-NH2 2.9Å
1185	C	80.1	Confident	71.9	Confident	1 Å²	1	47 Å²	47	1%	0.007	25%	0.252	C	S	.	.			trans	-66.3	-42.3	179.4	-75.8	0	0	0	0	113	A859 C1187 C1197 C1204 R1213	A859-C1185 VanDerWaalsContact O-CB 3.3Å; A859-C1185 WeakPolarHBondContact O-CB 3.46Å; A859-C1185 PolarHBondContact O-N 2.9Å; A859-C1185 PolarHBondContact O-SG 3.31Å; C1185-C1187 VanDerWaalsContact C-N 3.26Å; C1185-C1187 PolarHBondContact O-N 2.85Å; C1185-C1187 VanDerWaalsContact O-N 3.17Å; C1185-C1197 VanDerWaalsContact CA-SG 3.5Å; C1185-C1197 HydrophobicContact CB-CB 3.73Å; C1185-C1197 WeakPolarHBondContact CB-SG 3.45Å; C1185-C1197 WeakPolarHBondContact SG-CB 2.99Å; C1185-C1197 PolarHBondContact SG-N 3.2Å; C1185-C1197 CovalentContact SG-SG 2.03Å; C1185-C1197 PolarHBondContact SG-SG 2.04Å; C1185-C1204 PolarHBondContact O-SG 2.92Å; C1185-C1204 VanDerWaalsContact O-SG 3.42Å; C1185-R1213 PolarHBondContact O-NH1 2.78Å
1186	D	79.8	Confident	72.7	Confident	86 Å²	86	51 Å²	51	46%	0.46	27%	0.272	S	S	.	.			trans	50.2	36.7	176.2	-48.9	-38.4	0	0	0	115.5	S1184 N1188 R1213 Q1214	S1184-D1186 WeakPolarHBondContact CB-OD1 3.01Å; S1184-D1186 PolarHBondContact OG-OD1 2.9Å; D1186-N1188 PolarHBondContact O-N 3.05Å; D1186-R1213 IonicContact OD2-NH2 3.75Å; D1186-Q1214 HydrophobicContact CB-CG 4.13Å; D1186-Q1214 VanDerWaalsContact CB-NE2 3.33Å; D1186-Q1214 WeakPolarHBondContact O-CB 3.28Å; D1186-Q1214 VanDerWaalsContact O-CG 3.3Å; D1186-Q1214 WeakPolarHBondContact O-CG 3.29Å
1187	C	80.3	Confident	73.4	Confident	17 Å²	17	51.8 Å²	51.8	12%	0.115	28%	0.277	C	S	.	.			trans	-66.8	124.1	-176.1	-54.3	0	0	0	0	112.3	C1185 L1189 S1194 C1204	C1185-C1187 VanDerWaalsContact C-N 3.26Å; C1185-C1187 PolarHBondContact O-N 2.85Å; C1185-C1187 VanDerWaalsContact O-N 3.17Å; C1187-L1189 PolarHBondContact O-N 3.45Å; C1187-S1194 VanDerWaalsContact CB-O 3.29Å; C1187-S1194 WeakPolarHBondContact CB-O 3.32Å; C1187-S1194 PolarHBondContact SG-O 3.1Å; C1187-C1204 WeakPolarHBondContact CA-SG 3.37Å; C1187-C1204 HydrophobicContact CB-CB 3.7Å; C1187-C1204 WeakPolarHBondContact CB-SG 3.46Å; C1187-C1204 WeakPolarHBondContact SG-CB 3.07Å; C1187-C1204 CovalentContact SG-SG 2.03Å; C1187-C1204 PolarHBondContact SG-SG 3.01Å
1188	N	79.1	Confident	74.6	Confident	48 Å²	48	53 Å²	53	26%	0.257	28%	0.281	S	S	.	.			trans	-62.3	121.5	176.2	-178.6	-47.2	0	0	0	110.6	D1186 E1190 G1191 S1192 Q1214	D1186-N1188 PolarHBondContact O-N 3.05Å; N1188-E1190 VanDerWaalsContact C-N 3.31Å; N1188-E1190 PolarHBondContact O-N 3.37Å; N1188-E1190 WeakPolarHBondContact OD1-CB 3.14Å; N1188-E1190 PolarHBondContact OD1-N 3.49Å; N1188-G1191 PolarHBondContact O-N 2.74Å; N1188-G1191 PolarHBondContact OD1-N 3.11Å; N1188-G1191 VanDerWaalsContact OD1-N 3.13Å; N1188-S1192 WeakPolarHBondContact O-CA 3.33Å; N1188-S1192 WeakPolarHBondContact O-CB 3.23Å; N1188-S1192 PolarHBondContact O-N 2.82Å; N1188-Q1214 WeakPolarHBondContact CB-O 3.41Å; N1188-Q1214 PolarHBondContact N-O 2.78Å
1189	L	77.8	Confident	75.6	Confident	141 Å²	141	55.3 Å²	55.3	74%	0.738	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-22.5	-175.5	-74.4	163.6	0	0	0	114.5	C1187 F1195	C1187-L1189 PolarHBondContact O-N 3.45Å; L1189-F1195 HydrophobicContact CD2-CD1 4.35Å
1190	E	81.4	Confident	76.7	Confident	122 Å²	122	55.5 Å²	55.5	57%	0.57	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-29.4	176.4	-56.9	-170.3	139.8	0	0	112.1	N1188 M1207 F1225 P1226	N1188-E1190 VanDerWaalsContact C-N 3.31Å; N1188-E1190 PolarHBondContact O-N 3.37Å; N1188-E1190 WeakPolarHBondContact OD1-CB 3.14Å; N1188-E1190 PolarHBondContact OD1-N 3.49Å; E1190-M1207 VanDerWaalsContact O-CE 3.29Å; E1190-M1207 WeakPolarHBondContact O-CE 3.31Å; E1190-F1225 HydrophobicContact CB-CE1 4.49Å; E1190-F1225 HydrophobicContact CB-CZ 4.36Å; E1190-P1226 HydrophobicContact CB-CB 4.3Å
1191	G	79.8	Confident	77.4	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	-10.2	-175.8	0	0	0	0	0	115.8	N1188 C1206 M1207 C1215	N1188-G1191 PolarHBondContact O-N 2.74Å; N1188-G1191 PolarHBondContact OD1-N 3.11Å; N1188-G1191 VanDerWaalsContact OD1-N 3.13Å; G1191-C1206 WeakPolarHBondContact O-CA 3.49Å; G1191-M1207 WeakPolarHBondContact O-CG 3.36Å; G1191-M1207 PolarHBondContact O-N 3.09Å; G1191-C1215 WeakPolarHBondContact CA-O 3.05Å; G1191-C1215 WeakPolarHBondContact O-CB 3.24Å
1192	S	81.2	Confident	77.8	Confident	10 Å²	10	54.4 Å²	54.4	7%	0.07	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-112.5	148	-178.6	-169.4	0	0	0	0	112.9	N1188 S1194 Q1205 M1207	N1188-S1192 WeakPolarHBondContact O-CA 3.33Å; N1188-S1192 WeakPolarHBondContact O-CB 3.23Å; N1188-S1192 PolarHBondContact O-N 2.82Å; S1192-S1194 PolarHBondContact OG-N 3.02Å; S1192-S1194 PolarHBondContact OG-O 2.66Å; S1192-Q1205 CarbonylContact C-O 3.45Å; S1192-Q1205 WeakPolarHBondContact CA-O 3.49Å; S1192-Q1205 PolarHBondContact OG-O 2.63Å; S1192-Q1205 VanDerWaalsContact OG-O 3.09Å; S1192-M1207 VanDerWaalsContact O-CE 3.26Å; S1192-M1207 WeakPolarHBondContact O-CE 3.27Å
1193	T	79.6	Confident	78.1	Confident	93 Å²	93	57.2 Å²	57.2	57%	0.571	29%	0.289	S	S	*	.	S	Bend	trans	-88.9	-2.4	169.9	63.7	0	0	0	0	113.2	Q1205 M1207	T1193-Q1205 PolarHBondContact N-O 2.73Å; T1193-Q1205 VanDerWaalsContact OG1-CB 3.29Å; T1193-Q1205 WeakPolarHBondContact OG1-CB 3.19Å; T1193-Q1205 PolarHBondContact OG1-O 3.06Å; T1193-Q1205 PolarHBondContact OG1-OE1 3.07Å; T1193-M1207 HydrophobicContact CG2-CG 3.87Å
1194	S	76.1	Confident	78.6	Confident	22 Å²	22	55.7 Å²	55.7	15%	0.154	28%	0.282	C	S	.	.			trans	-155.7	142	-174.5	175	0	0	0	0	111.8	C1187 S1192 I1196	C1187-S1194 VanDerWaalsContact CB-O 3.29Å; C1187-S1194 WeakPolarHBondContact CB-O 3.32Å; C1187-S1194 PolarHBondContact SG-O 3.1Å; S1192-S1194 PolarHBondContact OG-N 3.02Å; S1192-S1194 PolarHBondContact OG-O 2.66Å; S1194-I1196 VanDerWaalsContact C-N 3.3Å; S1194-I1196 PolarHBondContact OG-N 2.87Å; S1194-I1196 PolarHBondContact OG-O 3.18Å
1195	F	75.6	Confident	78.8	Confident	148 Å²	148	59.6 Å²	59.6	65%	0.649	30%	0.296	S	S	*	.	S	Bend	trans	-81.7	-9.2	167.3	19.3	-92.2	0	0	0	113.1	L1189	L1189-F1195 HydrophobicContact CD2-CD1 4.35Å
1196	I	77.9	Confident	78.8	Confident	85 Å²	85	61.5 Å²	61.5	44%	0.436	31%	0.309	S	S	.	.			trans	-96	128	176.3	-50.7	174.8	0	0	0	109.5	S1194	S1194-I1196 VanDerWaalsContact C-N 3.3Å; S1194-I1196 PolarHBondContact OG-N 2.87Å; S1194-I1196 PolarHBondContact OG-O 3.18Å
1197	C	81.8	Confident	78.8	Confident	15 Å²	15	61.2 Å²	61.2	10%	0.101	31%	0.306	C	S	.	.			trans	-106.7	172.4	178.1	70.4	0	0	0	0	113	C1185 G1202 Q1203	C1185-C1197 VanDerWaalsContact CA-SG 3.5Å; C1185-C1197 HydrophobicContact CB-CB 3.73Å; C1185-C1197 WeakPolarHBondContact CB-SG 3.45Å; C1185-C1197 WeakPolarHBondContact SG-CB 2.99Å; C1185-C1197 PolarHBondContact SG-N 3.2Å; C1185-C1197 CovalentContact SG-SG 2.03Å; C1185-C1197 PolarHBondContact SG-SG 2.04Å; C1197-G1202 WeakPolarHBondContact CB-O 3.21Å; C1197-Q1203 CarbonylContact C-O 3.06Å; C1197-Q1203 VanDerWaalsContact CA-O 3.31Å; C1197-Q1203 WeakPolarHBondContact CA-O 3.48Å; C1197-Q1203 WeakPolarHBondContact CB-O 3.36Å
1198	E	79.8	Confident	78.8	Confident	97 Å²	97	68.8 Å²	68.8	45%	0.453	34%	0.34	S	S	.	.			trans	-67.9	135.1	176.3	-68.7	-154.6	153.5	0	0	112.1	F861 K1161 Y1200 G1202 Q1203	F861-E1198 WeakPolarHBondContact CB-O 3.4Å; K1161-E1198 IonicContact NZ-OE1 3.68Å; K1161-E1198 PolarHBondContact NZ-OE1 3.41Å; K1161-E1198 IonicContact NZ-OE2 3.93Å; E1198-Y1200 PolarHBondContact O-N 2.8Å; E1198-G1202 PolarHBondContact O-N 2.74Å; E1198-Q1203 PolarHBondContact N-O 2.9Å
1199	R	78.3	Confident	78.8	Confident	119 Å²	119	68.7 Å²	68.7	45%	0.449	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.9	-26	-176.3	-86.9	-167.5	173.5	-174.9	-3.8	115.9	E855 P856 F861 F862	E855-R1199 IonicContact OE1-CZ 2.75Å; E855-R1199 IonicContact OE1-NH1 3.76Å; E855-R1199 PolarHBondContact OE1-NH1 3.39Å; E855-R1199 IonicContact OE1-NH2 2.63Å; E855-R1199 PolarHBondContact OE1-NH2 2.79Å; E855-R1199 VanDerWaalsContact OE1-NH2 3.17Å; E855-R1199 IonicContact OE2-CZ 2.63Å; E855-R1199 IonicContact OE2-NH1 2.67Å; E855-R1199 IonicContact OE2-NH2 3.35Å; E855-R1199 PolarHBondContact OE2-NH2 2.84Å; P856-R1199 HydrophobicContact CG-CB 4.24Å; P856-R1199 HydrophobicContact CG-CG 3.84Å; F861-R1199 WeakPolarHBondContact CA-O 3.18Å; F862-R1199 PolarHBondContact N-O 3.05Å
1200	Y	74.3	Confident	78.8	Confident	53 Å²	53	62.5 Å²	62.5	21%	0.208	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-127.9	127.1	179.5	-72.1	-80.9	0	0	0	108.3	F862 M1160 F1172 E1198 G1202	F862-Y1200 HydrophobicContact CB-CD1 3.73Å; F862-Y1200 HydrophobicContact CB-CE1 3.94Å; F862-Y1200 HydrophobicContact CD2-CD1 4.12Å; F862-Y1200 AromaticContact CD2-CE1 3.62Å; F862-Y1200 HydrophobicContact CD2-CE1 3.62Å; F862-Y1200 AromaticContact CD2-CZ 3.91Å; F862-Y1200 HydrophobicContact CG-CD1 4.46Å; F862-Y1200 HydrophobicContact CG-CE1 4.28Å; F862-Y1200 WeakPolarHBondContact O-CA 3.26Å; M1160-Y1200 HydrophobicContact CE-CD1 3.35Å; M1160-Y1200 HydrophobicContact CE-CD2 4.16Å; M1160-Y1200 HydrophobicContact CE-CE1 3.61Å; M1160-Y1200 HydrophobicContact CE-CE2 4.4Å; M1160-Y1200 HydrophobicContact CE-CG 3.64Å; M1160-Y1200 HydrophobicContact CG-CD1 4.47Å; M1160-Y1200 HydrophobicContact CG-CD2 3.76Å; M1160-Y1200 HydrophobicContact CG-CE2 4.46Å; M1160-Y1200 HydrophobicContact CG-CG 3.76Å; M1160-Y1200 HydrophobicContact SD-CG 4.45Å; F1172-Y1200 HydrophobicContact CB-CE1 4.34Å; E1198-Y1200 PolarHBondContact O-N 2.8Å; Y1200-G1202 PolarHBondContact O-N 2.82Å
1201	G	68.8	Low	78.2	Confident	12 Å²	12	57.6 Å²	57.6	12%	0.124	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.1	2.1	-178.2	0	0	0	0	0	115.9	F862 H867 Q1203	F862-G1201 PolarHBondContact O-N 2.71Å; H867-G1201 PolarHBondContact NE2-O 3.48Å; G1201-Q1203 VanDerWaalsContact C-N 3.3Å; G1201-Q1203 PolarHBondContact O-N 2.73Å
1202	G	76.5	Confident	77.4	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.286	C	S	.	.			trans	66.9	18.7	155.6	0	0	0	0	0	117.4	F861 C1197 E1198 Y1200 C1204 R1213	F861-G1202 VanDerWaalsContact CD1-CA 3.48Å; C1197-G1202 WeakPolarHBondContact CB-O 3.21Å; E1198-G1202 PolarHBondContact O-N 2.74Å; Y1200-G1202 PolarHBondContact O-N 2.82Å; G1202-C1204 PolarHBondContact O-N 3.17Å; G1202-R1213 VanDerWaalsContact O-CG 3.28Å; G1202-R1213 WeakPolarHBondContact O-CG 3.25Å; G1202-R1213 PolarHBondContact O-NH1 3.4Å
1203	Q	79.4	Confident	77.2	Confident	66 Å²	66	59.6 Å²	59.6	31%	0.308	29%	0.292	S	S	.	.			trans	-73.2	121.1	-176.1	-180	58.2	64.8	0	0	112	C1197 E1198 G1201 G1212 R1213	C1197-Q1203 CarbonylContact C-O 3.06Å; C1197-Q1203 VanDerWaalsContact CA-O 3.31Å; C1197-Q1203 WeakPolarHBondContact CA-O 3.48Å; C1197-Q1203 WeakPolarHBondContact CB-O 3.36Å; E1198-Q1203 PolarHBondContact N-O 2.9Å; G1201-Q1203 VanDerWaalsContact C-N 3.3Å; G1201-Q1203 PolarHBondContact O-N 2.73Å; Q1203-G1212 PolarHBondContact NE2-O 2.9Å; Q1203-R1213 PolarHBondContact NE2-O 2.64Å
1204	C	84.5	Confident	77.2	Confident	4 Å²	4	58 Å²	58	3%	0.027	28%	0.278	C	S	.	.			trans	-76	160.8	173.3	-63.5	0	0	0	0	112.5	C1185 C1187 G1202 C1206 R1213 C1215	C1185-C1204 PolarHBondContact O-SG 2.92Å; C1185-C1204 VanDerWaalsContact O-SG 3.42Å; C1187-C1204 WeakPolarHBondContact CA-SG 3.37Å; C1187-C1204 HydrophobicContact CB-CB 3.7Å; C1187-C1204 WeakPolarHBondContact CB-SG 3.46Å; C1187-C1204 WeakPolarHBondContact SG-CB 3.07Å; C1187-C1204 CovalentContact SG-SG 2.03Å; C1187-C1204 PolarHBondContact SG-SG 3.01Å; G1202-C1204 PolarHBondContact O-N 3.17Å; C1204-C1206 PolarHBondContact O-N 2.83Å; C1204-R1213 VanDerWaalsContact CB-O 3.24Å; C1204-R1213 WeakPolarHBondContact CB-O 3.31Å; C1204-R1213 PolarHBondContact N-O 3.12Å; C1204-R1213 PolarHBondContact SG-O 2.68Å; C1204-R1213 VanDerWaalsContact SG-O 3.35Å; C1204-C1215 VanDerWaalsContact CB-SG 3.53Å
1205	Q	82.6	Confident	77.5	Confident	113 Å²	113	56.9 Å²	56.9	53%	0.528	27%	0.27	S	S	.	.			trans	-85.3	93.1	-179.8	-64	-173.7	-5.5	0	0	111.4	S1192 T1193	S1192-Q1205 CarbonylContact C-O 3.45Å; S1192-Q1205 WeakPolarHBondContact CA-O 3.49Å; S1192-Q1205 PolarHBondContact OG-O 2.63Å; S1192-Q1205 VanDerWaalsContact OG-O 3.09Å; T1193-Q1205 PolarHBondContact N-O 2.73Å; T1193-Q1205 VanDerWaalsContact OG1-CB 3.29Å; T1193-Q1205 WeakPolarHBondContact OG1-CB 3.19Å; T1193-Q1205 PolarHBondContact OG1-O 3.06Å; T1193-Q1205 PolarHBondContact OG1-OE1 3.07Å
1206	C	81.5	Confident	77.5	Confident	41 Å²	41	52 Å²	52	28%	0.277	25%	0.251	S	S	.	.	B	Isolated β-bridge	trans	-74.7	145	-172.9	-49.4	0	0	0	0	114.1	G1191 C1204 V1210 C1215	G1191-C1206 WeakPolarHBondContact O-CA 3.49Å; C1204-C1206 PolarHBondContact O-N 2.83Å; C1206-V1210 HydrophobicContact CB-CB 4.18Å; C1206-V1210 HydrophobicContact CB-CG1 4.25Å; C1206-V1210 WeakPolarHBondContact CB-O 3.46Å; C1206-C1215 WeakPolarHBondContact CA-SG 3.49Å; C1206-C1215 HydrophobicContact CB-CB 3.64Å; C1206-C1215 WeakPolarHBondContact CB-SG 3.42Å; C1206-C1215 PolarHBondContact N-SG 2.85Å; C1206-C1215 VanDerWaalsContact SG-CA 3.52Å; C1206-C1215 WeakPolarHBondContact SG-CB 3.13Å; C1206-C1215 CovalentContact SG-SG 2.04Å; C1206-C1215 PolarHBondContact SG-SG 2.81Å
1207	M	79.3	Confident	77.3	Confident	80 Å²	80	50.5 Å²	50.5	39%	0.394	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-63.6	165.4	169	-64.9	-159.9	-157.3	0	0	111.7	E1190 G1191 S1192 T1193 N1209 V1210	E1190-M1207 VanDerWaalsContact O-CE 3.29Å; E1190-M1207 WeakPolarHBondContact O-CE 3.31Å; G1191-M1207 WeakPolarHBondContact O-CG 3.36Å; G1191-M1207 PolarHBondContact O-N 3.09Å; S1192-M1207 VanDerWaalsContact O-CE 3.26Å; S1192-M1207 WeakPolarHBondContact O-CE 3.27Å; T1193-M1207 HydrophobicContact CG2-CG 3.87Å; M1207-N1209 PolarHBondContact O-N 3.42Å; M1207-V1210 HydrophobicContact CB-CB 4.5Å; M1207-V1210 HydrophobicContact CB-CG2 4.12Å; M1207-V1210 WeakPolarHBondContact O-CB 3.49Å; M1207-V1210 PolarHBondContact O-N 2.75Å
1208	Q	79.4	Confident	77	Confident	175 Å²	175	51 Å²	51	82%	0.818	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63	128.3	-173.8	-167.8	166.1	8.2	0	0	111.8	V1210	Q1208-V1210 PolarHBondContact O-N 3.22Å
1209	N	79.7	Confident	76.6	Confident	47 Å²	47	51.4 Å²	51.4	25%	0.251	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.4	1.8	-173.5	-45.7	-34.5	0	0	0	115.9	M1207 R1219 Y1222 C1228	M1207-N1209 PolarHBondContact O-N 3.42Å; N1209-R1219 VanDerWaalsContact O-CB 3.3Å; N1209-R1219 WeakPolarHBondContact O-CB 3.26Å; N1209-R1219 PolarHBondContact O-N 3.01Å; N1209-Y1222 HydrophobicContact CB-CD1 3.94Å; N1209-Y1222 HydrophobicContact CB-CE1 4Å; N1209-Y1222 HydrophobicContact CB-CG 4.36Å; N1209-Y1222 VanDerWaalsContact CG-CE1 3.49Å; N1209-Y1222 WeakPolarHBondContact ND2-CE1 3.02Å; N1209-C1228 HydrophobicContact CB-CB 3.89Å
1210	V	78.2	Confident	75.6	Confident	10 Å²	10	49.1 Å²	49.1	6%	0.061	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	147.4	169.9	-177.6	0	0	0	0	110.1	C1206 M1207 Q1208 C1215 K1217 F1225	C1206-V1210 HydrophobicContact CB-CB 4.18Å; C1206-V1210 HydrophobicContact CB-CG1 4.25Å; C1206-V1210 WeakPolarHBondContact CB-O 3.46Å; M1207-V1210 HydrophobicContact CB-CB 4.5Å; M1207-V1210 HydrophobicContact CB-CG2 4.12Å; M1207-V1210 WeakPolarHBondContact O-CB 3.49Å; M1207-V1210 PolarHBondContact O-N 2.75Å; Q1208-V1210 PolarHBondContact O-N 3.22Å; V1210-C1215 HydrophobicContact CG1-CB 3.89Å; V1210-C1215 VanDerWaalsContact CG1-O 3.26Å; V1210-C1215 WeakPolarHBondContact CG1-O 3.06Å; V1210-K1217 CarbonylContact C-O 3.56Å; V1210-K1217 VanDerWaalsContact CA-O 3.3Å; V1210-K1217 WeakPolarHBondContact CA-O 3.35Å; V1210-K1217 WeakPolarHBondContact CG1-O 3.26Å; V1210-F1225 HydrophobicContact CG1-CD2 4.45Å; V1210-F1225 HydrophobicContact CG1-CE2 3.97Å
1211	V	68.9	Low	75.2	Confident	19 Å²	19	48.3 Å²	48.3	12%	0.115	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	176.9	178	-57.6	0	0	0	0	111.1	C1215 D1216 K1217 R1219	V1211-C1215 CarbonylContact O-C 3.45Å; V1211-C1215 WeakPolarHBondContact O-CA 3.36Å; V1211-D1216 PolarHBondContact O-N 2.81Å; V1211-K1217 HydrophobicContact CG2-CB 4.09Å; V1211-K1217 PolarHBondContact N-O 3.42Å; V1211-K1217 PolarHBondContact O-N 2.88Å; V1211-R1219 HydrophobicContact CG1-CB 3.87Å; V1211-R1219 HydrophobicContact CG1-CG 4.46Å
1212	G	62.1	Low	75.6	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.01	26%	0.26	C	S	.	.	S	Bend	trans	108.8	156.9	-174.4	0	0	0	0	0	111.3	Q1203 Q1214 C1215 D1216	Q1203-G1212 PolarHBondContact NE2-O 2.9Å; G1212-Q1214 VanDerWaalsContact C-N 3.26Å; G1212-Q1214 PolarHBondContact O-N 3.4Å; G1212-C1215 PolarHBondContact O-N 2.97Å; G1212-C1215 VanDerWaalsContact O-N 3.14Å; G1212-D1216 WeakPolarHBondContact CA-OD1 3.13Å
1213	R	76	Confident	75.6	Confident	51 Å²	51	53.8 Å²	53.8	19%	0.192	27%	0.271	C	S	.	.	S	Bend	trans	-58.2	-44	177	-170.1	-172	73.4	69.1	-10.8	110.5	S1184 C1185 D1186 G1202 Q1203 C1204	S1184-R1213 PolarHBondContact O-NH1 3.3Å; S1184-R1213 PolarHBondContact O-NH2 2.9Å; C1185-R1213 PolarHBondContact O-NH1 2.78Å; D1186-R1213 IonicContact OD2-NH2 3.75Å; G1202-R1213 VanDerWaalsContact O-CG 3.28Å; G1202-R1213 WeakPolarHBondContact O-CG 3.25Å; G1202-R1213 PolarHBondContact O-NH1 3.4Å; Q1203-R1213 PolarHBondContact NE2-O 2.64Å; C1204-R1213 VanDerWaalsContact CB-O 3.24Å; C1204-R1213 WeakPolarHBondContact CB-O 3.31Å; C1204-R1213 PolarHBondContact N-O 3.12Å; C1204-R1213 PolarHBondContact SG-O 2.68Å; C1204-R1213 VanDerWaalsContact SG-O 3.35Å
1214	Q	79.6	Confident	75.5	Confident	59 Å²	59	52.1 Å²	52.1	28%	0.276	27%	0.272	S	S	.	.	S	Bend	trans	-87.9	-3.4	179	-65.4	171.7	-30.6	0	0	113	D1186 N1188 G1212 D1216	D1186-Q1214 HydrophobicContact CB-CG 4.13Å; D1186-Q1214 VanDerWaalsContact CB-NE2 3.33Å; D1186-Q1214 WeakPolarHBondContact O-CB 3.28Å; D1186-Q1214 VanDerWaalsContact O-CG 3.3Å; D1186-Q1214 WeakPolarHBondContact O-CG 3.29Å; N1188-Q1214 WeakPolarHBondContact CB-O 3.41Å; N1188-Q1214 PolarHBondContact N-O 2.78Å; G1212-Q1214 VanDerWaalsContact C-N 3.26Å; G1212-Q1214 PolarHBondContact O-N 3.4Å; Q1214-D1216 HydrophobicContact CB-CB 4.44Å
1215	C	82.9	Confident	75.1	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.285	C	S	.	.	S	Bend	trans	62.9	48	-171.6	-50.9	0	0	0	0	113.7	G1191 C1204 C1206 V1210 V1211 G1212	G1191-C1215 WeakPolarHBondContact CA-O 3.05Å; G1191-C1215 WeakPolarHBondContact O-CB 3.24Å; C1204-C1215 VanDerWaalsContact CB-SG 3.53Å; C1206-C1215 WeakPolarHBondContact CA-SG 3.49Å; C1206-C1215 HydrophobicContact CB-CB 3.64Å; C1206-C1215 WeakPolarHBondContact CB-SG 3.42Å; C1206-C1215 PolarHBondContact N-SG 2.85Å; C1206-C1215 VanDerWaalsContact SG-CA 3.52Å; C1206-C1215 WeakPolarHBondContact SG-CB 3.13Å; C1206-C1215 CovalentContact SG-SG 2.04Å; C1206-C1215 PolarHBondContact SG-SG 2.81Å; V1210-C1215 HydrophobicContact CG1-CB 3.89Å; V1210-C1215 VanDerWaalsContact CG1-O 3.26Å; V1210-C1215 WeakPolarHBondContact CG1-O 3.06Å; V1211-C1215 CarbonylContact O-C 3.45Å; V1211-C1215 WeakPolarHBondContact O-CA 3.36Å; G1212-C1215 PolarHBondContact O-N 2.97Å; G1212-C1215 VanDerWaalsContact O-N 3.14Å
1216	D	76.7	Confident	74.4	Confident	44 Å²	44	52.6 Å²	52.6	24%	0.235	28%	0.278	C	S	.	.			trans	-100.3	-0.6	-171.1	55	-53.2	0	0	0	114.6	V1211 G1212 Q1214	V1211-D1216 PolarHBondContact O-N 2.81Å; G1212-D1216 WeakPolarHBondContact CA-OD1 3.13Å; Q1214-D1216 HydrophobicContact CB-CB 4.44Å
1217	K	73.8	Confident	74.4	Confident	55 Å²	55	57.5 Å²	57.5	24%	0.239	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	159.3	-165.2	-44.4	-176.3	-172.2	-174.2	0	113.7	E873 V1210 V1211	E873-K1217 IonicContact OE1-NZ 3.7Å; E873-K1217 PolarHBondContact OE1-NZ 3.34Å; E873-K1217 IonicContact OE2-NZ 3.53Å; E873-K1217 PolarHBondContact OE2-NZ 2.84Å; V1210-K1217 CarbonylContact C-O 3.56Å; V1210-K1217 VanDerWaalsContact CA-O 3.3Å; V1210-K1217 WeakPolarHBondContact CA-O 3.35Å; V1210-K1217 WeakPolarHBondContact CG1-O 3.26Å; V1211-K1217 HydrophobicContact CG2-CB 4.09Å; V1211-K1217 PolarHBondContact N-O 3.42Å; V1211-K1217 PolarHBondContact O-N 2.88Å
1218	C	75.9	Confident	74.4	Confident	26 Å²	26	54.3 Å²	54.3	18%	0.176	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	143.4	166.1	-67.9	0	0	0	0	112.5	F1225 C1228	C1218-F1225 PolarHBondContact SG-N 2.98Å; C1218-C1228 WeakPolarHBondContact CA-SG 3.37Å; C1218-C1228 HydrophobicContact CB-CB 3.78Å; C1218-C1228 WeakPolarHBondContact CB-SG 3.5Å; C1218-C1228 VanDerWaalsContact SG-CA 3.51Å; C1218-C1228 WeakPolarHBondContact SG-CB 3.31Å; C1218-C1228 CovalentContact SG-SG 2.04Å; C1218-C1228 PolarHBondContact SG-SG 2.63Å
1219	R	69.6	Low	74.4	Confident	104 Å²	104	50.3 Å²	50.3	39%	0.392	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-53.8	139.6	170.4	173.7	174.5	-75.7	-104.9	-4	111.1	N1209 V1211 G1221 Y1222	N1209-R1219 VanDerWaalsContact O-CB 3.3Å; N1209-R1219 WeakPolarHBondContact O-CB 3.26Å; N1209-R1219 PolarHBondContact O-N 3.01Å; V1211-R1219 HydrophobicContact CG1-CB 3.87Å; V1211-R1219 HydrophobicContact CG1-CG 4.46Å; R1219-G1221 PolarHBondContact O-N 2.57Å; R1219-Y1222 HydrophobicContact CB-CD2 3.98Å; R1219-Y1222 HydrophobicContact CG-CD2 4.05Å; R1219-Y1222 HydrophobicContact CG-CE2 4.29Å; R1219-Y1222 WeakPolarHBondContact O-CA 3.44Å; R1219-Y1222 WeakPolarHBondContact O-CB 3.02Å; R1219-Y1222 PolarHBondContact O-N 3.5Å
1220	S	59.1	Low	74.3	Confident	71 Å²	71	52.2 Å²	52.2	50%	0.497	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.5	125.2	172.7	-55.4	0	0	0	0	112.2
1221	G	64.3	Low	73.7	Confident	37 Å²	37	53.3 Å²	53.3	38%	0.381	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.9	4.3	-171.4	0	0	0	0	0	115	R1219 P1230 C1231	R1219-G1221 PolarHBondContact O-N 2.57Å; G1221-P1230 WeakPolarHBondContact O-CA 3.08Å; G1221-C1231 WeakPolarHBondContact O-CB 3.38Å; G1221-C1231 PolarHBondContact O-N 3.17Å
1222	Y	78.1	Confident	73.9	Confident	70 Å²	70	60 Å²	60	28%	0.275	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	153.3	171.2	-63.8	-111.9	0	0	0	111	N1209 R1219 C1228 K1229 P1230	N1209-Y1222 HydrophobicContact CB-CD1 3.94Å; N1209-Y1222 HydrophobicContact CB-CE1 4Å; N1209-Y1222 HydrophobicContact CB-CG 4.36Å; N1209-Y1222 VanDerWaalsContact CG-CE1 3.49Å; N1209-Y1222 WeakPolarHBondContact ND2-CE1 3.02Å; R1219-Y1222 HydrophobicContact CB-CD2 3.98Å; R1219-Y1222 HydrophobicContact CG-CD2 4.05Å; R1219-Y1222 HydrophobicContact CG-CE2 4.29Å; R1219-Y1222 WeakPolarHBondContact O-CA 3.44Å; R1219-Y1222 WeakPolarHBondContact O-CB 3.02Å; R1219-Y1222 PolarHBondContact O-N 3.5Å; Y1222-C1228 HydrophobicContact CD1-CB 4.49Å; Y1222-C1228 WeakPolarHBondContact CD1-O 3.46Å; Y1222-K1229 CarbonylContact C-O 3.45Å; Y1222-K1229 WeakPolarHBondContact CA-O 3.26Å; Y1222-K1229 WeakPolarHBondContact CB-O 3.34Å; Y1222-P1230 HydrophobicContact CD1-CB 4.1Å; Y1222-P1230 HydrophobicContact CE1-CB 3.93Å; Y1222-P1230 HydrophobicContact CE1-CG 4.4Å
1223	F	77	Confident	74	Confident	56 Å²	56	61.7 Å²	61.7	25%	0.246	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	159.2	-178.9	73.8	-78.8	0	0	0	111.8	C1228 K1229 P1241	F1223-C1228 WeakPolarHBondContact O-CA 3.44Å; F1223-K1229 HydrophobicContact CD1-CB 4.41Å; F1223-K1229 WeakPolarHBondContact CD1-O 3.48Å; F1223-K1229 HydrophobicContact CE1-CB 4Å; F1223-K1229 HydrophobicContact CZ-CB 4.3Å; F1223-K1229 PolarHBondContact N-O 2.68Å; F1223-K1229 PolarHBondContact O-N 2.9Å; F1223-P1241 WeakPolarHBondContact CB-O 3.08Å
1224	G	77.3	Confident	73.2	Confident	31 Å²	31	63.7 Å²	63.7	32%	0.32	35%	0.353	S	S	.	.	S	Bend	trans	83.2	59.7	171.8	0	0	0	0	0	116.2	E1227 C1228 P1241	G1224-E1227 CarbonylContact O-C 3.53Å; G1224-E1227 PolarHBondContact O-N 2.99Å; G1224-E1227 VanDerWaalsContact O-O 3.1Å; G1224-C1228 PolarHBondContact O-N 3.38Å; G1224-P1241 PolarHBondContact N-O 3.33Å
1225	F	74.2	Confident	72	Confident	68 Å²	68	73 Å²	73	30%	0.298	39%	0.385	S	S	.	.	S	Bend	trans	-57.3	143.9	173	178.7	-84.1	0	0	0	111.7	E1190 V1210 C1218	E1190-F1225 HydrophobicContact CB-CE1 4.49Å; E1190-F1225 HydrophobicContact CB-CZ 4.36Å; V1210-F1225 HydrophobicContact CG1-CD2 4.45Å; V1210-F1225 HydrophobicContact CG1-CE2 3.97Å; C1218-F1225 PolarHBondContact SG-N 2.98Å
1226	P	69.2	Low	70.4	Confident	59 Å²	59	80.4 Å²	80.4	38%	0.383	43%	0.425	S	S	.	.	S	Bend	cis	-79	-21	-3.4	29.8	-34.4	0	0	0	114.4	E1190 C1228	E1190-P1226 HydrophobicContact CB-CB 4.3Å; P1226-C1228 VanDerWaalsContact C-N 3.3Å; P1226-C1228 PolarHBondContact O-N 3.48Å
1227	E	81	Confident	69.5	Low	145 Å²	145	82.3 Å²	82.3	68%	0.678	43%	0.431	S	S	*	.	S	Bend	trans	-79.8	67.3	178.2	-71.5	-160.5	158.8	0	0	113.6	G1224 K1229	G1224-E1227 CarbonylContact O-C 3.53Å; G1224-E1227 PolarHBondContact O-N 2.99Å; G1224-E1227 VanDerWaalsContact O-O 3.1Å; E1227-K1229 WeakPolarHBondContact O-CG 3.48Å; E1227-K1229 PolarHBondContact O-N 3.41Å; E1227-K1229 PolarHBondContact O-NZ 3.5Å; E1227-K1229 IonicContact OE2-NZ 2.68Å; E1227-K1229 PolarHBondContact OE2-NZ 3.02Å
1228	C	79.7	Confident	68.5	Low	12 Å²	12	84.3 Å²	84.3	8%	0.081	44%	0.443	C	S	.	.			trans	-58.2	114.4	-176.2	-61.5	0	0	0	0	113.9	N1209 C1218 Y1222 F1223 G1224 P1226	N1209-C1228 HydrophobicContact CB-CB 3.89Å; C1218-C1228 WeakPolarHBondContact CA-SG 3.37Å; C1218-C1228 HydrophobicContact CB-CB 3.78Å; C1218-C1228 WeakPolarHBondContact CB-SG 3.5Å; C1218-C1228 VanDerWaalsContact SG-CA 3.51Å; C1218-C1228 WeakPolarHBondContact SG-CB 3.31Å; C1218-C1228 CovalentContact SG-SG 2.04Å; C1218-C1228 PolarHBondContact SG-SG 2.63Å; Y1222-C1228 HydrophobicContact CD1-CB 4.49Å; Y1222-C1228 WeakPolarHBondContact CD1-O 3.46Å; F1223-C1228 WeakPolarHBondContact O-CA 3.44Å; G1224-C1228 PolarHBondContact O-N 3.38Å; P1226-C1228 VanDerWaalsContact C-N 3.3Å; P1226-C1228 PolarHBondContact O-N 3.48Å
1229	K	78.1	Confident	68	Low	92 Å²	92	84 Å²	84	40%	0.4	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	143	-178.2	-71.2	161.6	-171.3	75.4	0	111.5	Y1222 F1223 E1227	Y1222-K1229 CarbonylContact C-O 3.45Å; Y1222-K1229 WeakPolarHBondContact CA-O 3.26Å; Y1222-K1229 WeakPolarHBondContact CB-O 3.34Å; F1223-K1229 HydrophobicContact CD1-CB 4.41Å; F1223-K1229 WeakPolarHBondContact CD1-O 3.48Å; F1223-K1229 HydrophobicContact CE1-CB 4Å; F1223-K1229 HydrophobicContact CZ-CB 4.3Å; F1223-K1229 PolarHBondContact N-O 2.68Å; F1223-K1229 PolarHBondContact O-N 2.9Å; E1227-K1229 WeakPolarHBondContact O-CG 3.48Å; E1227-K1229 PolarHBondContact O-N 3.41Å; E1227-K1229 PolarHBondContact O-NZ 3.5Å; E1227-K1229 IonicContact OE2-NZ 2.68Å; E1227-K1229 PolarHBondContact OE2-NZ 3.02Å
1230	P	77.6	Confident	67.5	Low	87 Å²	87	80.6 Å²	80.6	57%	0.565	43%	0.43	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.4	146.7	-174.7	29.3	-35.5	0	0	0	113.8	G1221 Y1222	G1221-P1230 WeakPolarHBondContact O-CA 3.08Å; Y1222-P1230 HydrophobicContact CD1-CB 4.1Å; Y1222-P1230 HydrophobicContact CE1-CB 3.93Å; Y1222-P1230 HydrophobicContact CE1-CG 4.4Å
1231	C	66.9	Low	67.4	Low	33 Å²	33	82.1 Å²	82.1	22%	0.223	44%	0.439	C	S	.	.			trans	-84.7	160.4	179.6	-67.4	0	0	0	0	114.1	G1221 C1239	G1221-C1231 WeakPolarHBondContact O-CB 3.38Å; G1221-C1231 PolarHBondContact O-N 3.17Å; C1231-C1239 HydrophobicContact CB-CB 3.56Å; C1231-C1239 WeakPolarHBondContact CB-SG 3.38Å; C1231-C1239 WeakPolarHBondContact SG-CB 3.22Å; C1231-C1239 CovalentContact SG-SG 2.03Å; C1231-C1239 PolarHBondContact SG-SG 3.27Å
1232	N	73.6	Confident	67.4	Low	159 Å²	159	84.7 Å²	84.7	85%	0.85	45%	0.451	S	S	*	.			trans	-117.4	59	-174.3	-170.6	26.1	0	0	0	112.6
1233	C	63.4	Low	66.9	Low	37 Å²	37	85.6 Å²	85.6	25%	0.25	46%	0.463	C	S	.	.			trans	-113.8	158.8	-179.5	-58	0	0	0	0	112.1	F1237 C1246	C1233-F1237 HydrophobicContact CB-CB 4.05Å; C1233-F1237 VanDerWaalsContact CB-O 3.31Å; C1233-F1237 WeakPolarHBondContact CB-O 3.42Å; C1233-C1246 VanDerWaalsContact CA-SG 3.57Å; C1233-C1246 HydrophobicContact CB-CB 4.04Å; C1233-C1246 WeakPolarHBondContact CB-SG 3.18Å; C1233-C1246 WeakPolarHBondContact SG-CB 3.1Å; C1233-C1246 CovalentContact SG-SG 2.04Å; C1233-C1246 PolarHBondContact SG-SG 3.43Å
1234	S	59	Low	66.4	Low	92 Å²	92	83.7 Å²	83.7	64%	0.643	46%	0.46	S	S	*	.			trans	-65	153.2	172.9	-80.8	0	0	0	0	111.9	N1236 F1237	S1234-N1236 PolarHBondContact O-N 3.41Å; S1234-F1237 PolarHBondContact O-N 2.74Å
1235	R	54.1	Low	65.7	Low	254 Å²	254	85.5 Å²	85.5	96%	0.958	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.4	-14.5	-158.5	-108.7	-175.2	-169.6	178.6	4.2	120.7
1236	N	50.1	Low	65.3	Low	156 Å²	156	85.3 Å²	85.3	83%	0.834	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.9	8	179.5	-68.7	8.9	0	0	0	113.4	S1234	S1234-N1236 PolarHBondContact O-N 3.41Å
1237	F	57.7	Low	65.1	Low	84 Å²	84	88.8 Å²	88.8	37%	0.368	48%	0.48	S	S	.	.			trans	-106.3	126.5	-172.6	-71.3	-82.6	0	0	0	112.3	C1233 S1234 Y1247	C1233-F1237 HydrophobicContact CB-CB 4.05Å; C1233-F1237 VanDerWaalsContact CB-O 3.31Å; C1233-F1237 WeakPolarHBondContact CB-O 3.42Å; S1234-F1237 PolarHBondContact O-N 2.74Å; F1237-Y1247 WeakPolarHBondContact CD1-O 3.5Å; F1237-Y1247 WeakPolarHBondContact CE1-O 3.45Å
1238	M	52.9	Low	64.3	Low	97 Å²	97	85.2 Å²	85.2	48%	0.478	47%	0.471	S	S	.	.			trans	-77.7	159	175.8	-59.2	175.1	85.2	0	0	111.3
1239	C	64.8	Low	63.2	Low	19 Å²	19	85.5 Å²	85.5	13%	0.128	47%	0.472	C	S	.	.	B	Isolated β-bridge	trans	-118.4	156.5	-178.3	53.5	0	0	0	0	112.2	C1231 S1245	C1231-C1239 HydrophobicContact CB-CB 3.56Å; C1231-C1239 WeakPolarHBondContact CB-SG 3.38Å; C1231-C1239 WeakPolarHBondContact SG-CB 3.22Å; C1231-C1239 CovalentContact SG-SG 2.03Å; C1231-C1239 PolarHBondContact SG-SG 3.27Å; C1239-S1245 CarbonylContact C-O 3.57Å; C1239-S1245 VanDerWaalsContact CA-O 3.24Å; C1239-S1245 WeakPolarHBondContact CA-O 3.21Å
1240	D	59.6	Low	62.5	Low	33 Å²	33	85 Å²	85	18%	0.176	48%	0.478	C	S	.	.			trans	-60	129.3	172	-173.7	-79.6	0	0	0	111.8	S1242 T1243 G1244 S1245 Y1247	D1240-S1242 PolarHBondContact O-N 2.9Å; D1240-S1242 VanDerWaalsContact O-N 3.13Å; D1240-S1242 WeakPolarHBondContact OD1-CA 3.04Å; D1240-S1242 PolarHBondContact OD1-N 3.25Å; D1240-S1242 PolarHBondContact OD1-OG 2.95Å; D1240-T1243 VanDerWaalsContact CB-OG1 3.25Å; D1240-T1243 WeakPolarHBondContact CB-OG1 3.11Å; D1240-T1243 PolarHBondContact OD1-N 3.4Å; D1240-T1243 PolarHBondContact OD1-OG1 3.21Å; D1240-T1243 VanDerWaalsContact OD1-OG1 3.08Å; D1240-G1244 WeakPolarHBondContact O-CA 3.28Å; D1240-G1244 PolarHBondContact O-N 3.29Å; D1240-S1245 PolarHBondContact N-O 2.03Å; D1240-Y1247 HydrophobicContact CB-CE2 4.49Å; D1240-Y1247 VanDerWaalsContact CB-OH 3.29Å; D1240-Y1247 WeakPolarHBondContact CB-OH 3.01Å; D1240-Y1247 PolarHBondContact OD2-OH 2.73Å
1241	P	57.7	Low	62.2	Low	104 Å²	104	83.3 Å²	83.3	68%	0.675	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-18.8	-176.5	-23.9	34.3	0	0	0	115.6	F1223 G1224	F1223-P1241 WeakPolarHBondContact CB-O 3.08Å; G1224-P1241 PolarHBondContact N-O 3.33Å
1242	S	62.6	Low	62.3	Low	91 Å²	91	82.2 Å²	82.2	64%	0.636	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.7	-30.3	-174.1	69.4	0	0	0	0	113.5	D1240	D1240-S1242 PolarHBondContact O-N 2.9Å; D1240-S1242 VanDerWaalsContact O-N 3.13Å; D1240-S1242 WeakPolarHBondContact OD1-CA 3.04Å; D1240-S1242 PolarHBondContact OD1-N 3.25Å; D1240-S1242 PolarHBondContact OD1-OG 2.95Å
1243	T	68	Low	62.1	Low	88 Å²	88	79 Å²	79	54%	0.54	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.1	-12.7	-174.6	66.1	0	0	0	0	114.9	D1240 S1245	D1240-T1243 VanDerWaalsContact CB-OG1 3.25Å; D1240-T1243 WeakPolarHBondContact CB-OG1 3.11Å; D1240-T1243 PolarHBondContact OD1-N 3.4Å; D1240-T1243 PolarHBondContact OD1-OG1 3.21Å; D1240-T1243 VanDerWaalsContact OD1-OG1 3.08Å; T1243-S1245 PolarHBondContact O-N 2.95Å
1244	G	66.7	Low	62.3	Low	16 Å²	16	79.2 Å²	79.2	17%	0.165	45%	0.445	C	S	.	.			trans	75.5	10	177.3	0	0	0	0	0	116.9	D1240	D1240-G1244 WeakPolarHBondContact O-CA 3.28Å; D1240-G1244 PolarHBondContact O-N 3.29Å
1245	S	62.9	Low	62.6	Low	69 Å²	69	83.3 Å²	83.3	48%	0.483	46%	0.46	S	S	.	.			trans	-77.5	146	-178.5	-66	0	0	0	0	113.7	C1239 D1240 T1243	C1239-S1245 CarbonylContact C-O 3.57Å; C1239-S1245 VanDerWaalsContact CA-O 3.24Å; C1239-S1245 WeakPolarHBondContact CA-O 3.21Å; D1240-S1245 PolarHBondContact N-O 2.03Å; T1243-S1245 PolarHBondContact O-N 2.95Å
1246	C	65.9	Low	62.9	Low	64 Å²	64	79.2 Å²	79.2	43%	0.432	45%	0.449	S	S	.	.	B	Isolated β-bridge	trans	-96.7	158.6	-178.2	-37.2	0	0	0	0	113.2	C1233	C1233-C1246 VanDerWaalsContact CA-SG 3.57Å; C1233-C1246 HydrophobicContact CB-CB 4.04Å; C1233-C1246 WeakPolarHBondContact CB-SG 3.18Å; C1233-C1246 WeakPolarHBondContact SG-CB 3.1Å; C1233-C1246 CovalentContact SG-SG 2.04Å; C1233-C1246 PolarHBondContact SG-SG 3.43Å
1247	Y	63.9	Low	63.7	Low	133 Å²	133	73 Å²	73	52%	0.522	42%	0.418	S	S	.	.			trans	-126.7	164.9	-173.3	-52	-82.5	0	0	0	114.7	F1237 D1240	F1237-Y1247 WeakPolarHBondContact CD1-O 3.5Å; F1237-Y1247 WeakPolarHBondContact CE1-O 3.45Å; D1240-Y1247 HydrophobicContact CB-CE2 4.49Å; D1240-Y1247 VanDerWaalsContact CB-OH 3.29Å; D1240-Y1247 WeakPolarHBondContact CB-OH 3.01Å; D1240-Y1247 PolarHBondContact OD2-OH 2.73Å
1248	C	64.6	Low	64.4	Low	70 Å²	70	72.8 Å²	72.8	47%	0.473	42%	0.42	S	S	.	.			trans	-134.7	161.6	171.1	-103.1	0	0	0	0	113.8	C1257	C1248-C1257 HydrophobicContact CB-CB 4.03Å; C1248-C1257 WeakPolarHBondContact CB-SG 3.42Å; C1248-C1257 WeakPolarHBondContact SG-CB 3.46Å; C1248-C1257 CovalentContact SG-SG 2.05Å; C1248-C1257 PolarHBondContact SG-SG 3.2Å
1249	P	58.2	Low	65.5	Low	18 Å²	18	76.1 Å²	76.1	12%	0.117	43%	0.427	C	S	.	.			trans	-65.4	146.3	-177.5	-21.8	34.1	0	0	0	115.4	T1252	P1249-T1252 HydrophobicContact CB-CG2 3.88Å; P1249-T1252 PolarHBondContact O-OG1 2.98Å
1250	P	63.2	Low	66.1	Low	81 Å²	81	76.7 Å²	76.7	53%	0.526	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	147.5	173.2	-23.7	35.4	0	0	0	113.2	T1252 G1272 C1273	P1250-T1252 PolarHBondContact O-N 3.41Å; P1250-G1272 WeakPolarHBondContact O-CA 3.08Å; P1250-C1273 PolarHBondContact O-N 3.34Å
1251	L	70.2	Confident	66.9	Low	52 Å²	52	79.7 Å²	79.7	27%	0.272	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.7	16.6	177.5	-66.7	164.7	0	0	0	115.7	K1261 A1264 C1273 E1275	L1251-K1261 WeakPolarHBondContact O-CG 3.44Å; L1251-K1261 PolarHBondContact O-N 3.12Å; L1251-A1264 HydrophobicContact CB-CB 4.28Å; L1251-C1273 HydrophobicContact CB-CB 4.11Å; L1251-C1273 VanDerWaalsContact CD1-O 3.28Å; L1251-C1273 WeakPolarHBondContact CD1-O 3.21Å; L1251-E1275 HydrophobicContact CD1-CB 4.45Å; L1251-E1275 HydrophobicContact CD1-CG 3.82Å; L1251-E1275 HydrophobicContact CD2-CG 4.15Å
1252	T	70	Confident	67.8	Low	10 Å²	10	79.9 Å²	79.9	6%	0.061	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	154.5	173.8	63.7	0	0	0	0	113.8	P1249 P1250 R1259 K1261 F1267	P1249-T1252 HydrophobicContact CB-CG2 3.88Å; P1249-T1252 PolarHBondContact O-OG1 2.98Å; P1250-T1252 PolarHBondContact O-N 3.41Å; T1252-R1259 CarbonylContact C-O 2.98Å; T1252-R1259 WeakPolarHBondContact CA-O 3.35Å; T1252-R1259 WeakPolarHBondContact CB-O 3.44Å; T1252-K1261 WeakPolarHBondContact O-CE 3.38Å; T1252-F1267 HydrophobicContact CG2-CD2 4.4Å; T1252-F1267 HydrophobicContact CG2-CE2 4.25Å
1253	E	69.3	Low	68.7	Low	91 Å²	91	79.5 Å²	79.5	43%	0.425	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	176.4	173.7	61	170	-123	0	0	112	C1257 D1258 R1259 K1261	E1253-C1257 CarbonylContact O-C 3.49Å; E1253-D1258 PolarHBondContact O-N 3.25Å; E1253-R1259 HydrophobicContact CG-CB 4.24Å; E1253-R1259 PolarHBondContact N-O 2.99Å; E1253-R1259 PolarHBondContact O-N 2.92Å; E1253-R1259 VanDerWaalsContact O-N 3.1Å; E1253-K1261 HydrophobicContact CB-CG 3.99Å; E1253-K1261 HydrophobicContact CG-CG 4.02Å
1254	G	67.3	Low	69.2	Low	42 Å²	42	75.8 Å²	75.8	43%	0.433	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.1	158.6	-174.8	0	0	0	0	0	113.4	K1256 C1257	G1254-K1256 PolarHBondContact O-N 2.94Å; G1254-C1257 PolarHBondContact O-N 3.37Å
1255	N	65.9	Low	70.1	Confident	178 Å²	178	76.1 Å²	76.1	95%	0.952	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-4.9	-176.3	-73.9	-13.4	0	0	0	114
1256	K	59.2	Low	70.4	Confident	167 Å²	167	74.4 Å²	74.4	73%	0.726	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.5	11.6	171.9	-59.2	177	-177.9	174.6	0	112.3	G1254 D1258	G1254-K1256 PolarHBondContact O-N 2.94Å; K1256-D1258 VanDerWaalsContact C-N 3.35Å; K1256-D1258 HydrophobicContact CB-CB 4.05Å; K1256-D1258 PolarHBondContact N-OD1 3.18Å; K1256-D1258 VanDerWaalsContact N-OD1 3.14Å
1257	C	67.4	Low	70.5	Confident	27 Å²	27	75.8 Å²	75.8	18%	0.182	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	51	-171.8	-56.3	0	0	0	0	111.5	C1248 E1253 G1254	C1248-C1257 HydrophobicContact CB-CB 4.03Å; C1248-C1257 WeakPolarHBondContact CB-SG 3.42Å; C1248-C1257 WeakPolarHBondContact SG-CB 3.46Å; C1248-C1257 CovalentContact SG-SG 2.05Å; C1248-C1257 PolarHBondContact SG-SG 3.2Å; E1253-C1257 CarbonylContact O-C 3.49Å; G1254-C1257 PolarHBondContact O-N 3.37Å
1258	D	71.6	Confident	70.2	Confident	78 Å²	78	71.9 Å²	71.9	42%	0.417	39%	0.385	S	S	.	.			trans	-115.7	12.8	-161.5	56.2	-49.4	0	0	0	115	E1253 K1256	E1253-D1258 PolarHBondContact O-N 3.25Å; K1256-D1258 VanDerWaalsContact C-N 3.35Å; K1256-D1258 HydrophobicContact CB-CB 4.05Å; K1256-D1258 PolarHBondContact N-OD1 3.18Å; K1256-D1258 VanDerWaalsContact N-OD1 3.14Å
1259	R	76.7	Confident	69.6	Low	167 Å²	167	73.1 Å²	73.1	63%	0.63	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.7	158	174.9	-66.2	-175.3	174.5	-161.8	-7.1	112.1	T1252 E1253	T1252-R1259 CarbonylContact C-O 2.98Å; T1252-R1259 WeakPolarHBondContact CA-O 3.35Å; T1252-R1259 WeakPolarHBondContact CB-O 3.44Å; E1253-R1259 HydrophobicContact CG-CB 4.24Å; E1253-R1259 PolarHBondContact N-O 2.99Å; E1253-R1259 PolarHBondContact O-N 2.92Å; E1253-R1259 VanDerWaalsContact O-N 3.1Å
1260	C	76.9	Confident	69	Low	32 Å²	32	75.3 Å²	75.3	22%	0.216	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	147.2	164	-60.2	0	0	0	0	111.9	A1264 C1273	C1260-A1264 HydrophobicContact CB-CB 4.33Å; C1260-C1273 WeakPolarHBondContact CA-SG 3.4Å; C1260-C1273 HydrophobicContact CB-CB 3.76Å; C1260-C1273 WeakPolarHBondContact CB-SG 3.37Å; C1260-C1273 WeakPolarHBondContact SG-CB 3Å; C1260-C1273 CovalentContact SG-SG 2.03Å; C1260-C1273 PolarHBondContact SG-SG 3.42Å
1261	K	77.1	Confident	68.2	Low	96 Å²	96	76 Å²	76	42%	0.417	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-71.2	157.4	163.3	-67.7	-174.8	-178.6	-175.8	0	110.7	L1251 T1252 E1253 A1264	L1251-K1261 WeakPolarHBondContact O-CG 3.44Å; L1251-K1261 PolarHBondContact O-N 3.12Å; T1252-K1261 WeakPolarHBondContact O-CE 3.38Å; E1253-K1261 HydrophobicContact CB-CG 3.99Å; E1253-K1261 HydrophobicContact CG-CG 4.02Å; K1261-A1264 WeakPolarHBondContact O-CB 3.48Å; K1261-A1264 PolarHBondContact O-N 3.3Å; K1261-A1264 VanDerWaalsContact O-N 3.09Å
1262	V	76.7	Confident	68	Low	108 Å²	108	73.5 Å²	73.5	66%	0.655	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	141.2	173	-169.4	0	0	0	0	110.2	A1264	V1262-A1264 VanDerWaalsContact C-N 3.32Å
1263	H	80.3	Confident	68.4	Low	83 Å²	83	73.5 Å²	73.5	38%	0.384	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.3	17.8	-170.9	-44.4	-63.9	0	0	0	115.6	C1276 L1288 N1289	H1263-C1276 VanDerWaalsContact C-SG 3.56Å; H1263-C1276 WeakPolarHBondContact O-CB 3.42Å; H1263-C1276 PolarHBondContact O-N 3.05Å; H1263-C1276 PolarHBondContact O-SG 3.16Å; H1263-L1288 WeakPolarHBondContact ND1-CB 3.46Å; H1263-L1288 PolarHBondContact ND1-O 2.03Å; H1263-N1289 PolarHBondContact CE1-OD1 3.15Å; H1263-N1289 VanDerWaalsContact CE1-OD1 3.25Å; H1263-N1289 PolarHBondContact ND1-OD1 3.33Å
1264	A	79	Confident	68.6	Low	10 Å²	10	74.3 Å²	74.3	8%	0.083	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	151.5	167.5	0	0	0	0	0	112.8	L1251 C1260 K1261 V1262 C1273 Q1274	L1251-A1264 HydrophobicContact CB-CB 4.28Å; C1260-A1264 HydrophobicContact CB-CB 4.33Å; K1261-A1264 WeakPolarHBondContact O-CB 3.48Å; K1261-A1264 PolarHBondContact O-N 3.3Å; K1261-A1264 VanDerWaalsContact O-N 3.09Å; V1262-A1264 VanDerWaalsContact C-N 3.32Å; A1264-C1273 HydrophobicContact CB-CB 3.81Å; A1264-Q1274 CarbonylContact C-O 3.55Å; A1264-Q1274 WeakPolarHBondContact CA-O 3.48Å; A1264-Q1274 VanDerWaalsContact CB-O 3.31Å; A1264-Q1274 WeakPolarHBondContact CB-O 3.47Å
1265	Y	85.8	Confident	69.1	Low	22 Å²	22	76.6 Å²	76.6	9%	0.086	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	168.5	-178.6	71.2	-84.9	0	0	0	111.2	Q1274 E1275 C1290 D1291 E1292 R1306	Y1265-Q1274 HydrophobicContact CD1-CB 4.32Å; Y1265-Q1274 VanDerWaalsContact CD1-O 3.23Å; Y1265-Q1274 WeakPolarHBondContact CD1-O 3.07Å; Y1265-Q1274 HydrophobicContact CE1-CB 3.91Å; Y1265-Q1274 HydrophobicContact CE2-CB 4.33Å; Y1265-Q1274 PolarHBondContact N-O 2.03Å; Y1265-Q1274 PolarHBondContact O-N 3.29Å; Y1265-Q1274 PolarHBondContact OH-OE1 2.7Å; Y1265-E1275 WeakPolarHBondContact CE1-O 3.25Å; Y1265-C1290 VanDerWaalsContact CD1-SG 3.56Å; Y1265-D1291 VanDerWaalsContact CB-O 3.3Å; Y1265-D1291 WeakPolarHBondContact CB-O 3.19Å; Y1265-E1292 WeakPolarHBondContact CB-O 3.5Å; Y1265-R1306 PolarHBondContact OH-NE 3.28Å; Y1265-R1306 PolarHBondContact OH-NH2 3.14Å
1266	G	69.1	Low	69.8	Low	33 Å²	33	68.2 Å²	68.2	34%	0.34	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	67.2	69.2	172.3	0	0	0	0	0	113.9	D1268 E1292	G1266-D1268 PolarHBondContact O-N 3.5Å; G1266-E1292 PolarHBondContact N-O 2.97Å
1267	F	69	Low	70.9	Confident	94 Å²	94	64.9 Å²	64.9	41%	0.412	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	124.3	177.7	173.7	-99.8	0	0	0	112.7	T1252 P1269	T1252-F1267 HydrophobicContact CG2-CD2 4.4Å; T1252-F1267 HydrophobicContact CG2-CE2 4.25Å; F1267-P1269 HydrophobicContact CE1-CG 4.14Å; F1267-P1269 HydrophobicContact CZ-CG 4.43Å
1268	D	57.5	Low	71.6	Confident	51 Å²	51	63.9 Å²	63.9	27%	0.273	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	129.6	173.1	179.4	-71.8	0	0	0	110.9	G1266 L1270 I1271 G1272	G1266-D1268 PolarHBondContact O-N 3.5Å; D1268-L1270 PolarHBondContact O-N 3.35Å; D1268-L1270 VanDerWaalsContact O-N 3.12Å; D1268-L1270 VanDerWaalsContact OD1-CA 3.26Å; D1268-L1270 WeakPolarHBondContact OD1-CA 3.34Å; D1268-L1270 WeakPolarHBondContact OD1-CB 3.17Å; D1268-L1270 PolarHBondContact OD1-N 2.04Å; D1268-I1271 HydrophobicContact CB-CB 3.99Å; D1268-I1271 HydrophobicContact CB-CD1 4.47Å; D1268-I1271 HydrophobicContact CB-CG1 4.4Å; D1268-I1271 PolarHBondContact O-N 2.9Å; D1268-I1271 PolarHBondContact OD1-N 2.62Å; D1268-G1272 PolarHBondContact N-O 3.32Å; D1268-G1272 PolarHBondContact O-N 3.27Å
1269	P	51.6	Low	72.1	Confident	96 Å²	96	61.6 Å²	61.6	62%	0.623	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-20.5	-178.5	-25.1	34.6	0	0	0	116.1	F1267	F1267-P1269 HydrophobicContact CE1-CG 4.14Å; F1267-P1269 HydrophobicContact CZ-CG 4.43Å
1270	L	44.7	Very low	72.3	Confident	64 Å²	64	56.8 Å²	56.8	34%	0.335	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.8	-12	-175.2	-86.1	155.3	0	0	0	113.6	R884 D1268	R884-L1270 WeakPolarHBondContact CD-O 3.45Å; R884-L1270 VanDerWaalsContact CZ-C 3.5Å; R884-L1270 PolarHBondContact NE-O 3.43Å; R884-L1270 VanDerWaalsContact NE-O 3.07Å; R884-L1270 VanDerWaalsContact NH1-C 3.33Å; R884-L1270 PolarHBondContact NH1-O 3.16Å; R884-L1270 PolarHBondContact NH2-O 3.36Å; D1268-L1270 PolarHBondContact O-N 3.35Å; D1268-L1270 VanDerWaalsContact O-N 3.12Å; D1268-L1270 VanDerWaalsContact OD1-CA 3.26Å; D1268-L1270 WeakPolarHBondContact OD1-CA 3.34Å; D1268-L1270 WeakPolarHBondContact OD1-CB 3.17Å; D1268-L1270 PolarHBondContact OD1-N 2.04Å
1271	I	46.8	Very low	72.6	Confident	94 Å²	94	59.4 Å²	59.4	48%	0.482	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.5	-36.5	178.3	-56	170.3	0	0	0	111.3	R884 D1268	R884-I1271 PolarHBondContact NH2-O 3.21Å; D1268-I1271 HydrophobicContact CB-CB 3.99Å; D1268-I1271 HydrophobicContact CB-CD1 4.47Å; D1268-I1271 HydrophobicContact CB-CG1 4.4Å; D1268-I1271 PolarHBondContact O-N 2.9Å; D1268-I1271 PolarHBondContact OD1-N 2.62Å
1272	G	65.9	Low	72.5	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.01	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	106.1	-131.2	-173.2	0	0	0	0	0	111.2	P1250 D1268	P1250-G1272 WeakPolarHBondContact O-CA 3.08Å; D1268-G1272 PolarHBondContact N-O 3.32Å; D1268-G1272 PolarHBondContact O-N 3.27Å
1273	C	78.3	Confident	72.9	Confident	10 Å²	10	49.7 Å²	49.7	7%	0.068	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	163.8	171.6	-59.8	0	0	0	0	111.4	P1250 L1251 C1260 A1264	P1250-C1273 PolarHBondContact O-N 3.34Å; L1251-C1273 HydrophobicContact CB-CB 4.11Å; L1251-C1273 VanDerWaalsContact CD1-O 3.28Å; L1251-C1273 WeakPolarHBondContact CD1-O 3.21Å; C1260-C1273 WeakPolarHBondContact CA-SG 3.4Å; C1260-C1273 HydrophobicContact CB-CB 3.76Å; C1260-C1273 WeakPolarHBondContact CB-SG 3.37Å; C1260-C1273 WeakPolarHBondContact SG-CB 3Å; C1260-C1273 CovalentContact SG-SG 2.03Å; C1260-C1273 PolarHBondContact SG-SG 3.42Å; A1264-C1273 HydrophobicContact CB-CB 3.81Å
1274	Q	74.2	Confident	72.7	Confident	108 Å²	108	50 Å²	50	51%	0.505	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	139.1	179.2	-61.5	-174.1	3	0	0	111.8	A1264 Y1265	A1264-Q1274 CarbonylContact C-O 3.55Å; A1264-Q1274 WeakPolarHBondContact CA-O 3.48Å; A1264-Q1274 VanDerWaalsContact CB-O 3.31Å; A1264-Q1274 WeakPolarHBondContact CB-O 3.47Å; Y1265-Q1274 HydrophobicContact CD1-CB 4.32Å; Y1265-Q1274 VanDerWaalsContact CD1-O 3.23Å; Y1265-Q1274 WeakPolarHBondContact CD1-O 3.07Å; Y1265-Q1274 HydrophobicContact CE1-CB 3.91Å; Y1265-Q1274 HydrophobicContact CE2-CB 4.33Å; Y1265-Q1274 PolarHBondContact N-O 2.03Å; Y1265-Q1274 PolarHBondContact O-N 3.29Å; Y1265-Q1274 PolarHBondContact OH-OE1 2.7Å
1275	E	77	Confident	72.5	Confident	89 Å²	89	58.4 Å²	58.4	42%	0.416	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	138.3	177.5	-95.7	168.8	-127.3	0	0	113.4	L1251 Y1265 H1277	L1251-E1275 HydrophobicContact CD1-CB 4.45Å; L1251-E1275 HydrophobicContact CD1-CG 3.82Å; L1251-E1275 HydrophobicContact CD2-CG 4.15Å; Y1265-E1275 WeakPolarHBondContact CE1-O 3.25Å; E1275-H1277 WeakPolarHBondContact CB-NE2 3.49Å; E1275-H1277 PolarHBondContact O-CD2 2.8Å; E1275-H1277 VanDerWaalsContact O-CD2 3.24Å; E1275-H1277 PolarHBondContact O-N 2.95Å; E1275-H1277 IonicContact OE2-CE1 3.01Å; E1275-H1277 PolarHBondContact OE2-CE1 2.96Å; E1275-H1277 IonicContact OE2-ND1 3.46Å; E1275-H1277 PolarHBondContact OE2-ND1 2.97Å; E1275-H1277 IonicContact OE2-NE2 3.83Å
1276	C	80.1	Confident	71.9	Confident	3 Å²	3	63.9 Å²	63.9	2%	0.02	34%	0.337	C	S	.	.			trans	-57.7	-49	175.7	-71.5	0	0	0	0	111.9	H1263 C1278 C1290 R1306	H1263-C1276 VanDerWaalsContact C-SG 3.56Å; H1263-C1276 WeakPolarHBondContact O-CB 3.42Å; H1263-C1276 PolarHBondContact O-N 3.05Å; H1263-C1276 PolarHBondContact O-SG 3.16Å; C1276-C1278 VanDerWaalsContact C-N 3.3Å; C1276-C1278 PolarHBondContact O-N 2.97Å; C1276-C1290 WeakPolarHBondContact CA-SG 3.05Å; C1276-C1290 HydrophobicContact CB-CB 3.64Å; C1276-C1290 WeakPolarHBondContact CB-SG 3.05Å; C1276-C1290 WeakPolarHBondContact SG-CB 3.07Å; C1276-C1290 PolarHBondContact SG-N 3.14Å; C1276-C1290 CovalentContact SG-SG 2.03Å; C1276-C1290 PolarHBondContact SG-SG 3.37Å; C1276-R1306 PolarHBondContact O-NH1 2.68Å
1277	H	83	Confident	72.2	Confident	96 Å²	96	64.1 Å²	64.1	44%	0.444	33%	0.333	S	S	.	.			trans	51	37.5	-172.9	-56.3	-75.2	0	0	0	115	E1275 R1307	E1275-H1277 WeakPolarHBondContact CB-NE2 3.49Å; E1275-H1277 PolarHBondContact O-CD2 2.8Å; E1275-H1277 VanDerWaalsContact O-CD2 3.24Å; E1275-H1277 PolarHBondContact O-N 2.95Å; E1275-H1277 IonicContact OE2-CE1 3.01Å; E1275-H1277 PolarHBondContact OE2-CE1 2.96Å; E1275-H1277 IonicContact OE2-ND1 3.46Å; E1275-H1277 PolarHBondContact OE2-ND1 2.97Å; E1275-H1277 IonicContact OE2-NE2 3.83Å; H1277-R1307 HydrophobicContact CB-CG 4.4Å; H1277-R1307 PolarHBondContact CD2-NH2 3.42Å; H1277-R1307 WeakPolarHBondContact O-CB 3.49Å; H1277-R1307 WeakPolarHBondContact O-CD 3.09Å; H1277-R1307 WeakPolarHBondContact O-CG 3.41Å
1278	C	83.1	Confident	72.6	Confident	7 Å²	7	63.5 Å²	63.5	5%	0.047	33%	0.334	C	S	.	.			trans	-61.7	137.6	177.4	-58	0	0	0	0	112.3	C1276 V1280 T1283 C1297	C1276-C1278 VanDerWaalsContact C-N 3.3Å; C1276-C1278 PolarHBondContact O-N 2.97Å; C1278-V1280 PolarHBondContact O-N 3.17Å; C1278-T1283 HydrophobicContact CB-CG2 3.9Å; C1278-C1297 WeakPolarHBondContact CA-SG 3.38Å; C1278-C1297 HydrophobicContact CB-CB 3.77Å; C1278-C1297 WeakPolarHBondContact CB-SG 3.38Å; C1278-C1297 WeakPolarHBondContact SG-CB 3.33Å; C1278-C1297 CovalentContact SG-SG 2.03Å; C1278-C1297 PolarHBondContact SG-SG 3.16Å
1279	S	81.7	Confident	73.5	Confident	30 Å²	30	65.5 Å²	65.5	21%	0.21	35%	0.345	C	S	.	.			trans	-77.3	110.1	175.7	-177.7	0	0	0	0	111.1	V1281 G1282 T1283 R1307 Y1318	S1279-V1281 PolarHBondContact O-N 2.7Å; S1279-G1282 PolarHBondContact O-N 2.97Å; S1279-T1283 PolarHBondContact O-N 3Å; S1279-T1283 PolarHBondContact O-OG1 3.35Å; S1279-R1307 VanDerWaalsContact CB-O 3.26Å; S1279-R1307 WeakPolarHBondContact CB-O 3.42Å; S1279-R1307 PolarHBondContact N-O 2.79Å; S1279-Y1318 WeakPolarHBondContact CB-OH 3.05Å; S1279-Y1318 PolarHBondContact OG-OH 2.75Å
1280	V	80.4	Confident	75	Confident	65 Å²	65	61.8 Å²	61.8	39%	0.394	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.3	-28.1	177.2	-171.1	0	0	0	0	113.4	C1278 Q1286 L1288	C1278-V1280 PolarHBondContact O-N 3.17Å; V1280-Q1286 HydrophobicContact CG1-CB 3.88Å; V1280-Q1286 HydrophobicContact CG1-CG 4.32Å; V1280-Q1286 WeakPolarHBondContact O-CG 3.18Å; V1280-L1288 HydrophobicContact CG2-CD2 3.75Å; V1280-L1288 HydrophobicContact CG2-CG 4.47Å
1281	V	84.1	Confident	76.7	Confident	87 Å²	87	61.9 Å²	61.9	53%	0.527	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-18.4	-176.4	-153.1	0	0	0	0	112.8	S1279 M1300 P1319	S1279-V1281 PolarHBondContact O-N 2.7Å; V1281-M1300 VanDerWaalsContact O-CE 3.3Å; V1281-M1300 WeakPolarHBondContact O-CE 3.11Å; V1281-P1319 HydrophobicContact CB-CB 4.43Å; V1281-P1319 HydrophobicContact CG1-CB 3.81Å; V1281-P1319 HydrophobicContact CG1-CG 3.77Å
1282	G	75.4	Confident	77.9	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.5	-10.1	-179.1	0	0	0	0	0	114.7	S1279 M1300 C1308 Y1318	S1279-G1282 PolarHBondContact O-N 2.97Å; G1282-M1300 WeakPolarHBondContact O-CG 3.11Å; G1282-M1300 PolarHBondContact O-N 3.47Å; G1282-C1308 WeakPolarHBondContact CA-O 3.43Å; G1282-C1308 WeakPolarHBondContact O-CB 3.47Å; G1282-Y1318 PolarHBondContact N-OH 3.07Å
1283	T	83.4	Confident	78.1	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	37%	0.367	C	S	.	.	B	Isolated β-bridge	trans	-84.2	146.8	172.2	50.1	0	0	0	0	113	C1278 S1279 E1285 Q1286 S1287 C1297 S1298 M1300 C1308	C1278-T1283 HydrophobicContact CB-CG2 3.9Å; S1279-T1283 PolarHBondContact O-N 3Å; S1279-T1283 PolarHBondContact O-OG1 3.35Å; T1283-E1285 PolarHBondContact O-N 3.09Å; T1283-Q1286 PolarHBondContact O-N 3.15Å; T1283-S1287 PolarHBondContact OG1-N 3.23Å; T1283-S1287 PolarHBondContact OG1-O 3.19Å; T1283-C1297 HydrophobicContact CG2-CB 3.87Å; T1283-S1298 CarbonylContact C-O 3.09Å; T1283-S1298 WeakPolarHBondContact CA-O 3.34Å; T1283-M1300 WeakPolarHBondContact O-CE 3.49Å; T1283-C1308 HydrophobicContact CG2-CB 4.11Å
1284	I	77.4	Confident	77.9	Confident	90 Å²	90	74 Å²	74	46%	0.462	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-57	133.2	165.7	-61.6	172	0	0	0	108.3	Q1286 S1287 S1298 C1299	I1284-Q1286 PolarHBondContact O-N 2.77Å; I1284-Q1286 VanDerWaalsContact O-N 3.08Å; I1284-S1287 PolarHBondContact O-N 3.12Å; I1284-S1298 PolarHBondContact N-O 3.44Å; I1284-C1299 WeakPolarHBondContact CD1-O 3.46Å
1285	E	75	Confident	78.1	Confident	187 Å²	187	68.8 Å²	68.8	87%	0.874	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	54.8	24.7	178.7	-65.9	177.8	-178.2	0	0	115.2	T1283 S1287	T1283-E1285 PolarHBondContact O-N 3.09Å; E1285-S1287 PolarHBondContact O-N 3.04Å
1286	Q	72.9	Confident	78.4	Confident	137 Å²	137	68.5 Å²	68.5	64%	0.64	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	59.6	22.2	-179.8	-54.6	-174.3	-14.8	0	0	113.8	V1280 T1283 I1284 L1288	V1280-Q1286 HydrophobicContact CG1-CB 3.88Å; V1280-Q1286 HydrophobicContact CG1-CG 4.32Å; V1280-Q1286 WeakPolarHBondContact O-CG 3.18Å; T1283-Q1286 PolarHBondContact O-N 3.15Å; I1284-Q1286 PolarHBondContact O-N 2.77Å; I1284-Q1286 VanDerWaalsContact O-N 3.08Å; Q1286-L1288 PolarHBondContact O-N 2.79Å
1287	S	74.2	Confident	78.7	Confident	37 Å²	37	68.5 Å²	68.5	26%	0.259	36%	0.36	S	S	.	.			trans	-60.1	131.9	-175.9	-178.2	0	0	0	0	112.6	T1283 I1284 E1285 N1289	T1283-S1287 PolarHBondContact OG1-N 3.23Å; T1283-S1287 PolarHBondContact OG1-O 3.19Å; I1284-S1287 PolarHBondContact O-N 3.12Å; E1285-S1287 PolarHBondContact O-N 3.04Å; S1287-N1289 PolarHBondContact OG-N 3.28Å; S1287-N1289 VanDerWaalsContact OG-N 3.1Å
1288	L	77.3	Confident	78.8	Confident	82 Å²	82	67.3 Å²	67.3	43%	0.429	36%	0.363	S	S	.	.			trans	-93.8	2.4	168.3	-72.5	174.4	0	0	0	112.9	H1263 V1280 Q1286	H1263-L1288 WeakPolarHBondContact ND1-CB 3.46Å; H1263-L1288 PolarHBondContact ND1-O 2.03Å; V1280-L1288 HydrophobicContact CG2-CD2 3.75Å; V1280-L1288 HydrophobicContact CG2-CG 4.47Å; Q1286-L1288 PolarHBondContact O-N 2.79Å
1289	N	76.7	Confident	79	Confident	92 Å²	92	68.5 Å²	68.5	49%	0.492	37%	0.371	S	S	.	.			trans	-89.8	136.9	179.1	-64.5	-8.5	0	0	0	110.2	H1263 S1287	H1263-N1289 PolarHBondContact CE1-OD1 3.15Å; H1263-N1289 VanDerWaalsContact CE1-OD1 3.25Å; H1263-N1289 PolarHBondContact ND1-OD1 3.33Å; S1287-N1289 PolarHBondContact OG-N 3.28Å; S1287-N1289 VanDerWaalsContact OG-N 3.1Å
1290	C	82.9	Confident	79	Confident	19 Å²	19	70.7 Å²	70.7	13%	0.128	38%	0.378	C	S	.	.	B	Isolated β-bridge	trans	-117.8	170	169.1	68.7	0	0	0	0	110.3	Y1265 C1276 E1292 G1295 Q1296	Y1265-C1290 VanDerWaalsContact CD1-SG 3.56Å; C1276-C1290 WeakPolarHBondContact CA-SG 3.05Å; C1276-C1290 HydrophobicContact CB-CB 3.64Å; C1276-C1290 WeakPolarHBondContact CB-SG 3.05Å; C1276-C1290 WeakPolarHBondContact SG-CB 3.07Å; C1276-C1290 PolarHBondContact SG-N 3.14Å; C1276-C1290 CovalentContact SG-SG 2.03Å; C1276-C1290 PolarHBondContact SG-SG 3.37Å; C1290-E1292 PolarHBondContact O-N 2.89Å; C1290-G1295 WeakPolarHBondContact CB-O 3.4Å; C1290-Q1296 VanDerWaalsContact CA-O 3.32Å; C1290-Q1296 WeakPolarHBondContact CA-O 3.48Å; C1290-Q1296 WeakPolarHBondContact CB-O 3.4Å
1291	D	80.2	Confident	78.7	Confident	65 Å²	65	77 Å²	77	35%	0.348	40%	0.4	S	S	.	.			trans	-58.7	127.1	170.1	-175.9	-59.4	0	0	0	111.6	Y1265 T1293 N1294 G1295 Q1296	Y1265-D1291 VanDerWaalsContact CB-O 3.3Å; Y1265-D1291 WeakPolarHBondContact CB-O 3.19Å; D1291-T1293 PolarHBondContact O-N 3.11Å; D1291-T1293 VanDerWaalsContact O-N 3.13Å; D1291-T1293 WeakPolarHBondContact OD1-CA 3.47Å; D1291-T1293 WeakPolarHBondContact OD1-CB 3.32Å; D1291-T1293 PolarHBondContact OD1-N 2.91Å; D1291-T1293 PolarHBondContact OD1-OG1 3.29Å; D1291-N1294 VanDerWaalsContact CB-OD1 3.29Å; D1291-N1294 WeakPolarHBondContact CB-OD1 3.37Å; D1291-N1294 VanDerWaalsContact CG-CG 3.4Å; D1291-N1294 PolarHBondContact OD1-N 3.03Å; D1291-N1294 PolarHBondContact OD1-ND2 2.96Å; D1291-N1294 PolarHBondContact OD2-ND2 2.81Å; D1291-G1295 VanDerWaalsContact O-CA 3.32Å; D1291-G1295 WeakPolarHBondContact O-CA 3.47Å; D1291-G1295 PolarHBondContact O-N 2.96Å; D1291-Q1296 PolarHBondContact N-O 3.12Å
1292	E	71.8	Confident	78.7	Confident	162 Å²	162	75.2 Å²	75.2	76%	0.757	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-14.7	-176.5	-62.5	-175.3	167	0	0	114.1	Y1265 G1266 C1290	Y1265-E1292 WeakPolarHBondContact CB-O 3.5Å; G1266-E1292 PolarHBondContact N-O 2.97Å; C1290-E1292 PolarHBondContact O-N 2.89Å
1293	T	70.5	Confident	79	Confident	113 Å²	113	75.6 Å²	75.6	69%	0.693	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.1	-45.4	-177.8	69.9	0	0	0	0	113.3	D1291	D1291-T1293 PolarHBondContact O-N 3.11Å; D1291-T1293 VanDerWaalsContact O-N 3.13Å; D1291-T1293 WeakPolarHBondContact OD1-CA 3.47Å; D1291-T1293 WeakPolarHBondContact OD1-CB 3.32Å; D1291-T1293 PolarHBondContact OD1-N 2.91Å; D1291-T1293 PolarHBondContact OD1-OG1 3.29Å
1294	N	74.8	Confident	78.6	Confident	84 Å²	84	76.1 Å²	76.1	45%	0.449	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.5	-8	-173.6	63.5	61.3	0	0	0	114.6	D1291 Q1296	D1291-N1294 VanDerWaalsContact CB-OD1 3.29Å; D1291-N1294 WeakPolarHBondContact CB-OD1 3.37Å; D1291-N1294 VanDerWaalsContact CG-CG 3.4Å; D1291-N1294 PolarHBondContact OD1-N 3.03Å; D1291-N1294 PolarHBondContact OD1-ND2 2.96Å; D1291-N1294 PolarHBondContact OD2-ND2 2.81Å; N1294-Q1296 VanDerWaalsContact C-N 3.29Å; N1294-Q1296 PolarHBondContact O-N 2.98Å; N1294-Q1296 WeakPolarHBondContact OD1-CB 3.34Å; N1294-Q1296 PolarHBondContact OD1-N 3.08Å
1295	G	78.1	Confident	78.3	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	39%	0.387	C	S	.	.			trans	72.5	11.6	174.8	0	0	0	0	0	115.8	C1290 D1291 R1306	C1290-G1295 WeakPolarHBondContact CB-O 3.4Å; D1291-G1295 VanDerWaalsContact O-CA 3.32Å; D1291-G1295 WeakPolarHBondContact O-CA 3.47Å; D1291-G1295 PolarHBondContact O-N 2.96Å; G1295-R1306 WeakPolarHBondContact O-CD 3.36Å; G1295-R1306 WeakPolarHBondContact O-CG 3.41Å; G1295-R1306 PolarHBondContact O-NH1 2.94Å
1296	Q	83	Confident	78.5	Confident	83 Å²	83	67.2 Å²	67.2	39%	0.388	36%	0.357	S	S	.	.			trans	-71	136.6	176.8	-176.8	58.1	50.3	0	0	111.8	C1290 D1291 N1294 G1305 R1306	C1290-Q1296 VanDerWaalsContact CA-O 3.32Å; C1290-Q1296 WeakPolarHBondContact CA-O 3.48Å; C1290-Q1296 WeakPolarHBondContact CB-O 3.4Å; D1291-Q1296 PolarHBondContact N-O 3.12Å; N1294-Q1296 VanDerWaalsContact C-N 3.29Å; N1294-Q1296 PolarHBondContact O-N 2.98Å; N1294-Q1296 WeakPolarHBondContact OD1-CB 3.34Å; N1294-Q1296 PolarHBondContact OD1-N 3.08Å; Q1296-G1305 PolarHBondContact NE2-O 3.19Å; Q1296-R1306 PolarHBondContact NE2-O 2.82Å
1297	C	86.9	Confident	79.1	Confident	3 Å²	3	65.1 Å²	65.1	2%	0.02	34%	0.343	C	S	.	.	B	Isolated β-bridge	trans	-98.1	154.6	173.6	-55.6	0	0	0	0	111.6	C1278 T1283 C1299 R1306 C1308	C1278-C1297 WeakPolarHBondContact CA-SG 3.38Å; C1278-C1297 HydrophobicContact CB-CB 3.77Å; C1278-C1297 WeakPolarHBondContact CB-SG 3.38Å; C1278-C1297 WeakPolarHBondContact SG-CB 3.33Å; C1278-C1297 CovalentContact SG-SG 2.03Å; C1278-C1297 PolarHBondContact SG-SG 3.16Å; T1283-C1297 HydrophobicContact CG2-CB 3.87Å; C1297-C1299 PolarHBondContact O-N 3.32Å; C1297-C1299 PolarHBondContact O-SG 2.04Å; C1297-R1306 VanDerWaalsContact CB-O 3.3Å; C1297-R1306 WeakPolarHBondContact CB-O 3.44Å; C1297-R1306 PolarHBondContact N-O 3.1Å; C1297-R1306 PolarHBondContact SG-O 3.18Å; C1297-R1306 VanDerWaalsContact SG-O 3.33Å; C1297-C1308 PolarHBondContact O-SG 3.35Å; C1297-C1308 VanDerWaalsContact O-SG 3.41Å
1298	S	85.7	Confident	79.7	Confident	71 Å²	71	63.4 Å²	63.4	50%	0.497	33%	0.33	S	S	.	.			trans	-84.3	98.7	-176.1	-53.8	0	0	0	0	112.6	T1283 I1284	T1283-S1298 CarbonylContact C-O 3.09Å; T1283-S1298 WeakPolarHBondContact CA-O 3.34Å; I1284-S1298 PolarHBondContact N-O 3.44Å
1299	C	85.8	Confident	80	Confident	32 Å²	32	63.4 Å²	63.4	22%	0.216	33%	0.328	C	S	.	.	B	Isolated β-bridge	trans	-86	150.3	-168.8	-50.9	0	0	0	0	115.5	I1284 C1297 V1303 C1308	I1284-C1299 WeakPolarHBondContact CD1-O 3.46Å; C1297-C1299 PolarHBondContact O-N 3.32Å; C1297-C1299 PolarHBondContact O-SG 2.04Å; C1299-V1303 HydrophobicContact CB-CG1 4.3Å; C1299-C1308 WeakPolarHBondContact CA-SG 3.38Å; C1299-C1308 HydrophobicContact CB-CB 3.64Å; C1299-C1308 WeakPolarHBondContact CB-SG 3.49Å; C1299-C1308 PolarHBondContact N-SG 2.79Å; C1299-C1308 WeakPolarHBondContact SG-CA 3.33Å; C1299-C1308 WeakPolarHBondContact SG-CB 3.14Å; C1299-C1308 CovalentContact SG-SG 2.04Å; C1299-C1308 PolarHBondContact SG-SG 3.33Å
1300	M	82.3	Confident	80.3	Confident	76 Å²	76	64.3 Å²	64.3	37%	0.374	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-66.8	158.5	171.6	-66.4	-169.2	-160.7	0	0	112.8	V1281 G1282 T1283 N1302 V1303	V1281-M1300 VanDerWaalsContact O-CE 3.3Å; V1281-M1300 WeakPolarHBondContact O-CE 3.11Å; G1282-M1300 WeakPolarHBondContact O-CG 3.11Å; G1282-M1300 PolarHBondContact O-N 3.47Å; T1283-M1300 WeakPolarHBondContact O-CE 3.49Å; M1300-N1302 PolarHBondContact O-N 2.88Å; M1300-V1303 HydrophobicContact CB-CB 4.23Å; M1300-V1303 HydrophobicContact CB-CG2 4.15Å; M1300-V1303 WeakPolarHBondContact O-CB 3.44Å; M1300-V1303 PolarHBondContact O-N 2.83Å
1301	K	74.5	Confident	80.5	Confident	197 Å²	197	63.5 Å²	63.5	86%	0.857	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	132.9	172.7	-164.7	178.2	-179.2	-176.6	0	109.9	V1303	K1301-V1303 VanDerWaalsContact C-N 3.28Å
1302	N	83.7	Confident	80.6	Confident	49 Å²	49	64.4 Å²	64.4	26%	0.262	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.4	-5.1	-169.4	-52.1	7.8	0	0	0	116	M1300 L1312 F1315 C1321	M1300-N1302 PolarHBondContact O-N 2.88Å; N1302-L1312 PolarHBondContact O-N 3.3Å; N1302-F1315 HydrophobicContact CB-CD1 4.46Å; N1302-F1315 HydrophobicContact CB-CG 4.49Å; N1302-F1315 WeakPolarHBondContact ND2-CE1 3.42Å; N1302-C1321 HydrophobicContact CB-CB 3.71Å; N1302-C1321 PolarHBondContact ND2-O 2.96Å; N1302-C1321 VanDerWaalsContact ND2-O 3.13Å
1303	V	81.7	Confident	80.9	Confident	9 Å²	9	59.4 Å²	59.4	6%	0.055	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	147.6	175.8	174.6	0	0	0	0	110.3	C1299 M1300 K1301 C1308 K1310 Y1318	C1299-V1303 HydrophobicContact CB-CG1 4.3Å; M1300-V1303 HydrophobicContact CB-CB 4.23Å; M1300-V1303 HydrophobicContact CB-CG2 4.15Å; M1300-V1303 WeakPolarHBondContact O-CB 3.44Å; M1300-V1303 PolarHBondContact O-N 2.83Å; K1301-V1303 VanDerWaalsContact C-N 3.28Å; V1303-C1308 HydrophobicContact CG1-CB 3.88Å; V1303-C1308 WeakPolarHBondContact CG1-O 3.26Å; V1303-K1310 CarbonylContact C-O 3.51Å; V1303-K1310 WeakPolarHBondContact CA-O 3.38Å; V1303-K1310 WeakPolarHBondContact CG1-O 3.44Å; V1303-Y1318 HydrophobicContact CG1-CE2 3.9Å; V1303-Y1318 HydrophobicContact CG2-CD2 4.48Å; V1303-Y1318 HydrophobicContact CG2-CE2 4.33Å
1304	G	74.1	Confident	81.3	Confident	10 Å²	10	54.4 Å²	54.4	10%	0.103	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	-173.2	177.2	0	0	0	0	0	114.1	C1308 E1309 K1310	G1304-C1308 CarbonylContact O-C 3.53Å; G1304-E1309 PolarHBondContact O-N 2.87Å; G1304-K1310 PolarHBondContact N-O 2.9Å; G1304-K1310 WeakPolarHBondContact O-CG 3.43Å; G1304-K1310 PolarHBondContact O-N 3.02Å
1305	G	72.4	Confident	81.9	Confident	27 Å²	27	52.7 Å²	52.7	28%	0.278	27%	0.273	S	S	.	.	S	Bend	trans	97.8	169.4	-170.7	0	0	0	0	0	112.8	Q1296 R1307 C1308 E1309	Q1296-G1305 PolarHBondContact NE2-O 3.19Å; G1305-R1307 VanDerWaalsContact C-N 3.28Å; G1305-R1307 PolarHBondContact O-N 3.3Å; G1305-C1308 PolarHBondContact O-N 2.73Å; G1305-E1309 WeakPolarHBondContact CA-OE2 3.33Å
1306	R	79.6	Confident	82.2	Confident	64 Å²	64	56.3 Å²	56.3	24%	0.242	29%	0.287	C	S	.	.	S	Bend	trans	-65.6	-36.2	-177.5	-167.6	-179.7	70.3	57.3	-15	111.1	Y1265 C1276 G1295 Q1296 C1297 E1309	Y1265-R1306 PolarHBondContact OH-NE 3.28Å; Y1265-R1306 PolarHBondContact OH-NH2 3.14Å; C1276-R1306 PolarHBondContact O-NH1 2.68Å; G1295-R1306 WeakPolarHBondContact O-CD 3.36Å; G1295-R1306 WeakPolarHBondContact O-CG 3.41Å; G1295-R1306 PolarHBondContact O-NH1 2.94Å; Q1296-R1306 PolarHBondContact NE2-O 2.82Å; C1297-R1306 VanDerWaalsContact CB-O 3.3Å; C1297-R1306 WeakPolarHBondContact CB-O 3.44Å; C1297-R1306 PolarHBondContact N-O 3.1Å; C1297-R1306 PolarHBondContact SG-O 3.18Å; C1297-R1306 VanDerWaalsContact SG-O 3.33Å; R1306-E1309 PolarHBondContact N-OE2 2.76Å
1307	R	84.4	Confident	82.1	Confident	93 Å²	93	53.5 Å²	53.5	35%	0.351	28%	0.281	S	S	.	.	S	Bend	trans	-101.4	4.3	-176.3	-56.8	170.1	179.5	-163.5	-3.1	112.4	H1277 S1279 G1305 E1309	H1277-R1307 HydrophobicContact CB-CG 4.4Å; H1277-R1307 PolarHBondContact CD2-NH2 3.42Å; H1277-R1307 WeakPolarHBondContact O-CB 3.49Å; H1277-R1307 WeakPolarHBondContact O-CD 3.09Å; H1277-R1307 WeakPolarHBondContact O-CG 3.41Å; S1279-R1307 VanDerWaalsContact CB-O 3.26Å; S1279-R1307 WeakPolarHBondContact CB-O 3.42Å; S1279-R1307 PolarHBondContact N-O 2.79Å; G1305-R1307 VanDerWaalsContact C-N 3.28Å; G1305-R1307 PolarHBondContact O-N 3.3Å; R1307-E1309 VanDerWaalsContact C-N 3.35Å; R1307-E1309 WeakPolarHBondContact CA-OE2 3.34Å; R1307-E1309 HydrophobicContact CB-CB 4.35Å; R1307-E1309 HydrophobicContact CB-CG 4.5Å; R1307-E1309 WeakPolarHBondContact CB-OE1 3.46Å; R1307-E1309 PolarHBondContact N-OE1 2.96Å; R1307-E1309 PolarHBondContact N-OE2 2.8Å
1308	C	88.2	Confident	81.6	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.294	C	S	.	.	S	Bend	trans	60	44.2	-173.7	-46.9	0	0	0	0	112.4	G1282 T1283 C1297 C1299 V1303 G1304 G1305 Y1318	G1282-C1308 WeakPolarHBondContact CA-O 3.43Å; G1282-C1308 WeakPolarHBondContact O-CB 3.47Å; T1283-C1308 HydrophobicContact CG2-CB 4.11Å; C1297-C1308 PolarHBondContact O-SG 3.35Å; C1297-C1308 VanDerWaalsContact O-SG 3.41Å; C1299-C1308 WeakPolarHBondContact CA-SG 3.38Å; C1299-C1308 HydrophobicContact CB-CB 3.64Å; C1299-C1308 WeakPolarHBondContact CB-SG 3.49Å; C1299-C1308 PolarHBondContact N-SG 2.79Å; C1299-C1308 WeakPolarHBondContact SG-CA 3.33Å; C1299-C1308 WeakPolarHBondContact SG-CB 3.14Å; C1299-C1308 CovalentContact SG-SG 2.04Å; C1299-C1308 PolarHBondContact SG-SG 3.33Å; V1303-C1308 HydrophobicContact CG1-CB 3.88Å; V1303-C1308 WeakPolarHBondContact CG1-O 3.26Å; G1304-C1308 CarbonylContact O-C 3.53Å; G1305-C1308 PolarHBondContact O-N 2.73Å; C1308-Y1318 VanDerWaalsContact O-CE2 3.3Å; C1308-Y1318 WeakPolarHBondContact O-CE2 3.39Å; C1308-Y1318 PolarHBondContact O-OH 2.8Å
1309	E	82.9	Confident	81	Confident	83 Å²	83	55.7 Å²	55.7	39%	0.388	28%	0.284	S	S	.	.			trans	-101	-5.5	-167.7	66.3	-90.4	-115.3	0	0	115	G1304 G1305 R1306 R1307 Y1318	G1304-E1309 PolarHBondContact O-N 2.87Å; G1305-E1309 WeakPolarHBondContact CA-OE2 3.33Å; R1306-E1309 PolarHBondContact N-OE2 2.76Å; R1307-E1309 VanDerWaalsContact C-N 3.35Å; R1307-E1309 WeakPolarHBondContact CA-OE2 3.34Å; R1307-E1309 HydrophobicContact CB-CB 4.35Å; R1307-E1309 HydrophobicContact CB-CG 4.5Å; R1307-E1309 WeakPolarHBondContact CB-OE1 3.46Å; R1307-E1309 PolarHBondContact N-OE1 2.96Å; R1307-E1309 PolarHBondContact N-OE2 2.8Å; E1309-Y1318 VanDerWaalsContact C-CE2 3.47Å
1310	K	83.5	Confident	80.9	Confident	110 Å²	110	60.3 Å²	60.3	48%	0.478	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	169.1	-174	64.7	172	-177	174.1	0	113.2	V1303 G1304	V1303-K1310 CarbonylContact C-O 3.51Å; V1303-K1310 WeakPolarHBondContact CA-O 3.38Å; V1303-K1310 WeakPolarHBondContact CG1-O 3.44Å; G1304-K1310 PolarHBondContact N-O 2.9Å; G1304-K1310 WeakPolarHBondContact O-CG 3.43Å; G1304-K1310 PolarHBondContact O-N 3.02Å
1311	C	85.7	Confident	81.1	Confident	2 Å²	2	56.8 Å²	56.8	1%	0.014	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	165.3	174.1	-62.9	0	0	0	0	111.9	F1315 C1321 Q1338	C1311-F1315 HydrophobicContact CB-CB 4.12Å; C1311-F1315 WeakPolarHBondContact CB-O 3.36Å; C1311-C1321 WeakPolarHBondContact CA-SG 3.47Å; C1311-C1321 HydrophobicContact CB-CB 3.84Å; C1311-C1321 WeakPolarHBondContact CB-SG 2.99Å; C1311-C1321 VanDerWaalsContact SG-CA 3.5Å; C1311-C1321 WeakPolarHBondContact SG-CB 3.34Å; C1311-C1321 CovalentContact SG-SG 2.05Å; C1311-C1321 PolarHBondContact SG-SG 2.75Å; C1311-Q1338 HydrophobicContact CB-CG 4.47Å; C1311-Q1338 PolarHBondContact O-NE2 2.87Å; C1311-Q1338 PolarHBondContact O-OE1 2.83Å
1312	L	83.4	Confident	81.6	Confident	84 Å²	84	53.4 Å²	53.4	44%	0.44	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-77.4	162.3	164.5	-60.9	179.1	0	0	0	110.9	N1302 F1315	N1302-L1312 PolarHBondContact O-N 3.3Å; L1312-F1315 HydrophobicContact CB-CD2 4.13Å; L1312-F1315 PolarHBondContact O-N 2.81Å
1313	A	76.7	Confident	81.7	Confident	57 Å²	57	58.6 Å²	58.6	47%	0.471	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	144.1	177.3	0	0	0	0	0	111.6	F1315	A1313-F1315 VanDerWaalsContact C-N 3.28Å; A1313-F1315 WeakPolarHBondContact O-CD2 3.19Å
1314	G	80.4	Confident	81.7	Confident	9 Å²	9	59.2 Å²	59.2	9%	0.093	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.1	0.7	-170.8	0	0	0	0	0	115.8	C1324 E1334	G1314-C1324 PolarHBondContact O-N 2.83Å; G1314-C1324 VanDerWaalsContact O-N 3.1Å; G1314-E1334 PolarHBondContact N-O 3.01Å
1315	F	86.5	Confident	82.3	Confident	47 Å²	47	62.9 Å²	62.9	21%	0.206	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	145.1	178.6	-59.2	-87.7	0	0	0	113.6	N1302 C1311 L1312 A1313 C1321 Y1322 E1323	N1302-F1315 HydrophobicContact CB-CD1 4.46Å; N1302-F1315 HydrophobicContact CB-CG 4.49Å; N1302-F1315 WeakPolarHBondContact ND2-CE1 3.42Å; C1311-F1315 HydrophobicContact CB-CB 4.12Å; C1311-F1315 WeakPolarHBondContact CB-O 3.36Å; L1312-F1315 HydrophobicContact CB-CD2 4.13Å; L1312-F1315 PolarHBondContact O-N 2.81Å; A1313-F1315 VanDerWaalsContact C-N 3.28Å; A1313-F1315 WeakPolarHBondContact O-CD2 3.19Å; F1315-C1321 HydrophobicContact CB-CB 4.02Å; F1315-C1321 VanDerWaalsContact CD1-O 3.23Å; F1315-C1321 WeakPolarHBondContact CD1-O 3.49Å; F1315-Y1322 CarbonylContact C-O 3.5Å; F1315-Y1322 WeakPolarHBondContact CA-O 2.99Å; F1315-E1323 HydrophobicContact CD1-CB 4.23Å; F1315-E1323 HydrophobicContact CE1-CB 4.07Å; F1315-E1323 HydrophobicContact CE1-CG 4.47Å
1316	Y	84.8	Confident	82.9	Confident	76 Å²	76	62.6 Å²	62.6	30%	0.298	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	158.9	-178.2	80.1	-82.3	0	0	0	113.6	C1321 Y1322 Q1338 A1341	Y1316-C1321 CarbonylContact O-C 3.47Å; Y1316-C1321 VanDerWaalsContact O-CA 3.23Å; Y1316-C1321 WeakPolarHBondContact O-CA 3.18Å; Y1316-Y1322 WeakPolarHBondContact CD1-O 3.39Å; Y1316-Y1322 PolarHBondContact N-O 3Å; Y1316-Y1322 PolarHBondContact O-N 2.97Å; Y1316-Q1338 CarbonylContact C-O 3.54Å; Y1316-Q1338 WeakPolarHBondContact CA-O 3.43Å; Y1316-Q1338 WeakPolarHBondContact CB-O 3.28Å; Y1316-A1341 HydrophobicContact CD1-CB 3.6Å; Y1316-A1341 HydrophobicContact CD2-CB 3.75Å; Y1316-A1341 HydrophobicContact CE1-CB 3.67Å; Y1316-A1341 HydrophobicContact CE2-CB 3.83Å; Y1316-A1341 HydrophobicContact CG-CB 3.63Å
1317	G	80.2	Confident	83.2	Confident	25 Å²	25	62.4 Å²	62.4	26%	0.258	32%	0.321	S	S	.	.	S	Bend	trans	80.6	62.7	174	0	0	0	0	0	113.5	H1320 C1321 Q1338	G1317-H1320 PolarHBondContact O-N 2.94Å; G1317-C1321 PolarHBondContact O-N 2.06Å; G1317-Q1338 PolarHBondContact N-O 3.32Å
1318	Y	77.8	Confident	83.1	Confident	76 Å²	76	61.9 Å²	61.9	30%	0.298	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	138.5	169.4	-176.8	-90.2	0	0	0	111	S1279 G1282 V1303 C1308 E1309	S1279-Y1318 WeakPolarHBondContact CB-OH 3.05Å; S1279-Y1318 PolarHBondContact OG-OH 2.75Å; G1282-Y1318 PolarHBondContact N-OH 3.07Å; V1303-Y1318 HydrophobicContact CG1-CE2 3.9Å; V1303-Y1318 HydrophobicContact CG2-CD2 4.48Å; V1303-Y1318 HydrophobicContact CG2-CE2 4.33Å; C1308-Y1318 VanDerWaalsContact O-CE2 3.3Å; C1308-Y1318 WeakPolarHBondContact O-CE2 3.39Å; C1308-Y1318 PolarHBondContact O-OH 2.8Å; E1309-Y1318 VanDerWaalsContact C-CE2 3.47Å
1319	P	72.8	Confident	82.8	Confident	43 Å²	43	63.6 Å²	63.6	28%	0.279	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	cis	-87	-0.5	6.6	36.8	-38.8	0	0	0	115	V1281	V1281-P1319 HydrophobicContact CB-CB 4.43Å; V1281-P1319 HydrophobicContact CG1-CB 3.81Å; V1281-P1319 HydrophobicContact CG1-CG 3.77Å
1320	H	82.7	Confident	82.6	Confident	130 Å²	130	59.7 Å²	59.7	60%	0.602	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-28.5	-171.3	-66.7	-48.1	0	0	0	114.6	G1317 Y1322	G1317-H1320 PolarHBondContact O-N 2.94Å; H1320-Y1322 HydrophobicContact CB-CD2 4.27Å; H1320-Y1322 HydrophobicContact CB-CE1 4.23Å; H1320-Y1322 HydrophobicContact CB-CE2 3.6Å
1321	C	86.5	Confident	82.5	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.007	30%	0.299	C	S	.	.			trans	50.7	70.9	172	-59.2	0	0	0	0	113.7	N1302 C1311 F1315 Y1316 G1317	N1302-C1321 HydrophobicContact CB-CB 3.71Å; N1302-C1321 PolarHBondContact ND2-O 2.96Å; N1302-C1321 VanDerWaalsContact ND2-O 3.13Å; C1311-C1321 WeakPolarHBondContact CA-SG 3.47Å; C1311-C1321 HydrophobicContact CB-CB 3.84Å; C1311-C1321 WeakPolarHBondContact CB-SG 2.99Å; C1311-C1321 VanDerWaalsContact SG-CA 3.5Å; C1311-C1321 WeakPolarHBondContact SG-CB 3.34Å; C1311-C1321 CovalentContact SG-SG 2.05Å; C1311-C1321 PolarHBondContact SG-SG 2.75Å; F1315-C1321 HydrophobicContact CB-CB 4.02Å; F1315-C1321 VanDerWaalsContact CD1-O 3.23Å; F1315-C1321 WeakPolarHBondContact CD1-O 3.49Å; Y1316-C1321 CarbonylContact O-C 3.47Å; Y1316-C1321 VanDerWaalsContact O-CA 3.23Å; Y1316-C1321 WeakPolarHBondContact O-CA 3.18Å; G1317-C1321 PolarHBondContact O-N 2.06Å
1322	Y	85.1	Confident	82.1	Confident	127 Å²	127	57.5 Å²	57.5	50%	0.498	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	152.2	175.9	-55.5	-75.1	0	0	0	112.2	F1315 Y1316 H1320	F1315-Y1322 CarbonylContact C-O 3.5Å; F1315-Y1322 WeakPolarHBondContact CA-O 2.99Å; Y1316-Y1322 WeakPolarHBondContact CD1-O 3.39Å; Y1316-Y1322 PolarHBondContact N-O 3Å; Y1316-Y1322 PolarHBondContact O-N 2.97Å; H1320-Y1322 HydrophobicContact CB-CD2 4.27Å; H1320-Y1322 HydrophobicContact CB-CE1 4.23Å; H1320-Y1322 HydrophobicContact CB-CE2 3.6Å
1323	E	85.3	Confident	81.6	Confident	157 Å²	157	58.1 Å²	58.1	73%	0.734	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.2	145.9	-177	-170.8	171.5	-165.8	0	0	113.1	F1315	F1315-E1323 HydrophobicContact CD1-CB 4.23Å; F1315-E1323 HydrophobicContact CE1-CB 4.07Å; F1315-E1323 HydrophobicContact CE1-CG 4.47Å
1324	C	83.4	Confident	81.4	Confident	22 Å²	22	61.7 Å²	61.7	15%	0.149	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-92.6	154.5	-177.7	-68.6	0	0	0	0	114.4	G1314 C1336	G1314-C1324 PolarHBondContact O-N 2.83Å; G1314-C1324 VanDerWaalsContact O-N 3.1Å; C1324-C1336 HydrophobicContact CB-CB 3.55Å; C1324-C1336 WeakPolarHBondContact CB-SG 3.3Å; C1324-C1336 WeakPolarHBondContact SG-CB 3.4Å; C1324-C1336 CovalentContact SG-SG 2.02Å; C1324-C1336 PolarHBondContact SG-SG 2.93Å
1325	A	86.4	Confident	81.4	Confident	88 Å²	88	63.5 Å²	63.5	73%	0.727	34%	0.344	S	S	*	.			trans	-112.2	74.3	-174.3	0	0	0	0	0	112.6
1326	C	84.9	Confident	81.4	Confident	21 Å²	21	61.4 Å²	61.4	14%	0.142	34%	0.336	C	S	.	.			trans	-126.2	147.1	-170.4	-54.2	0	0	0	0	112.4	L1328 S1331 I1335 C1343	C1326-L1328 PolarHBondContact O-N 3.41Å; C1326-S1331 WeakPolarHBondContact CB-OG 3.38Å; C1326-I1335 HydrophobicContact CB-CG2 4.12Å; C1326-C1343 WeakPolarHBondContact CA-SG 3.43Å; C1326-C1343 HydrophobicContact CB-CB 3.67Å; C1326-C1343 WeakPolarHBondContact CB-SG 3.2Å; C1326-C1343 WeakPolarHBondContact SG-CA 3.47Å; C1326-C1343 WeakPolarHBondContact SG-CB 3.38Å; C1326-C1343 CovalentContact SG-SG 2.03Å; C1326-C1343 PolarHBondContact SG-SG 2.83Å
1327	D	85.8	Confident	81.1	Confident	59 Å²	59	62.2 Å²	62.2	32%	0.316	34%	0.342	S	S	.	.			trans	-75.6	114	174.6	-165	-50.1	0	0	0	110.3	S1329 G1330 S1331 T1371 A1373	D1327-S1329 PolarHBondContact O-N 3Å; D1327-S1329 VanDerWaalsContact O-N 3.12Å; D1327-S1329 WeakPolarHBondContact OD1-CA 3.46Å; D1327-S1329 WeakPolarHBondContact OD1-CB 3.38Å; D1327-S1329 PolarHBondContact OD1-N 3.45Å; D1327-S1329 PolarHBondContact OD1-OG 3.22Å; D1327-G1330 PolarHBondContact O-N 2.99Å; D1327-S1331 VanDerWaalsContact O-CB 3.3Å; D1327-S1331 WeakPolarHBondContact O-CB 3.43Å; D1327-S1331 PolarHBondContact O-N 3.02Å; D1327-S1331 PolarHBondContact O-OG 3.1Å; D1327-T1371 VanDerWaalsContact CB-O 3.25Å; D1327-T1371 WeakPolarHBondContact CB-O 3.39Å; D1327-T1371 PolarHBondContact N-O 2.7Å; D1327-A1373 HydrophobicContact CB-CB 4.1Å
1328	L	82.1	Confident	80.9	Confident	83 Å²	83	63.9 Å²	63.9	44%	0.435	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-1.3	-176.6	-56	178.1	0	0	0	113.8	C1326 I1335 R1384	C1326-L1328 PolarHBondContact O-N 3.41Å; L1328-I1335 HydrophobicContact CD2-CD1 4.35Å; L1328-I1335 HydrophobicContact CD2-CG2 4.24Å; L1328-R1384 WeakPolarHBondContact O-CG 3.09Å; L1328-R1384 PolarHBondContact O-NE 3.02Å
1329	S	82.4	Confident	80.6	Confident	36 Å²	36	67.5 Å²	67.5	25%	0.252	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-44.1	172	-39.7	0	0	0	0	110.7	D1327 K1346	D1327-S1329 PolarHBondContact O-N 3Å; D1327-S1329 VanDerWaalsContact O-N 3.12Å; D1327-S1329 WeakPolarHBondContact OD1-CA 3.46Å; D1327-S1329 WeakPolarHBondContact OD1-CB 3.38Å; D1327-S1329 PolarHBondContact OD1-N 3.45Å; D1327-S1329 PolarHBondContact OD1-OG 3.22Å; S1329-K1346 VanDerWaalsContact O-CE 3.24Å; S1329-K1346 WeakPolarHBondContact O-CE 3.37Å; S1329-K1346 PolarHBondContact O-NZ 3.3Å
1330	G	79.1	Confident	80.8	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	-6.7	-179.4	0	0	0	0	0	115.5	D1327 C1345 K1346 C1372	D1327-G1330 PolarHBondContact O-N 2.99Å; G1330-C1345 CarbonylContact O-C 3.59Å; G1330-C1345 WeakPolarHBondContact O-CA 3.45Å; G1330-K1346 WeakPolarHBondContact O-CG 3.44Å; G1330-K1346 PolarHBondContact O-N 3.09Å; G1330-C1372 WeakPolarHBondContact CA-O 3.25Å
1331	S	81.3	Confident	80.8	Confident	8 Å²	8	63.3 Å²	63.3	6%	0.056	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	153.9	177.5	-56.6	0	0	0	0	113.2	C1326 D1327 L1344	C1326-S1331 WeakPolarHBondContact CB-OG 3.38Å; D1327-S1331 VanDerWaalsContact O-CB 3.3Å; D1327-S1331 WeakPolarHBondContact O-CB 3.43Å; D1327-S1331 PolarHBondContact O-N 3.02Å; D1327-S1331 PolarHBondContact O-OG 3.1Å; S1331-L1344 CarbonylContact C-O 3.55Å; S1331-L1344 WeakPolarHBondContact CA-O 3.02Å
1332	N	76.8	Confident	80.5	Confident	59 Å²	59	66.8 Å²	66.8	32%	0.316	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	-177.1	175.9	82	24.7	0	0	0	112.9	E1334 I1335 L1344	N1332-E1334 VanDerWaalsContact C-N 3.33Å; N1332-E1334 PolarHBondContact O-N 3.4Å; N1332-E1334 PolarHBondContact OD1-N 2.95Å; N1332-I1335 PolarHBondContact O-N 2.87Å; N1332-I1335 VanDerWaalsContact O-N 3.11Å; N1332-I1335 PolarHBondContact OD1-N 2.89Å; N1332-L1344 PolarHBondContact N-O 3.39Å; N1332-L1344 WeakPolarHBondContact ND2-CB 3.15Å
1333	A	72.1	Confident	80.5	Confident	97 Å²	97	61.4 Å²	61.4	80%	0.802	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.5	-20.2	-173.9	0	0	0	0	0	115.8
1334	E	72.4	Confident	80.3	Confident	132 Å²	132	55.8 Å²	55.8	62%	0.617	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.4	-15.8	173	-63.2	-165.3	147	0	0	112.2	G1314 N1332 C1336 L1344	G1314-E1334 PolarHBondContact N-O 3.01Å; N1332-E1334 VanDerWaalsContact C-N 3.33Å; N1332-E1334 PolarHBondContact O-N 3.4Å; N1332-E1334 PolarHBondContact OD1-N 2.95Å; E1334-C1336 PolarHBondContact O-N 3.25Å; E1334-L1344 HydrophobicContact CB-CD1 3.79Å
1335	I	81.7	Confident	80.3	Confident	46 Å²	46	55.4 Å²	55.4	24%	0.236	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	66.8	-50.4	177.3	-54.9	171.8	0	0	0	113.8	C1326 L1328 N1332 L1344	C1326-I1335 HydrophobicContact CB-CG2 4.12Å; L1328-I1335 HydrophobicContact CD2-CD1 4.35Å; L1328-I1335 HydrophobicContact CD2-CG2 4.24Å; N1332-I1335 PolarHBondContact O-N 2.87Å; N1332-I1335 VanDerWaalsContact O-N 3.11Å; N1332-I1335 PolarHBondContact OD1-N 2.89Å; I1335-L1344 PolarHBondContact O-N 3.24Å
1336	C	85.5	Confident	79.8	Confident	4 Å²	4	52.5 Å²	52.5	3%	0.027	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	157.6	-177.7	61.8	0	0	0	0	113.1	C1324 E1334 Q1338 T1342	C1324-C1336 HydrophobicContact CB-CB 3.55Å; C1324-C1336 WeakPolarHBondContact CB-SG 3.3Å; C1324-C1336 WeakPolarHBondContact SG-CB 3.4Å; C1324-C1336 CovalentContact SG-SG 2.02Å; C1324-C1336 PolarHBondContact SG-SG 2.93Å; E1334-C1336 PolarHBondContact O-N 3.25Å; C1336-Q1338 PolarHBondContact O-N 3.12Å; C1336-T1342 CarbonylContact C-O 3.46Å; C1336-T1342 WeakPolarHBondContact CA-O 3Å; C1336-T1342 WeakPolarHBondContact CB-O 3.43Å
1337	E	79.4	Confident	78.7	Confident	93 Å²	93	53.3 Å²	53.3	44%	0.435	31%	0.305	S	S	.	.			trans	-68.2	127.4	171.4	-69	-167.4	157.9	0	0	112.2	N1339 S1340 A1341 T1342 L1344	E1337-N1339 PolarHBondContact O-N 2.85Å; E1337-S1340 WeakPolarHBondContact CB-OG 3.02Å; E1337-S1340 PolarHBondContact O-N 3.22Å; E1337-S1340 WeakPolarHBondContact OE2-CB 3.46Å; E1337-S1340 PolarHBondContact OE2-OG 3.28Å; E1337-A1341 PolarHBondContact O-N 3.1Å; E1337-A1341 VanDerWaalsContact O-N 3.14Å; E1337-T1342 PolarHBondContact N-O 3.06Å; E1337-L1344 HydrophobicContact CG-CD2 3.89Å; E1337-L1344 HydrophobicContact CG-CG 4.39Å
1338	Q	75.5	Confident	76.9	Confident	60 Å²	60	54.8 Å²	54.8	28%	0.28	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-13.1	-179.1	-54.6	-162.3	-2.9	0	0	115	C1311 Y1316 G1317 C1336	C1311-Q1338 HydrophobicContact CB-CG 4.47Å; C1311-Q1338 PolarHBondContact O-NE2 2.87Å; C1311-Q1338 PolarHBondContact O-OE1 2.83Å; Y1316-Q1338 CarbonylContact C-O 3.54Å; Y1316-Q1338 WeakPolarHBondContact CA-O 3.43Å; Y1316-Q1338 WeakPolarHBondContact CB-O 3.28Å; G1317-Q1338 PolarHBondContact N-O 3.32Å; C1336-Q1338 PolarHBondContact O-N 3.12Å
1339	N	71.1	Confident	75	Confident	152 Å²	152	57.3 Å²	57.3	81%	0.813	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.4	-32.4	-178.6	-69	-19.8	0	0	0	113.7	E1337	E1337-N1339 PolarHBondContact O-N 2.85Å
1340	S	78.1	Confident	72.7	Confident	56 Å²	56	58.6 Å²	58.6	39%	0.392	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.2	-10.9	-167.6	74.8	0	0	0	0	114.7	E1337 T1342	E1337-S1340 WeakPolarHBondContact CB-OG 3.02Å; E1337-S1340 PolarHBondContact O-N 3.22Å; E1337-S1340 WeakPolarHBondContact OE2-CB 3.46Å; E1337-S1340 PolarHBondContact OE2-OG 3.28Å; S1340-T1342 PolarHBondContact O-N 3.41Å; S1340-T1342 VanDerWaalsContact OG-CB 3.24Å; S1340-T1342 WeakPolarHBondContact OG-CB 3.15Å; S1340-T1342 PolarHBondContact OG-N 2.93Å; S1340-T1342 VanDerWaalsContact OG-N 3.11Å; S1340-T1342 PolarHBondContact OG-OG1 2.98Å
1341	A	80.7	Confident	70.4	Confident	29 Å²	29	65 Å²	65	24%	0.24	36%	0.359	C	S	.	.			trans	60.5	10.1	-167.1	0	0	0	0	0	114.9	Y1316 E1337 C1343	Y1316-A1341 HydrophobicContact CD1-CB 3.6Å; Y1316-A1341 HydrophobicContact CD2-CB 3.75Å; Y1316-A1341 HydrophobicContact CE1-CB 3.67Å; Y1316-A1341 HydrophobicContact CE2-CB 3.83Å; Y1316-A1341 HydrophobicContact CG-CB 3.63Å; E1337-A1341 PolarHBondContact O-N 3.1Å; E1337-A1341 VanDerWaalsContact O-N 3.14Å; A1341-C1343 PolarHBondContact O-N 2.7Å
1342	T	81.1	Confident	67.9	Low	73 Å²	73	71 Å²	71	45%	0.448	39%	0.39	S	S	.	.			trans	-67.5	130.9	177.6	-54	0	0	0	0	109.8	C1336 E1337 S1340	C1336-T1342 CarbonylContact C-O 3.46Å; C1336-T1342 WeakPolarHBondContact CA-O 3Å; C1336-T1342 WeakPolarHBondContact CB-O 3.43Å; E1337-T1342 PolarHBondContact N-O 3.06Å; S1340-T1342 PolarHBondContact O-N 3.41Å; S1340-T1342 VanDerWaalsContact OG-CB 3.24Å; S1340-T1342 WeakPolarHBondContact OG-CB 3.15Å; S1340-T1342 PolarHBondContact OG-N 2.93Å; S1340-T1342 VanDerWaalsContact OG-N 3.11Å; S1340-T1342 PolarHBondContact OG-OG1 2.98Å
1343	C	84.8	Confident	65.5	Low	14 Å²	14	75 Å²	75	10%	0.095	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	135.4	179	-59.4	0	0	0	0	111.3	C1326 A1341	C1326-C1343 WeakPolarHBondContact CA-SG 3.43Å; C1326-C1343 HydrophobicContact CB-CB 3.67Å; C1326-C1343 WeakPolarHBondContact CB-SG 3.2Å; C1326-C1343 WeakPolarHBondContact SG-CA 3.47Å; C1326-C1343 WeakPolarHBondContact SG-CB 3.38Å; C1326-C1343 CovalentContact SG-SG 2.03Å; C1326-C1343 PolarHBondContact SG-SG 2.83Å; A1341-C1343 PolarHBondContact O-N 2.7Å
1344	L	82.3	Confident	63.5	Low	40 Å²	40	76.3 Å²	76.3	21%	0.209	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	104.7	-178.6	-66.2	170.6	0	0	0	109	S1331 N1332 E1334 I1335 E1337	S1331-L1344 CarbonylContact C-O 3.55Å; S1331-L1344 WeakPolarHBondContact CA-O 3.02Å; N1332-L1344 PolarHBondContact N-O 3.39Å; N1332-L1344 WeakPolarHBondContact ND2-CB 3.15Å; E1334-L1344 HydrophobicContact CB-CD1 3.79Å; I1335-L1344 PolarHBondContact O-N 3.24Å; E1337-L1344 HydrophobicContact CG-CD2 3.89Å; E1337-L1344 HydrophobicContact CG-CG 4.39Å
1345	C	83.3	Confident	61.3	Low	14 Å²	14	76.9 Å²	76.9	10%	0.095	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	164.4	-173.7	-52	0	0	0	0	113.1	G1330 V1367 C1372	G1330-C1345 CarbonylContact O-C 3.59Å; G1330-C1345 WeakPolarHBondContact O-CA 3.45Å; C1345-V1367 HydrophobicContact CB-CB 4.47Å; C1345-C1372 WeakPolarHBondContact CA-SG 3.37Å; C1345-C1372 HydrophobicContact CB-CB 3.84Å; C1345-C1372 WeakPolarHBondContact CB-SG 3.38Å; C1345-C1372 PolarHBondContact N-SG 3.1Å; C1345-C1372 VanDerWaalsContact N-SG 3.43Å; C1345-C1372 VanDerWaalsContact SG-CA 3.51Å; C1345-C1372 WeakPolarHBondContact SG-CB 3.4Å; C1345-C1372 CovalentContact SG-SG 2.04Å; C1345-C1372 PolarHBondContact SG-SG 3.07Å
1346	K	75.1	Confident	58.7	Low	26 Å²	26	83.1 Å²	83.1	11%	0.113	42%	0.424	C	S	.	.			trans	-71.5	137.3	172.6	-72.8	174.5	175	176.5	0	110.1	S1329 G1330 A1383 R1384 N1386	S1329-K1346 VanDerWaalsContact O-CE 3.24Å; S1329-K1346 WeakPolarHBondContact O-CE 3.37Å; S1329-K1346 PolarHBondContact O-NZ 3.3Å; G1330-K1346 WeakPolarHBondContact O-CG 3.44Å; G1330-K1346 PolarHBondContact O-N 3.09Å; K1346-A1383 PolarHBondContact NZ-O 2.79Å; K1346-R1384 PolarHBondContact NZ-O 3.31Å; K1346-N1386 WeakPolarHBondContact CD-O 3.4Å; K1346-N1386 PolarHBondContact NZ-O 3.09Å
1347	V	62.9	Low	55.9	Low	38 Å²	38	92.8 Å²	92.8	23%	0.23	46%	0.46	C	S	.	.			trans	-137.5	143.4	-177.8	-160.1	0	0	0	0	108.8	Q1349 L1363 Q1364 E1365	V1347-Q1349 PolarHBondContact O-N 3.3Å; V1347-L1363 HydrophobicContact CG1-CB 4.06Å; V1347-L1363 HydrophobicContact CG1-CD2 3.9Å; V1347-L1363 HydrophobicContact CG1-CG 3.75Å; V1347-Q1364 WeakPolarHBondContact CG1-O 2.99Å; V1347-E1365 HydrophobicContact CG1-CG 4.18Å; V1347-E1365 HydrophobicContact CG2-CG 4.13Å
1348	F	47.9	Very low	53.4	Low	90 Å²	90	91.6 Å²	91.6	40%	0.395	47%	0.466	S	S	.	.			trans	-67.2	121.2	-175.6	178.6	-144.1	0	0	0	112.4	P1350 K1388	F1348-P1350 HydrophobicContact CZ-CB 4.25Å; F1348-P1350 HydrophobicContact CZ-CG 4.46Å; F1348-K1388 HydrophobicContact CB-CD 4.08Å; F1348-K1388 HydrophobicContact CB-CG 4.29Å; F1348-K1388 HydrophobicContact CD2-CD 3.76Å; F1348-K1388 HydrophobicContact CD2-CG 3.9Å; F1348-K1388 HydrophobicContact CE2-CD 4.37Å; F1348-K1388 VanDerWaalsContact CE2-CE 3.47Å; F1348-K1388 HydrophobicContact CG-CD 3.9Å; F1348-K1388 HydrophobicContact CG-CG 4.32Å
1349	Q	42.3	Very low	51.1	Low	136 Å²	136	95.2 Å²	95.2	64%	0.636	49%	0.492	S	S	*	.			trans	-117.2	107.5	168.4	-70	-168.9	-0.3	0	0	110.9	V1347	V1347-Q1349 PolarHBondContact O-N 3.3Å
1350	P	34.3	Very low	49.1	Very low	63 Å²	63	93.7 Å²	93.7	41%	0.409	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-70.8	133.2	157.5	29.5	-32	0	0	0	109.8	F1348	F1348-P1350 HydrophobicContact CZ-CB 4.25Å; F1348-P1350 HydrophobicContact CZ-CG 4.46Å
1351	L	29.5	Very low	46.8	Very low	134 Å²	134	96.9 Å²	96.9	70%	0.702	51%	0.506	S	S	*	.	S	Bend	trans	-65.9	147.7	159.5	-70.3	145.8	0	0	0	108	K1353	L1351-K1353 HydrophobicContact CD2-CD 4Å; L1351-K1353 HydrophobicContact CD2-CG 4.07Å
1352	L	29.9	Very low	44.7	Very low	134 Å²	134	105.1 Å²	105.1	70%	0.702	53%	0.533	S	S	*	.	P	Polyproline II helix	cis	-87.7	142.2	17	-82.3	64.9	0	0	0	115.4	V931	V931-L1352 HydrophobicContact CG2-CD2 4.18Å
1353	K	26.2	Very low	42.7	Very low	145 Å²	145	107.2 Å²	107.2	63%	0.63	54%	0.541	S	S	*	.			trans	-89.4	100.2	168.4	-68.9	167.8	-179	173.3	0	109.7	L1351	L1351-K1353 HydrophobicContact CD2-CD 4Å; L1351-K1353 HydrophobicContact CD2-CG 4.07Å
1354	I	28.8	Very low	40.8	Very low	124 Å²	124	113.8 Å²	113.8	64%	0.636	57%	0.57	S	S	*	*	S	Bend	trans	-161.9	-38	157.4	-99.1	146	0	0	0	110.8	R1356	I1354-R1356 PolarHBondContact O-N 3.1Å
1355	L	27.6	Very low	39.7	Very low	144 Å²	144	116.6 Å²	116.6	75%	0.754	58%	0.582	S	S	*	*			trans	-99.3	66	-175.8	-67.3	175.7	0	0	0	114.6
1356	R	26.2	Very low	39.1	Very low	176 Å²	176	116.2 Å²	116.2	66%	0.664	58%	0.579	S	S	*	*			trans	-143.9	96.2	166.2	-75.6	-161.2	-178.6	-159.5	0.3	114.2	I1354	I1354-R1356 PolarHBondContact O-N 3.1Å
1357	R	27	Very low	39.3	Very low	208 Å²	208	115 Å²	115	79%	0.785	57%	0.574	S	S	*	*	S	Bend	trans	-156.9	47	158	-128.5	-178.8	-167.7	-178.4	4.6	114.2
1358	A	26.1	Very low	39.9	Very low	68 Å²	68	116.1 Å²	116.1	56%	0.562	58%	0.578	S	S	*	*	S	Bend	trans	-148.6	0.9	178.7	0	0	0	0	0	117.3	I233	I233-A1358 HydrophobicContact CD1-CB 4.27Å; I233-A1358 WeakPolarHBondContact CD1-O 3.28Å
1359	T	28.2	Very low	41	Very low	136 Å²	136	114 Å²	114	83%	0.834	58%	0.582	S	S	*	*			trans	-136.9	131.5	172.3	46.4	0	0	0	0	110.7
1360	S	28.7	Very low	42.5	Very low	120 Å²	120	112.4 Å²	112.4	84%	0.839	59%	0.585	S	S	*	*			trans	-136.6	37.2	-169.1	-171.2	0	0	0	0	113.2
1361	D	31.2	Very low	44.8	Very low	123 Å²	123	112.5 Å²	112.5	66%	0.658	59%	0.585	S	S	*	*	S	Bend	trans	-135.8	8.4	177.6	-90	-45.4	0	0	0	113.5	Q280	Q280-D1361 PolarHBondContact NE2-OD1 2.85Å; Q280-D1361 PolarHBondContact NE2-OD2 3.1Å
1362	Y	35	Very low	47.5	Very low	202 Å²	202	106.1 Å²	106.1	79%	0.792	55%	0.551	S	S	*	*			trans	-137.9	69.2	175.8	-96.9	-90.7	0	0	0	112.1
1363	L	39.3	Very low	50.1	Low	117 Å²	117	101.6 Å²	101.6	61%	0.613	53%	0.533	S	S	*	.			trans	-112.3	103.8	158.5	-114.1	66.8	0	0	0	106.9	V1347 E1365	V1347-L1363 HydrophobicContact CG1-CB 4.06Å; V1347-L1363 HydrophobicContact CG1-CD2 3.9Å; V1347-L1363 HydrophobicContact CG1-CG 3.75Å; L1363-E1365 PolarHBondContact O-N 3.43Å
1364	Q	45.4	Very low	52.9	Low	151 Å²	151	98.5 Å²	98.5	71%	0.706	53%	0.527	S	S	*	.			trans	-79.5	114.9	169.9	-84.3	175	-53.1	0	0	109	V1347	V1347-Q1364 WeakPolarHBondContact CG1-O 2.99Å
1365	E	59.1	Low	55.5	Low	99 Å²	99	94 Å²	94	46%	0.463	51%	0.506	S	S	.	.			trans	-81.7	112.9	170.7	-56.4	-172.1	142.8	0	0	108.6	V1347 L1363 V1367 A1376	V1347-E1365 HydrophobicContact CG1-CG 4.18Å; V1347-E1365 HydrophobicContact CG2-CG 4.13Å; L1363-E1365 PolarHBondContact O-N 3.43Å; E1365-V1367 PolarHBondContact O-N 3.42Å; E1365-A1376 WeakPolarHBondContact O-CB 3.1Å
1366	N	71.3	Confident	57.8	Low	7 Å²	7	87.9 Å²	87.9	4%	0.037	48%	0.476	C	S	.	.	S	Bend	trans	-73.9	-13.9	175	-67.6	23.1	0	0	0	111.6	C1375 A1376 T1379 K1388 C1390 E1392	N1366-C1375 WeakPolarHBondContact O-CA 3.02Å; N1366-A1376 PolarHBondContact O-N 2.03Å; N1366-T1379 HydrophobicContact CB-CG2 3.95Å; N1366-T1379 PolarHBondContact O-OG1 2.9Å; N1366-T1379 VanDerWaalsContact O-OG1 3.13Å; N1366-K1388 HydrophobicContact CB-CB 4.43Å; N1366-K1388 WeakPolarHBondContact ND2-CD 3.41Å; N1366-C1390 HydrophobicContact CB-CB 4.12Å; N1366-C1390 WeakPolarHBondContact CB-O 3.39Å; N1366-C1390 PolarHBondContact ND2-O 2.04Å; N1366-C1390 WeakPolarHBondContact O-CB 3.24Å; N1366-E1392 PolarHBondContact ND2-OE1 2.8Å
1367	V	78.5	Confident	60.3	Low	0 Å²	0	85 Å²	85	0%	0	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	127.8	174.8	-176.5	0	0	0	0	109.4	C1345 E1365 C1372 T1374 L1382	C1345-V1367 HydrophobicContact CB-CB 4.47Å; E1365-V1367 PolarHBondContact O-N 3.42Å; V1367-C1372 HydrophobicContact CG1-CB 4Å; V1367-C1372 WeakPolarHBondContact CG1-O 3.35Å; V1367-T1374 CarbonylContact C-O 3.59Å; V1367-T1374 WeakPolarHBondContact CA-O 2.99Å; V1367-T1374 WeakPolarHBondContact CG1-O 3.44Å; V1367-L1382 HydrophobicContact CG1-CD1 4.12Å; V1367-L1382 HydrophobicContact CG2-CD1 3.8Å
1368	I	74.6	Confident	62.6	Low	62 Å²	62	76.1 Å²	76.1	32%	0.318	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	166.6	-178	59.9	166.5	0	0	0	112.7	T1374 A1376	I1368-T1374 HydrophobicContact CD1-CG2 4.43Å; I1368-T1374 HydrophobicContact CG1-CG2 4.2Å; I1368-T1374 PolarHBondContact N-O 3.14Å; I1368-A1376 HydrophobicContact CG2-CB 3.93Å
1369	G	71.5	Confident	65.3	Low	46 Å²	46	73.7 Å²	73.7	47%	0.474	43%	0.431	S	S	.	.	S	Bend	trans	92.4	149	175.2	0	0	0	0	0	113	T1371 C1372	G1369-T1371 PolarHBondContact O-N 3.07Å; G1369-C1372 PolarHBondContact O-N 3.23Å
1370	S	73.7	Confident	67.9	Low	102 Å²	102	67.8 Å²	67.8	71%	0.713	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	0.8	-167.5	59.9	0	0	0	0	116.4
1371	T	84.1	Confident	70.4	Confident	65 Å²	65	63 Å²	63	40%	0.399	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.1	5.9	174.9	58.3	0	0	0	0	112.7	D1327 G1369 A1373	D1327-T1371 VanDerWaalsContact CB-O 3.25Å; D1327-T1371 WeakPolarHBondContact CB-O 3.39Å; D1327-T1371 PolarHBondContact N-O 2.7Å; G1369-T1371 PolarHBondContact O-N 3.07Å; T1371-A1373 PolarHBondContact O-N 2.98Å
1372	C	85.8	Confident	72.8	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	34%	0.342	C	S	.	.	S	Bend	trans	57	40.9	-177.1	-46.5	0	0	0	0	114.6	G1330 C1345 V1367 G1369	G1330-C1372 WeakPolarHBondContact CA-O 3.25Å; C1345-C1372 WeakPolarHBondContact CA-SG 3.37Å; C1345-C1372 HydrophobicContact CB-CB 3.84Å; C1345-C1372 WeakPolarHBondContact CB-SG 3.38Å; C1345-C1372 PolarHBondContact N-SG 3.1Å; C1345-C1372 VanDerWaalsContact N-SG 3.43Å; C1345-C1372 VanDerWaalsContact SG-CA 3.51Å; C1345-C1372 WeakPolarHBondContact SG-CB 3.4Å; C1345-C1372 CovalentContact SG-SG 2.04Å; C1345-C1372 PolarHBondContact SG-SG 3.07Å; V1367-C1372 HydrophobicContact CG1-CB 4Å; V1367-C1372 WeakPolarHBondContact CG1-O 3.35Å; G1369-C1372 PolarHBondContact O-N 3.23Å
1373	A	84	Confident	74.7	Confident	39 Å²	39	51.1 Å²	51.1	32%	0.322	31%	0.312	S	S	.	.			trans	-116.2	14.1	-168.9	0	0	0	0	0	114.8	D1327 T1371	D1327-A1373 HydrophobicContact CB-CB 4.1Å; T1371-A1373 PolarHBondContact O-N 2.98Å
1374	T	84.2	Confident	76.3	Confident	80 Å²	80	53.6 Å²	53.6	49%	0.491	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	138.4	-175.2	-53.8	0	0	0	0	110.3	V1367 I1368	V1367-T1374 CarbonylContact C-O 3.59Å; V1367-T1374 WeakPolarHBondContact CA-O 2.99Å; V1367-T1374 WeakPolarHBondContact CG1-O 3.44Å; I1368-T1374 HydrophobicContact CD1-CG2 4.43Å; I1368-T1374 HydrophobicContact CG1-CG2 4.2Å; I1368-T1374 PolarHBondContact N-O 3.14Å
1375	C	83.4	Confident	77.5	Confident	29 Å²	29	52.3 Å²	52.3	20%	0.196	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	149.1	171.5	-66.5	0	0	0	0	111.9	N1366 T1379 C1390	N1366-C1375 WeakPolarHBondContact O-CA 3.02Å; C1375-T1379 WeakPolarHBondContact CB-O 3.17Å; C1375-T1379 WeakPolarHBondContact CB-OG1 3.43Å; C1375-C1390 WeakPolarHBondContact CA-SG 3.48Å; C1375-C1390 HydrophobicContact CB-CB 3.8Å; C1375-C1390 WeakPolarHBondContact CB-SG 3.3Å; C1375-C1390 WeakPolarHBondContact SG-CB 3.12Å; C1375-C1390 CovalentContact SG-SG 2.04Å; C1375-C1390 PolarHBondContact SG-SG 3.32Å
1376	A	77.8	Confident	78	Confident	15 Å²	15	47.8 Å²	47.8	12%	0.124	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-65	151.4	170	0	0	0	0	0	111.3	E1365 N1366 I1368 G1378 T1379	E1365-A1376 WeakPolarHBondContact O-CB 3.1Å; N1366-A1376 PolarHBondContact O-N 2.03Å; I1368-A1376 HydrophobicContact CG2-CB 3.93Å; A1376-G1378 PolarHBondContact O-N 2.03Å; A1376-T1379 HydrophobicContact CB-CG2 4.46Å; A1376-T1379 PolarHBondContact N-OG1 2.85Å; A1376-T1379 VanDerWaalsContact N-OG1 3.07Å; A1376-T1379 PolarHBondContact O-N 2.94Å; A1376-T1379 PolarHBondContact O-OG1 3.24Å
1377	P	78.6	Confident	77.9	Confident	116 Å²	116	55.7 Å²	55.7	75%	0.753	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	136.4	160.8	-22.5	33.5	0	0	0	110
1378	G	75.1	Confident	77.4	Confident	21 Å²	21	57.6 Å²	57.6	22%	0.216	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.8	-1.4	-170.2	0	0	0	0	0	115.4	A1376 E1392 C1393 D1400	A1376-G1378 PolarHBondContact O-N 2.03Å; G1378-E1392 WeakPolarHBondContact O-CA 3.18Å; G1378-C1393 VanDerWaalsContact C-SG 3.59Å; G1378-C1393 PolarHBondContact O-N 3.08Å; G1378-C1393 PolarHBondContact O-SG 3.49Å; G1378-D1400 WeakPolarHBondContact CA-O 3.18Å
1379	T	82.1	Confident	77.5	Confident	17 Å²	17	54.6 Å²	54.6	10%	0.104	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	156.6	-179.5	68.6	0	0	0	0	113.8	N1366 C1375 A1376 T1391 E1392	N1366-T1379 HydrophobicContact CB-CG2 3.95Å; N1366-T1379 PolarHBondContact O-OG1 2.9Å; N1366-T1379 VanDerWaalsContact O-OG1 3.13Å; C1375-T1379 WeakPolarHBondContact CB-O 3.17Å; C1375-T1379 WeakPolarHBondContact CB-OG1 3.43Å; A1376-T1379 HydrophobicContact CB-CG2 4.46Å; A1376-T1379 PolarHBondContact N-OG1 2.85Å; A1376-T1379 VanDerWaalsContact N-OG1 3.07Å; A1376-T1379 PolarHBondContact O-N 2.94Å; A1376-T1379 PolarHBondContact O-OG1 3.24Å; T1379-T1391 CarbonylContact C-O 3.47Å; T1379-T1391 WeakPolarHBondContact CA-O 3.44Å; T1379-T1391 VanDerWaalsContact CB-O 3.22Å; T1379-T1391 WeakPolarHBondContact CB-O 3.38Å; T1379-E1392 HydrophobicContact CG2-CG 4.26Å
1380	F	83.3	Confident	78.1	Confident	13 Å²	13	52.4 Å²	52.4	6%	0.057	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	-179	-177.6	74.4	-73.1	0	0	0	112	C1390 T1391 C1402 N1547 E1549	F1380-C1390 CarbonylContact O-C 3.51Å; F1380-C1390 VanDerWaalsContact O-CA 3.32Å; F1380-C1390 WeakPolarHBondContact O-CA 3.46Å; F1380-C1390 VanDerWaalsContact O-CB 3.22Å; F1380-C1390 WeakPolarHBondContact O-CB 3.24Å; F1380-T1391 VanDerWaalsContact CD1-O 3.25Å; F1380-T1391 WeakPolarHBondContact CD1-O 3.33Å; F1380-T1391 HydrophobicContact CE1-CG2 4.01Å; F1380-T1391 HydrophobicContact CZ-CG2 4.32Å; F1380-T1391 PolarHBondContact N-O 2.85Å; F1380-T1391 PolarHBondContact O-N 3.06Å; F1380-C1402 WeakPolarHBondContact CD1-SG 3.47Å; F1380-N1547 WeakPolarHBondContact CE2-O 3.11Å; F1380-E1549 HydrophobicContact CE1-CB 4.03Å; F1380-E1549 HydrophobicContact CE2-CB 4.13Å; F1380-E1549 HydrophobicContact CZ-CB 3.8Å
1381	N	80	Confident	78.2	Confident	18 Å²	18	49.5 Å²	49.5	10%	0.096	28%	0.275	C	S	.	.			trans	57.5	64.4	176	-166.1	51.6	0	0	0	115.4	A1383 N1386 S1404 S1546	N1381-A1383 PolarHBondContact O-N 2.66Å; N1381-N1386 PolarHBondContact O-ND2 2.88Å; N1381-S1404 PolarHBondContact N-OG 3.4Å; N1381-S1404 VanDerWaalsContact N-OG 3.12Å; N1381-S1546 WeakPolarHBondContact CB-O 3.15Å; N1381-S1546 PolarHBondContact OD1-O 2.04Å; N1381-S1546 PolarHBondContact OD1-OG 3.48Å
1382	L	81.9	Confident	77.7	Confident	58 Å²	58	50.5 Å²	50.5	30%	0.304	28%	0.275	S	S	.	.			trans	-66.6	108.8	172.2	-178.4	63.4	0	0	0	110.7	V1367 G1389 C1390	V1367-L1382 HydrophobicContact CG1-CD1 4.12Å; V1367-L1382 HydrophobicContact CG2-CD1 3.8Å; L1382-G1389 VanDerWaalsContact CA-O 3.31Å; L1382-G1389 WeakPolarHBondContact CA-O 3.49Å; L1382-C1390 VanDerWaalsContact CA-SG 3.59Å
1383	A	75.7	Confident	77.3	Confident	19 Å²	19	51.7 Å²	51.7	16%	0.157	28%	0.283	C	S	.	.			trans	-144	155.6	-176.9	0	0	0	0	0	114	K1346 N1381 D1385 N1386 G1389	K1346-A1383 PolarHBondContact NZ-O 2.79Å; N1381-A1383 PolarHBondContact O-N 2.66Å; A1383-D1385 WeakPolarHBondContact CB-OD1 3.11Å; A1383-N1386 HydrophobicContact CB-CB 4.01Å; A1383-N1386 WeakPolarHBondContact O-CB 3.14Å; A1383-N1386 PolarHBondContact O-N 3.17Å; A1383-G1389 PolarHBondContact N-O 3.29Å
1384	R	71.8	Confident	76.8	Confident	168 Å²	168	54 Å²	54	63%	0.634	29%	0.286	S	S	*	.	S	Bend	trans	-75.2	-34	-174.1	-168.1	168.6	-161.1	-160	1.5	113	L1328 K1346	L1328-R1384 WeakPolarHBondContact O-CG 3.09Å; L1328-R1384 PolarHBondContact O-NE 3.02Å; K1346-R1384 PolarHBondContact NZ-O 3.31Å
1385	D	70.9	Confident	76.2	Confident	125 Å²	125	50.2 Å²	50.2	67%	0.668	26%	0.262	S	S	*	.	S	Bend	trans	-81.1	-17	172.9	57.5	-47.3	0	0	0	113.4	A1383 E1387	A1383-D1385 WeakPolarHBondContact CB-OD1 3.11Å; D1385-E1387 PolarHBondContact O-N 3.03Å
1386	N	69.3	Low	75.3	Confident	3 Å²	3	51.2 Å²	51.2	2%	0.016	26%	0.264	C	S	.	.			trans	-69.1	112.1	170.5	-171.8	-20.5	0	0	0	109.8	K1346 N1381 A1383 K1388 G1389 C1390 T1391	K1346-N1386 WeakPolarHBondContact CD-O 3.4Å; K1346-N1386 PolarHBondContact NZ-O 3.09Å; N1381-N1386 PolarHBondContact O-ND2 2.88Å; A1383-N1386 HydrophobicContact CB-CB 4.01Å; A1383-N1386 WeakPolarHBondContact O-CB 3.14Å; A1383-N1386 PolarHBondContact O-N 3.17Å; N1386-K1388 VanDerWaalsContact C-N 3.32Å; N1386-K1388 PolarHBondContact O-N 3.17Å; N1386-K1388 PolarHBondContact OD1-N 2.8Å; N1386-K1388 VanDerWaalsContact OD1-N 3.15Å; N1386-G1389 PolarHBondContact ND2-O 3.17Å; N1386-G1389 WeakPolarHBondContact O-CA 3.43Å; N1386-G1389 PolarHBondContact O-N 2.81Å; N1386-G1389 PolarHBondContact OD1-N 2.72Å; N1386-C1390 VanDerWaalsContact ND2-C 3.29Å; N1386-C1390 WeakPolarHBondContact ND2-CA 3.43Å; N1386-T1391 PolarHBondContact ND2-N 3.22Å; N1386-T1391 PolarHBondContact ND2-OG1 3.43Å; N1386-T1391 VanDerWaalsContact ND2-OG1 3.15Å
1387	E	69.6	Low	74.6	Confident	173 Å²	173	54 Å²	54	81%	0.808	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-33.4	-177.8	-63.1	-167	150.7	0	0	113	D1385 G1389	D1385-E1387 PolarHBondContact O-N 3.03Å; E1387-G1389 VanDerWaalsContact C-N 3.27Å
1388	K	68.9	Low	73.7	Confident	40 Å²	40	50.1 Å²	50.1	17%	0.174	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-13.8	171.3	-57	-164	-167.6	-159.5	0	112.6	F1348 N1366 N1386 C1390 E1392	F1348-K1388 HydrophobicContact CB-CD 4.08Å; F1348-K1388 HydrophobicContact CB-CG 4.29Å; F1348-K1388 HydrophobicContact CD2-CD 3.76Å; F1348-K1388 HydrophobicContact CD2-CG 3.9Å; F1348-K1388 HydrophobicContact CE2-CD 4.37Å; F1348-K1388 VanDerWaalsContact CE2-CE 3.47Å; F1348-K1388 HydrophobicContact CG-CD 3.9Å; F1348-K1388 HydrophobicContact CG-CG 4.32Å; N1366-K1388 HydrophobicContact CB-CB 4.43Å; N1366-K1388 WeakPolarHBondContact ND2-CD 3.41Å; N1386-K1388 VanDerWaalsContact C-N 3.32Å; N1386-K1388 PolarHBondContact O-N 3.17Å; N1386-K1388 PolarHBondContact OD1-N 2.8Å; N1386-K1388 VanDerWaalsContact OD1-N 3.15Å; K1388-C1390 VanDerWaalsContact C-N 3.26Å; K1388-C1390 VanDerWaalsContact CB-O 3.29Å; K1388-C1390 WeakPolarHBondContact CB-O 3.22Å; K1388-C1390 PolarHBondContact O-N 2.85Å; K1388-E1392 VanDerWaalsContact CD-OE1 3.22Å; K1388-E1392 WeakPolarHBondContact CD-OE1 3.46Å; K1388-E1392 WeakPolarHBondContact CE-OE1 3.32Å; K1388-E1392 IonicContact NZ-OE1 2.73Å; K1388-E1392 PolarHBondContact NZ-OE1 3.26Å; K1388-E1392 IonicContact NZ-OE2 3.06Å; K1388-E1392 PolarHBondContact NZ-OE2 2.03Å
1389	G	76	Confident	73.3	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.264	C	S	.	.	S	Bend	trans	85.3	-52	-171.7	0	0	0	0	0	112.9	L1382 A1383 N1386 E1387	L1382-G1389 VanDerWaalsContact CA-O 3.31Å; L1382-G1389 WeakPolarHBondContact CA-O 3.49Å; A1383-G1389 PolarHBondContact N-O 3.29Å; N1386-G1389 PolarHBondContact ND2-O 3.17Å; N1386-G1389 WeakPolarHBondContact O-CA 3.43Å; N1386-G1389 PolarHBondContact O-N 2.81Å; N1386-G1389 PolarHBondContact OD1-N 2.72Å; E1387-G1389 VanDerWaalsContact C-N 3.27Å
1390	C	83.9	Confident	72.9	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.286	C	S	.	.	S	Bend	trans	-127.6	156.2	168.4	-61.8	0	0	0	0	111.1	N1366 C1375 F1380 L1382 N1386 K1388	N1366-C1390 HydrophobicContact CB-CB 4.12Å; N1366-C1390 WeakPolarHBondContact CB-O 3.39Å; N1366-C1390 PolarHBondContact ND2-O 2.04Å; N1366-C1390 WeakPolarHBondContact O-CB 3.24Å; C1375-C1390 WeakPolarHBondContact CA-SG 3.48Å; C1375-C1390 HydrophobicContact CB-CB 3.8Å; C1375-C1390 WeakPolarHBondContact CB-SG 3.3Å; C1375-C1390 WeakPolarHBondContact SG-CB 3.12Å; C1375-C1390 CovalentContact SG-SG 2.04Å; C1375-C1390 PolarHBondContact SG-SG 3.32Å; F1380-C1390 CarbonylContact O-C 3.51Å; F1380-C1390 VanDerWaalsContact O-CA 3.32Å; F1380-C1390 WeakPolarHBondContact O-CA 3.46Å; F1380-C1390 VanDerWaalsContact O-CB 3.22Å; F1380-C1390 WeakPolarHBondContact O-CB 3.24Å; L1382-C1390 VanDerWaalsContact CA-SG 3.59Å; N1386-C1390 VanDerWaalsContact ND2-C 3.29Å; N1386-C1390 WeakPolarHBondContact ND2-CA 3.43Å; K1388-C1390 VanDerWaalsContact C-N 3.26Å; K1388-C1390 VanDerWaalsContact CB-O 3.29Å; K1388-C1390 WeakPolarHBondContact CB-O 3.22Å; K1388-C1390 PolarHBondContact O-N 2.85Å
1391	T	75.8	Confident	72.6	Confident	41 Å²	41	58.2 Å²	58.2	25%	0.252	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	139.4	-179.4	-54.6	0	0	0	0	110.6	T1379 F1380 N1386	T1379-T1391 CarbonylContact C-O 3.47Å; T1379-T1391 WeakPolarHBondContact CA-O 3.44Å; T1379-T1391 VanDerWaalsContact CB-O 3.22Å; T1379-T1391 WeakPolarHBondContact CB-O 3.38Å; F1380-T1391 VanDerWaalsContact CD1-O 3.25Å; F1380-T1391 WeakPolarHBondContact CD1-O 3.33Å; F1380-T1391 HydrophobicContact CE1-CG2 4.01Å; F1380-T1391 HydrophobicContact CZ-CG2 4.32Å; F1380-T1391 PolarHBondContact N-O 2.85Å; F1380-T1391 PolarHBondContact O-N 3.06Å; N1386-T1391 PolarHBondContact ND2-N 3.22Å; N1386-T1391 PolarHBondContact ND2-OG1 3.43Å; N1386-T1391 VanDerWaalsContact ND2-OG1 3.15Å
1392	E	73.5	Confident	72.7	Confident	86 Å²	86	58.2 Å²	58.2	40%	0.402	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	144.6	173.7	-69.5	105.4	-99.1	0	0	112.7	N1366 G1378 T1379 K1388	N1366-E1392 PolarHBondContact ND2-OE1 2.8Å; G1378-E1392 WeakPolarHBondContact O-CA 3.18Å; T1379-E1392 HydrophobicContact CG2-CG 4.26Å; K1388-E1392 VanDerWaalsContact CD-OE1 3.22Å; K1388-E1392 WeakPolarHBondContact CD-OE1 3.46Å; K1388-E1392 WeakPolarHBondContact CE-OE1 3.32Å; K1388-E1392 IonicContact NZ-OE1 2.73Å; K1388-E1392 PolarHBondContact NZ-OE1 3.26Å; K1388-E1392 IonicContact NZ-OE2 3.06Å; K1388-E1392 PolarHBondContact NZ-OE2 2.03Å
1393	C	78.1	Confident	72.8	Confident	24 Å²	24	63.3 Å²	63.3	16%	0.162	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-72	135.4	170.7	-60.1	0	0	0	0	111.4	G1378 D1400 C1402	G1378-C1393 VanDerWaalsContact C-SG 3.59Å; G1378-C1393 PolarHBondContact O-N 3.08Å; G1378-C1393 PolarHBondContact O-SG 3.49Å; C1393-D1400 PolarHBondContact SG-O 2.92Å; C1393-C1402 HydrophobicContact CB-CB 3.71Å; C1393-C1402 WeakPolarHBondContact CB-SG 3.35Å; C1393-C1402 WeakPolarHBondContact SG-CB 3.48Å; C1393-C1402 CovalentContact SG-SG 2.03Å; C1393-C1402 PolarHBondContact SG-SG 3.2Å
1394	F	72.3	Confident	72.9	Confident	88 Å²	88	64.2 Å²	64.2	39%	0.386	33%	0.328	S	S	.	.			trans	-95.5	-60	178.6	167	-104.7	0	0	0	112.3	F1396 G1397 E1549 L1589	F1394-F1396 HydrophobicContact CD1-CD2 4.36Å; F1394-F1396 AromaticContact CE1-CD2 3.57Å; F1394-F1396 HydrophobicContact CE1-CD2 3.57Å; F1394-F1396 AromaticContact CE1-CE2 3.82Å; F1394-F1396 HydrophobicContact CE1-CE2 3.82Å; F1394-F1396 HydrophobicContact CE1-CG 4Å; F1394-F1396 HydrophobicContact CE1-CZ 4.43Å; F1394-F1396 HydrophobicContact CZ-CD2 4.27Å; F1394-F1396 HydrophobicContact CZ-CG 4.26Å; F1394-F1396 PolarHBondContact O-N 2.81Å; F1394-G1397 PolarHBondContact O-N 2.88Å; F1394-E1549 PolarHBondContact N-OE2 3.44Å; F1394-L1589 HydrophobicContact CZ-CD1 4.35Å
1395	C	71.8	Confident	73	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	45.2	33.5	171.6	-56.7	0	0	0	0	116.2	G1397 V1398 T1399 E1549 C1551 S1561	C1395-G1397 PolarHBondContact O-N 3.34Å; C1395-V1398 WeakPolarHBondContact O-CB 3.3Å; C1395-V1398 PolarHBondContact O-N 2.86Å; C1395-T1399 HydrophobicContact CB-CG2 3.9Å; C1395-T1399 WeakPolarHBondContact CB-O 3.24Å; C1395-E1549 PolarHBondContact N-OE1 2.91Å; C1395-C1551 WeakPolarHBondContact CA-SG 3.1Å; C1395-C1551 HydrophobicContact CB-CB 3.75Å; C1395-C1551 WeakPolarHBondContact CB-SG 3.05Å; C1395-C1551 WeakPolarHBondContact SG-CB 3.14Å; C1395-C1551 CovalentContact SG-SG 2.03Å; C1395-C1551 PolarHBondContact SG-SG 3.13Å; C1395-S1561 CarbonylContact C-O 3.57Å
1396	F	64.9	Low	73.1	Confident	51 Å²	51	55 Å²	55	22%	0.224	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	50.6	21	-172.1	-77.1	-107.9	0	0	0	114.7	F1394 V1398 L1466 S1561 E1563 L1589	F1394-F1396 HydrophobicContact CD1-CD2 4.36Å; F1394-F1396 AromaticContact CE1-CD2 3.57Å; F1394-F1396 HydrophobicContact CE1-CD2 3.57Å; F1394-F1396 AromaticContact CE1-CE2 3.82Å; F1394-F1396 HydrophobicContact CE1-CE2 3.82Å; F1394-F1396 HydrophobicContact CE1-CG 4Å; F1394-F1396 HydrophobicContact CE1-CZ 4.43Å; F1394-F1396 HydrophobicContact CZ-CD2 4.27Å; F1394-F1396 HydrophobicContact CZ-CG 4.26Å; F1394-F1396 PolarHBondContact O-N 2.81Å; F1396-V1398 VanDerWaalsContact C-N 3.29Å; F1396-V1398 HydrophobicContact CB-CG2 4.3Å; F1396-V1398 PolarHBondContact O-N 2.03Å; F1396-L1466 HydrophobicContact CE2-CD1 4.23Å; F1396-L1466 HydrophobicContact CE2-CD2 3.95Å; F1396-L1466 HydrophobicContact CZ-CD1 4.1Å; F1396-L1466 HydrophobicContact CZ-CD2 3.82Å; F1396-S1561 VanDerWaalsContact CD2-O 3.25Å; F1396-S1561 WeakPolarHBondContact CD2-O 3.36Å; F1396-E1563 HydrophobicContact CD2-CB 4.11Å; F1396-E1563 HydrophobicContact CE1-CB 4.39Å; F1396-E1563 HydrophobicContact CE2-CB 3.85Å; F1396-E1563 HydrophobicContact CG-CB 4.48Å; F1396-E1563 HydrophobicContact CZ-CB 4Å; F1396-L1589 HydrophobicContact CD1-CB 4.37Å; F1396-L1589 HydrophobicContact CD1-CD1 3.87Å; F1396-L1589 HydrophobicContact CD1-CD2 4.46Å; F1396-L1589 HydrophobicContact CD1-CG 4.46Å; F1396-L1589 HydrophobicContact CE1-CD2 4.45Å
1397	G	62.9	Low	73.1	Confident	72 Å²	72	56.4 Å²	56.4	74%	0.742	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	73.2	12.6	-174.8	0	0	0	0	0	115.1	F1394 C1395	F1394-G1397 PolarHBondContact O-N 2.88Å; C1395-G1397 PolarHBondContact O-N 3.34Å
1398	V	59.4	Low	72.8	Confident	35 Å²	35	51.2 Å²	51.2	21%	0.212	28%	0.276	C	S	.	.	S	Bend	trans	-88.6	-27	-176.1	-176.8	0	0	0	0	112.7	C1395 F1396 P1554 Y1557 C1562	C1395-V1398 WeakPolarHBondContact O-CB 3.3Å; C1395-V1398 PolarHBondContact O-N 2.86Å; F1396-V1398 VanDerWaalsContact C-N 3.29Å; F1396-V1398 HydrophobicContact CB-CG2 4.3Å; F1396-V1398 PolarHBondContact O-N 2.03Å; V1398-P1554 HydrophobicContact CG1-CG 4.38Å; V1398-Y1557 HydrophobicContact CG1-CD1 4.15Å; V1398-Y1557 HydrophobicContact CG1-CD2 3.53Å; V1398-Y1557 HydrophobicContact CG1-CE2 4.23Å; V1398-Y1557 HydrophobicContact CG1-CG 3.52Å; V1398-Y1557 HydrophobicContact CG2-CD1 4.1Å; V1398-Y1557 HydrophobicContact CG2-CE1 4.41Å; V1398-Y1557 HydrophobicContact CG2-CG 4.3Å; V1398-C1562 HydrophobicContact CB-CB 3.58Å; V1398-C1562 HydrophobicContact CG1-CB 3.76Å; V1398-C1562 HydrophobicContact CG2-CB 3.81Å
1399	T	67.6	Low	72.3	Confident	24 Å²	24	54.1 Å²	54.1	15%	0.147	29%	0.289	C	S	.	.			trans	-155.7	147.6	175.7	-173.5	0	0	0	0	110.8	C1395 N1401 C1551	C1395-T1399 HydrophobicContact CB-CG2 3.9Å; C1395-T1399 WeakPolarHBondContact CB-O 3.24Å; T1399-N1401 WeakPolarHBondContact OG1-CB 3.21Å; T1399-N1401 PolarHBondContact OG1-N 3.37Å; T1399-N1401 VanDerWaalsContact OG1-N 3.1Å; T1399-C1551 HydrophobicContact CG2-CB 3.95Å
1400	D	72.7	Confident	71.6	Confident	107 Å²	107	57.5 Å²	57.5	57%	0.572	31%	0.31	S	S	*	.	S	Bend	trans	-88.4	-11.5	168	62	-24.5	0	0	0	112.4	G1378 C1393 C1402	G1378-D1400 WeakPolarHBondContact CA-O 3.18Å; C1393-D1400 PolarHBondContact SG-O 2.92Å; D1400-C1402 PolarHBondContact O-N 2.82Å
1401	N	78.7	Confident	70.3	Confident	91 Å²	91	61.8 Å²	61.8	49%	0.487	34%	0.34	S	S	.	.			trans	-83.4	85.6	-177.4	-174	2	0	0	0	110.8	T1399 H1552	T1399-N1401 WeakPolarHBondContact OG1-CB 3.21Å; T1399-N1401 PolarHBondContact OG1-N 3.37Å; T1399-N1401 VanDerWaalsContact OG1-N 3.1Å; N1401-H1552 HydrophobicContact CB-CB 4.2Å; N1401-H1552 WeakPolarHBondContact O-CB 3.39Å; N1401-H1552 PolarHBondContact O-N 3Å
1402	C	82.1	Confident	69.7	Low	17 Å²	17	63.6 Å²	63.6	12%	0.115	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	168.7	171	88	0	0	0	0	113	F1380 C1393 D1400 E1549 V1550	F1380-C1402 WeakPolarHBondContact CD1-SG 3.47Å; C1393-C1402 HydrophobicContact CB-CB 3.71Å; C1393-C1402 WeakPolarHBondContact CB-SG 3.35Å; C1393-C1402 WeakPolarHBondContact SG-CB 3.48Å; C1393-C1402 CovalentContact SG-SG 2.03Å; C1393-C1402 PolarHBondContact SG-SG 3.2Å; D1400-C1402 PolarHBondContact O-N 2.82Å; C1402-E1549 HydrophobicContact CB-CB 4.24Å; C1402-V1550 CarbonylContact C-O 3.54Å; C1402-V1550 VanDerWaalsContact CA-O 3.26Å; C1402-V1550 WeakPolarHBondContact CA-O 3.22Å
1403	R	83.2	Confident	69.1	Low	165 Å²	165	66.7 Å²	66.7	62%	0.623	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.2	158.1	170.4	64	175	-174.9	-97.6	-1	111.2	E1549 V1550	R1403-E1549 CarbonylContact O-C 3.28Å; R1403-V1550 HydrophobicContact CG-CB 4.19Å; R1403-V1550 PolarHBondContact N-O 3.09Å; R1403-V1550 PolarHBondContact O-N 2.89Å
1404	S	77.8	Confident	68.5	Low	39 Å²	39	68.6 Å²	68.6	27%	0.273	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.2	137.4	165.7	-71.4	0	0	0	0	111.6	N1381 S1546	N1381-S1404 PolarHBondContact N-OG 3.4Å; N1381-S1404 VanDerWaalsContact N-OG 3.12Å; S1404-S1546 WeakPolarHBondContact CB-O 2.98Å; S1404-S1546 PolarHBondContact OG-O 3.07Å
1405	S	73.5	Confident	68.1	Low	5 Å²	5	68.5 Å²	68.5	4%	0.035	38%	0.375	C	S	.	.			trans	-72.9	158.1	178.4	96.4	0	0	0	0	112.9	F1407 A1545 V1548	S1405-F1407 VanDerWaalsContact CB-CD2 3.49Å; S1405-F1407 WeakPolarHBondContact OG-CB 3.29Å; S1405-F1407 PolarHBondContact OG-N 2.76Å; S1405-A1545 PolarHBondContact OG-O 2.77Å; S1405-V1548 WeakPolarHBondContact CB-O 3.32Å; S1405-V1548 PolarHBondContact N-O 2.9Å
1406	T	72.4	Confident	67.7	Low	93 Å²	93	76.7 Å²	76.7	57%	0.571	41%	0.407	S	S	*	.			trans	-108.1	23.7	166.5	54.9	0	0	0	0	111.1	L1538	T1406-L1538 WeakPolarHBondContact O-CD1 3.49Å; T1406-L1538 WeakPolarHBondContact O-CG 3.4Å
1407	F	69.2	Low	67.7	Low	34 Å²	34	75.4 Å²	75.4	15%	0.149	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-82.7	160.7	-178.1	-62.6	-40.5	0	0	0	111.9	S1405 A1533 D1534 E1535 A1544 A1545 V1550	S1405-F1407 VanDerWaalsContact CB-CD2 3.49Å; S1405-F1407 WeakPolarHBondContact OG-CB 3.29Å; S1405-F1407 PolarHBondContact OG-N 2.76Å; F1407-A1533 HydrophobicContact CB-CB 3.58Å; F1407-A1533 HydrophobicContact CD2-CB 3.88Å; F1407-A1533 HydrophobicContact CG-CB 4.14Å; F1407-D1534 WeakPolarHBondContact CB-O 3.24Å; F1407-E1535 HydrophobicContact CE1-CG 3.91Å; F1407-E1535 HydrophobicContact CZ-CG 4.25Å; F1407-A1544 WeakPolarHBondContact O-CA 3.47Å; F1407-A1545 PolarHBondContact O-N 2.71Å; F1407-V1550 HydrophobicContact CE2-CG2 3.86Å; F1407-V1550 HydrophobicContact CZ-CG2 4.33Å
1408	K	63.6	Low	68.1	Low	63 Å²	63	74.2 Å²	74.2	27%	0.274	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	135.3	-172.9	173.2	176.2	-174	145.7	0	112.9	S1532 A1533 D1534 E1542	K1408-S1532 VanDerWaalsContact O-O 3.1Å; K1408-A1533 CarbonylContact O-C 3.21Å; K1408-A1533 WeakPolarHBondContact O-CA 3.22Å; K1408-D1534 HydrophobicContact CB-CB 4.26Å; K1408-D1534 PolarHBondContact N-O 3.41Å; K1408-D1534 PolarHBondContact O-N 3.2Å; K1408-E1542 WeakPolarHBondContact CE-OE1 3.47Å; K1408-E1542 WeakPolarHBondContact CE-OE2 3.03Å; K1408-E1542 IonicContact NZ-OE1 2.69Å; K1408-E1542 PolarHBondContact NZ-OE1 3.47Å; K1408-E1542 IonicContact NZ-OE2 3.84Å; K1408-E1542 PolarHBondContact NZ-OE2 3.36Å
1409	K	59.9	Low	68.5	Low	101 Å²	101	79.3 Å²	79.3	44%	0.439	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	129.6	177.8	-165.1	177.4	-163	136.7	0	113	M1530 D1531 S1532	K1409-M1530 PolarHBondContact NZ-O 3.1Å; K1409-D1531 HydrophobicContact CD-CB 4.32Å; K1409-D1531 WeakPolarHBondContact CD-OD2 3.34Å; K1409-D1531 VanDerWaalsContact CE-CG 3.41Å; K1409-D1531 WeakPolarHBondContact CE-OD2 3.33Å; K1409-D1531 HydrophobicContact CG-CB 4.09Å; K1409-D1531 IonicContact NZ-OD1 3.36Å; K1409-D1531 PolarHBondContact NZ-OD1 2.85Å; K1409-D1531 IonicContact NZ-OD2 3.46Å; K1409-D1531 PolarHBondContact NZ-OD2 2.88Å; K1409-S1532 CarbonylContact C-O 3.44Å; K1409-S1532 VanDerWaalsContact CA-O 3.26Å; K1409-S1532 WeakPolarHBondContact CA-O 3.32Å
1410	T	60.2	Low	68.4	Low	72 Å²	72	79.2 Å²	79.2	44%	0.442	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	177.3	-179.4	-164.5	0	0	0	0	114.4	S1532	T1410-S1532 PolarHBondContact N-O 2.04Å; T1410-S1532 WeakPolarHBondContact O-CB 3.14Å
1411	S	56.6	Low	67.7	Low	90 Å²	90	75.5 Å²	75.5	63%	0.629	38%	0.381	S	S	*	.			trans	-154.6	163.2	178.5	63.1	0	0	0	0	113.9
1412	I	62.6	Low	66.4	Low	79 Å²	79	76.7 Å²	76.7	41%	0.405	39%	0.392	S	S	.	.			trans	-122.1	129.6	-179.9	-58.4	172.7	0	0	0	109.6	Y1461	I1412-Y1461 HydrophobicContact CG2-CD1 4.48Å; I1412-Y1461 HydrophobicContact CG2-CE1 4Å; I1412-Y1461 HydrophobicContact CG2-CE2 4.2Å
1413	I	62.7	Low	64.8	Low	150 Å²	150	85.9 Å²	85.9	77%	0.769	43%	0.425	S	S	*	.			trans	-138.2	24.6	-171.5	60.5	171.3	0	0	0	113.8	M1415	I1413-M1415 PolarHBondContact O-N 3.01Å
1414	D	64.6	Low	62.8	Low	65 Å²	65	83.8 Å²	83.8	35%	0.348	44%	0.442	S	S	.	.			trans	-88.7	91.8	-168.5	178.9	24.1	0	0	0	113.8	Y1416 S1460 Y1461	D1414-Y1416 PolarHBondContact O-N 3.11Å; D1414-Y1416 VanDerWaalsContact OD1-CB 3.3Å; D1414-Y1416 WeakPolarHBondContact OD1-CB 3.4Å; D1414-Y1416 PolarHBondContact OD1-N 3.16Å; D1414-Y1416 VanDerWaalsContact OD1-N 3.12Å; D1414-S1460 WeakPolarHBondContact OD2-CB 3.17Å; D1414-S1460 PolarHBondContact OD2-OG 3.25Å; D1414-Y1461 HydrophobicContact CB-CE2 4.39Å; D1414-Y1461 PolarHBondContact N-OH 3.12Å; D1414-Y1461 VanDerWaalsContact O-CE2 3.3Å; D1414-Y1461 WeakPolarHBondContact O-CE2 3.48Å
1415	M	62.8	Low	61.5	Low	85 Å²	85	83.4 Å²	83.4	42%	0.419	45%	0.445	S	S	.	.			trans	-78.3	10.2	177.1	-64.2	-53.6	-60	0	0	114.8	I1413 W1418	I1413-M1415 PolarHBondContact O-N 3.01Å; M1415-W1418 HydrophobicContact CE-CZ2 4.5Å
1416	Y	63.7	Low	60.6	Low	173 Å²	173	90.1 Å²	90.1	68%	0.678	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	125.3	-175.6	-172.7	-113.3	0	0	0	114	D1414 P1458	D1414-Y1416 PolarHBondContact O-N 3.11Å; D1414-Y1416 VanDerWaalsContact OD1-CB 3.3Å; D1414-Y1416 WeakPolarHBondContact OD1-CB 3.4Å; D1414-Y1416 PolarHBondContact OD1-N 3.16Å; D1414-Y1416 VanDerWaalsContact OD1-N 3.12Å; Y1416-P1458 WeakPolarHBondContact O-CB 3.33Å; Y1416-P1458 VanDerWaalsContact O-CG 3.29Å; Y1416-P1458 WeakPolarHBondContact O-CG 3.33Å
1417	G	65.3	Low	59.9	Low	23 Å²	23	89.1 Å²	89.1	24%	0.237	46%	0.462	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.8	21.8	168.2	0	0	0	0	0	116.4
1418	W	70.9	Confident	59.7	Low	48 Å²	48	96.6 Å²	96.6	18%	0.182	49%	0.489	C	S	.	.			trans	-62.6	149.4	165.2	-70.3	76	0	0	0	111.3	M1415 Q1429 L1455 F1456 P1458 Y1461	M1415-W1418 HydrophobicContact CE-CZ2 4.5Å; W1418-Q1429 PolarHBondContact O-NE2 2.55Å; W1418-L1455 HydrophobicContact CE3-CB 3.92Å; W1418-L1455 HydrophobicContact CZ3-CB 4.42Å; W1418-F1456 WeakPolarHBondContact CA-O 3.48Å; W1418-P1458 VanDerWaalsContact CE2-CD 3.48Å; W1418-P1458 HydrophobicContact CG-CG 4.47Å; W1418-P1458 VanDerWaalsContact NE1-CD 3.35Å; W1418-Y1461 HydrophobicContact CZ2-CD2 4.36Å; W1418-Y1461 HydrophobicContact CZ2-CE2 4.1Å
1419	K	68.1	Low	59.6	Low	141 Å²	141	96.6 Å²	96.6	61%	0.613	49%	0.491	S	S	*	.	B	Isolated β-bridge	trans	-140.3	141.1	-170.5	-64.2	173.7	-172.2	172.3	0	114.3	F1456	K1419-F1456 PolarHBondContact N-O 3.46Å; K1419-F1456 PolarHBondContact O-N 2.99Å
1420	V	65.3	Low	59.7	Low	22 Å²	22	95.1 Å²	95.1	13%	0.133	49%	0.486	C	S	.	.			trans	-82.6	135.9	168.2	-175.6	0	0	0	0	110	V1438 V1453 L1455	V1420-V1438 HydrophobicContact CG2-CG1 4.11Å; V1420-V1438 HydrophobicContact CG2-CG2 4.17Å; V1420-V1453 HydrophobicContact CG1-CG1 4.27Å; V1420-L1455 HydrophobicContact CG2-CD2 3.77Å
1421	P	59.2	Low	59.6	Low	29 Å²	29	96.2 Å²	96.2	19%	0.188	49%	0.487	C	S	.	.			trans	-70.8	127	169.8	30.4	-33.3	0	0	0	110.2	W1423 Y1454 F1456	P1421-W1423 HydrophobicContact CB-CE3 4.24Å; P1421-W1423 HydrophobicContact CB-CH2 4.33Å; P1421-W1423 HydrophobicContact CB-CZ3 3.92Å; P1421-W1423 HydrophobicContact CG-CE3 4.17Å; P1421-W1423 HydrophobicContact CG-CZ3 3.76Å; P1421-W1423 PolarHBondContact O-N 3.2Å; P1421-W1423 VanDerWaalsContact O-N 3.17Å; P1421-Y1454 WeakPolarHBondContact CD-O 3.47Å; P1421-F1456 HydrophobicContact CB-CD2 4.36Å; P1421-F1456 HydrophobicContact CB-CE2 3.79Å; P1421-F1456 HydrophobicContact CG-CD2 4.37Å; P1421-F1456 HydrophobicContact CG-CE2 3.88Å
1422	T	49.9	Very low	59.6	Low	117 Å²	117	95 Å²	95	72%	0.718	48%	0.476	S	S	*	.			trans	-80.1	102	-172.6	52.8	0	0	0	0	112.7
1423	W	50.3	Low	59.2	Low	210 Å²	210	99.8 Å²	99.8	80%	0.795	50%	0.502	S	S	*	.			trans	-119.4	121.3	160.7	-68.6	-64.9	0	0	0	110.4	P1421 G1425	P1421-W1423 HydrophobicContact CB-CE3 4.24Å; P1421-W1423 HydrophobicContact CB-CH2 4.33Å; P1421-W1423 HydrophobicContact CB-CZ3 3.92Å; P1421-W1423 HydrophobicContact CG-CE3 4.17Å; P1421-W1423 HydrophobicContact CG-CZ3 3.76Å; P1421-W1423 PolarHBondContact O-N 3.2Å; P1421-W1423 VanDerWaalsContact O-N 3.17Å; W1423-G1425 VanDerWaalsContact C-N 3.3Å; W1423-G1425 PolarHBondContact O-N 2.82Å
1424	A	40.5	Very low	58.9	Low	120 Å²	120	95.7 Å²	95.7	99%	0.992	50%	0.496	S	S	*	.	S	Bend	trans	56.7	-41.5	168.6	0	0	0	0	0	121.2
1425	G	50	Low	58.6	Low	32 Å²	32	97.1 Å²	97.1	33%	0.33	50%	0.5	S	S	.	.			trans	-96.7	150.2	-165.5	0	0	0	0	0	116.9	W1423	W1423-G1425 VanDerWaalsContact C-N 3.3Å; W1423-G1425 PolarHBondContact O-N 2.82Å
1426	K	54.5	Low	58.6	Low	146 Å²	146	94.7 Å²	94.7	64%	0.635	49%	0.49	S	S	*	.			trans	-73.1	133.1	162.1	-70.1	172.8	-174.2	154.5	0	110	D1441 D1444	K1426-D1441 HydrophobicContact CB-CB 4.5Å; K1426-D1444 WeakPolarHBondContact CB-OD2 3.45Å; K1426-D1444 PolarHBondContact N-OD2 2.84Å
1427	H	59	Low	58.7	Low	71 Å²	71	90.9 Å²	90.9	33%	0.329	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	159.4	172	56.8	-82.1	0	0	0	110.3	V1438 V1439 F1440	H1427-V1438 HydrophobicContact CB-CG1 4.32Å; H1427-V1439 CarbonylContact C-O 3.33Å; H1427-V1439 WeakPolarHBondContact CA-O 3.4Å; H1427-F1440 HydrophobicContact CB-CD1 4.23Å; H1427-F1440 HydrophobicContact CB-CE1 4.31Å
1428	R	63.6	Low	58.6	Low	191 Å²	191	91.7 Å²	91.7	72%	0.721	48%	0.478	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.8	118.8	164.1	-59.2	-173.2	-166.7	-179.8	7.9	108.6	V1439	R1428-V1439 HydrophobicContact CB-CB 4.5Å; R1428-V1439 PolarHBondContact N-O 2.57Å; R1428-V1439 PolarHBondContact O-N 3.44Å
1429	Q	60.9	Low	58.2	Low	64 Å²	64	93 Å²	93	30%	0.299	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	127.6	164.4	-178.5	165.4	-26.5	0	0	108	W1418 E1431 V1436 E1437	W1418-Q1429 PolarHBondContact O-NE2 2.55Å; Q1429-E1431 HydrophobicContact CG-CG 4.31Å; Q1429-E1431 PolarHBondContact NE2-OE1 3.03Å; Q1429-V1436 HydrophobicContact CG-CG1 3.98Å; Q1429-E1437 CarbonylContact C-O 3.55Å; Q1429-E1437 WeakPolarHBondContact CA-O 3.27Å
1430	I	62.8	Low	57.8	Low	69 Å²	69	90.7 Å²	90.7	35%	0.354	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	118.5	176.2	-58.6	172.5	0	0	0	106.8	T1432 E1437 V1439	I1430-T1432 HydrophobicContact CG2-CG2 3.99Å; I1430-E1437 HydrophobicContact CB-CB 4.18Å; I1430-E1437 PolarHBondContact N-O 3.29Å; I1430-E1437 PolarHBondContact O-N 3.37Å; I1430-V1439 HydrophobicContact CD1-CG2 4.44Å
1431	E	59.2	Low	57.5	Low	96 Å²	96	93 Å²	93	45%	0.449	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	115.2	179.4	-63.1	-176.3	157.8	0	0	109.1	Q1429	Q1429-E1431 HydrophobicContact CG-CG 4.31Å; Q1429-E1431 PolarHBondContact NE2-OE1 3.03Å
1432	T	55.8	Low	57.2	Low	64 Å²	64	98.4 Å²	98.4	39%	0.393	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	113.3	-173	36.6	0	0	0	0	111.3	I1430 G1434 K1435	I1430-T1432 HydrophobicContact CG2-CG2 3.99Å; T1432-G1434 PolarHBondContact O-N 3.13Å; T1432-G1434 VanDerWaalsContact O-N 3.15Å; T1432-K1435 PolarHBondContact N-O 2.78Å; T1432-K1435 VanDerWaalsContact N-O 3.08Å; T1432-K1435 WeakPolarHBondContact O-CB 3.44Å; T1432-K1435 PolarHBondContact O-N 2.78Å
1433	D	55	Low	57.3	Low	180 Å²	180	97.7 Å²	97.7	96%	0.963	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.5	50	161.5	-132	19.8	0	0	0	115
1434	G	56.1	Low	57.4	Low	63 Å²	63	91 Å²	91	65%	0.649	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.3	3.6	-178.7	0	0	0	0	0	115.5	T1432	T1432-G1434 PolarHBondContact O-N 3.13Å; T1432-G1434 VanDerWaalsContact O-N 3.15Å
1435	K	58.1	Low	57.9	Low	96 Å²	96	91 Å²	91	42%	0.417	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	152.9	178	-54	-174.6	-178.2	-174.9	0	112.6	T1432 Y1517	T1432-K1435 PolarHBondContact N-O 2.78Å; T1432-K1435 VanDerWaalsContact N-O 3.08Å; T1432-K1435 WeakPolarHBondContact O-CB 3.44Å; T1432-K1435 PolarHBondContact O-N 2.78Å; K1435-Y1517 PolarHBondContact NZ-OH 2.88Å
1436	V	62.7	Low	57.6	Low	34 Å²	34	96.6 Å²	96.6	21%	0.206	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	104	169.8	-177.6	0	0	0	0	107.5	Q1429 V1438	Q1429-V1436 HydrophobicContact CG-CG1 3.98Å; V1436-V1438 HydrophobicContact CG1-CG2 4.42Å
1437	E	64.4	Low	56.7	Low	92 Å²	92	92.5 Å²	92.5	43%	0.43	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	136.9	174.5	-68.6	171.5	-178.7	0	0	109.5	Q1429 I1430	Q1429-E1437 CarbonylContact C-O 3.55Å; Q1429-E1437 WeakPolarHBondContact CA-O 3.27Å; I1430-E1437 HydrophobicContact CB-CB 4.18Å; I1430-E1437 PolarHBondContact N-O 3.29Å; I1430-E1437 PolarHBondContact O-N 3.37Å
1438	V	63.9	Low	55.7	Low	40 Å²	40	97.8 Å²	97.8	24%	0.242	52%	0.519	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	114.5	177.8	-176.6	0	0	0	0	109.2	V1420 H1427 V1436 F1440	V1420-V1438 HydrophobicContact CG2-CG1 4.11Å; V1420-V1438 HydrophobicContact CG2-CG2 4.17Å; H1427-V1438 HydrophobicContact CB-CG1 4.32Å; V1436-V1438 HydrophobicContact CG1-CG2 4.42Å; V1438-F1440 HydrophobicContact CG1-CE1 4.29Å; V1438-F1440 HydrophobicContact CG1-CE2 3.82Å; V1438-F1440 HydrophobicContact CG1-CZ 3.65Å
1439	V	63.1	Low	54.4	Low	75 Å²	75	94.3 Å²	94.3	46%	0.455	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	127.2	-177.5	-175.1	0	0	0	0	110	H1427 R1428 I1430	H1427-V1439 CarbonylContact C-O 3.33Å; H1427-V1439 WeakPolarHBondContact CA-O 3.4Å; R1428-V1439 HydrophobicContact CB-CB 4.5Å; R1428-V1439 PolarHBondContact N-O 2.57Å; R1428-V1439 PolarHBondContact O-N 3.44Å; I1430-V1439 HydrophobicContact CD1-CG2 4.44Å
1440	F	59.7	Low	53.5	Low	94 Å²	94	95.3 Å²	95.3	41%	0.412	54%	0.542	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	153.5	177.5	-59.9	-86	0	0	0	111.4	H1427 V1438 V1453	H1427-F1440 HydrophobicContact CB-CD1 4.23Å; H1427-F1440 HydrophobicContact CB-CE1 4.31Å; V1438-F1440 HydrophobicContact CG1-CE1 4.29Å; V1438-F1440 HydrophobicContact CG1-CE2 3.82Å; V1438-F1440 HydrophobicContact CG1-CZ 3.65Å; F1440-V1453 HydrophobicContact CE1-CG2 4.41Å; F1440-V1453 HydrophobicContact CZ-CG1 4.1Å; F1440-V1453 HydrophobicContact CZ-CG2 3.82Å
1441	D	58.5	Low	53	Low	70 Å²	70	98.9 Å²	98.9	37%	0.374	56%	0.555	S	S	.	*			trans	-85.1	133.9	177.4	-155.9	-45.5	0	0	0	110.5	K1426 T1443 D1444	K1426-D1441 HydrophobicContact CB-CB 4.5Å; D1441-T1443 PolarHBondContact O-N 3Å; D1441-T1443 PolarHBondContact OD1-OG1 3.19Å; D1441-D1444 PolarHBondContact O-N 3.45Å
1442	E	52.4	Low	52.8	Low	142 Å²	142	98 Å²	98	66%	0.664	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.5	-23.3	-172.1	-170.2	178.6	-152	0	0	113
1443	T	53.3	Low	53.2	Low	102 Å²	102	98.9 Å²	98.9	63%	0.626	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	-17.4	-179.8	50.8	0	0	0	0	115	D1441	D1441-T1443 PolarHBondContact O-N 3Å; D1441-T1443 PolarHBondContact OD1-OG1 3.19Å
1444	D	52.5	Low	53.9	Low	70 Å²	70	93.2 Å²	93.2	37%	0.374	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-5.1	-175.4	-73.5	-17.3	0	0	0	113.5	K1426 D1441	K1426-D1444 WeakPolarHBondContact CB-OD2 3.45Å; K1426-D1444 PolarHBondContact N-OD2 2.84Å; D1441-D1444 PolarHBondContact O-N 3.45Å
1445	L	50	Low	54.7	Low	120 Å²	120	94 Å²	94	63%	0.628	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-6.2	-174.7	-73.5	164.6	0	0	0	115.3
1446	I	43.1	Very low	55.4	Low	149 Å²	149	95.3 Å²	95.3	76%	0.764	52%	0.518	S	S	*	.	S	Bend	trans	-97.7	-7.5	-165	-59.4	175.9	0	0	0	112.8
1447	G	37.4	Very low	55.9	Low	61 Å²	61	95.8 Å²	95.8	63%	0.629	52%	0.523	S	S	*	.	S	Bend	trans	-116.8	107.4	-171.6	0	0	0	0	0	115.4
1448	Q	36.4	Very low	56.1	Low	182 Å²	182	92.1 Å²	92.1	85%	0.85	51%	0.507	S	S	*	.	S	Bend	trans	61.9	123.9	170.4	-58.1	-175.8	-9.5	0	0	116.9
1449	N	37.7	Very low	56.3	Low	118 Å²	118	97.2 Å²	97.2	63%	0.631	53%	0.532	S	S	*	.			trans	53.4	75.5	164.4	-79.6	-49.5	0	0	0	115.3	K1451	N1449-K1451 HydrophobicContact CB-CD 3.94Å; N1449-K1451 HydrophobicContact CB-CG 4.28Å; N1449-K1451 WeakPolarHBondContact O-CG 3.44Å; N1449-K1451 PolarHBondContact O-N 2.72Å; N1449-K1451 VanDerWaalsContact OD1-CE 3.25Å; N1449-K1451 WeakPolarHBondContact OD1-CE 3.34Å; N1449-K1451 PolarHBondContact OD1-NZ 3.2Å; N1449-K1451 VanDerWaalsContact OD1-NZ 3.08Å
1450	G	41.3	Very low	56.7	Low	85 Å²	85	95 Å²	95	88%	0.876	52%	0.52	S	S	*	.			trans	-60.7	99.7	171.1	0	0	0	0	0	111.9
1451	K	51.8	Low	57.1	Low	144 Å²	144	94 Å²	94	63%	0.626	51%	0.514	S	S	*	.			trans	-141.9	119.1	-169.1	-70.5	179.8	-175.2	172.6	0	112.4	N1449	N1449-K1451 HydrophobicContact CB-CD 3.94Å; N1449-K1451 HydrophobicContact CB-CG 4.28Å; N1449-K1451 WeakPolarHBondContact O-CG 3.44Å; N1449-K1451 PolarHBondContact O-N 2.72Å; N1449-K1451 VanDerWaalsContact OD1-CE 3.25Å; N1449-K1451 WeakPolarHBondContact OD1-CE 3.34Å; N1449-K1451 PolarHBondContact OD1-NZ 3.2Å; N1449-K1451 VanDerWaalsContact OD1-NZ 3.08Å
1452	L	56.3	Low	57.6	Low	76 Å²	76	95.1 Å²	95.1	40%	0.398	52%	0.519	S	S	.	.			trans	45	111	141.9	-88.9	160.6	0	0	0	119.5	Y1454 S1491	L1452-Y1454 HydrophobicContact CB-CE2 4.36Å; L1452-Y1454 HydrophobicContact CD2-CD2 4.38Å; L1452-Y1454 HydrophobicContact CD2-CE2 3.57Å; L1452-Y1454 HydrophobicContact CG-CE2 4.37Å; L1452-S1491 VanDerWaalsContact CD2-CB 3.41Å; L1452-S1491 WeakPolarHBondContact CD2-OG 3.43Å
1453	V	62.7	Low	58.3	Low	83 Å²	83	91.6 Å²	91.6	50%	0.503	52%	0.522	S	S	.	.			trans	-104.6	128.5	169.8	-178.6	0	0	0	0	109.7	V1420 F1440	V1420-V1453 HydrophobicContact CG1-CG1 4.27Å; F1440-V1453 HydrophobicContact CE1-CG2 4.41Å; F1440-V1453 HydrophobicContact CZ-CG1 4.1Å; F1440-V1453 HydrophobicContact CZ-CG2 3.82Å
1454	Y	70.2	Confident	58.6	Low	61 Å²	61	92.4 Å²	92.4	24%	0.239	52%	0.522	C	S	.	.			trans	-120.6	155.1	173.2	-79.8	-75.5	0	0	0	111.4	P1421 L1452 P1492 I1495	P1421-Y1454 WeakPolarHBondContact CD-O 3.47Å; L1452-Y1454 HydrophobicContact CB-CE2 4.36Å; L1452-Y1454 HydrophobicContact CD2-CD2 4.38Å; L1452-Y1454 HydrophobicContact CD2-CE2 3.57Å; L1452-Y1454 HydrophobicContact CG-CE2 4.37Å; Y1454-P1492 WeakPolarHBondContact CE1-O 3.23Å; Y1454-P1492 WeakPolarHBondContact OH-CD 3.27Å; Y1454-P1492 PolarHBondContact OH-O 3.02Å; Y1454-P1492 VanDerWaalsContact OH-O 3.12Å; Y1454-I1495 HydrophobicContact CD1-CD1 4.44Å; Y1454-I1495 HydrophobicContact CE1-CD1 3.74Å; Y1454-I1495 HydrophobicContact CE1-CG1 4.09Å; Y1454-I1495 HydrophobicContact CE2-CD1 4.31Å
1455	L	72.8	Confident	59.3	Low	81 Å²	81	93.8 Å²	93.8	42%	0.424	52%	0.522	S	S	.	.			trans	-112.3	122.8	172.3	-64.3	174.1	0	0	0	110.3	W1418 V1420	W1418-L1455 HydrophobicContact CE3-CB 3.92Å; W1418-L1455 HydrophobicContact CZ3-CB 4.42Å; V1420-L1455 HydrophobicContact CG2-CD2 3.77Å
1456	F	73.8	Confident	59.8	Low	122 Å²	122	91.2 Å²	91.2	54%	0.535	51%	0.509	S	S	.	.	B	Isolated β-bridge	trans	-82.8	132	173.8	-78.2	-105	0	0	0	110.3	W1418 K1419 P1421	W1418-F1456 WeakPolarHBondContact CA-O 3.48Å; K1419-F1456 PolarHBondContact N-O 3.46Å; K1419-F1456 PolarHBondContact O-N 2.99Å; P1421-F1456 HydrophobicContact CB-CD2 4.36Å; P1421-F1456 HydrophobicContact CB-CE2 3.79Å; P1421-F1456 HydrophobicContact CG-CD2 4.37Å; P1421-F1456 HydrophobicContact CG-CE2 3.88Å
1457	S	71.6	Confident	60.7	Low	44 Å²	44	87.3 Å²	87.3	31%	0.308	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-77.8	150.7	-177.8	56.3	0	0	0	0	113.5
1458	P	70.1	Confident	61.7	Low	15 Å²	15	85.6 Å²	85.6	10%	0.097	47%	0.467	C	S	.	.	P	Polyproline II helix	trans	-76.3	168.3	177.6	30.3	-33.9	0	0	0	112.5	Y1416 W1418 S1460 Y1461	Y1416-P1458 WeakPolarHBondContact O-CB 3.33Å; Y1416-P1458 VanDerWaalsContact O-CG 3.29Å; Y1416-P1458 WeakPolarHBondContact O-CG 3.33Å; W1418-P1458 VanDerWaalsContact CE2-CD 3.48Å; W1418-P1458 HydrophobicContact CG-CG 4.47Å; W1418-P1458 VanDerWaalsContact NE1-CD 3.35Å; P1458-S1460 PolarHBondContact O-N 2.78Å; P1458-Y1461 HydrophobicContact CG-CD2 3.88Å; P1458-Y1461 HydrophobicContact CG-CE2 4.1Å; P1458-Y1461 PolarHBondContact O-N 3.4Å
1459	I	68.4	Low	62.6	Low	147 Å²	147	83.2 Å²	83.2	75%	0.754	45%	0.451	S	S	*	.	G	3₁₀ helix	trans	-60.5	-20.5	-171.5	-158.4	167.4	0	0	0	114.2	Y1461 L1462	I1459-Y1461 VanDerWaalsContact C-N 3.26Å; I1459-Y1461 PolarHBondContact O-N 2.85Å; I1459-L1462 PolarHBondContact O-N 3.29Å; I1459-L1462 VanDerWaalsContact O-N 3.16Å
1460	S	69.8	Low	63.4	Low	29 Å²	29	78.2 Å²	78.2	20%	0.203	43%	0.428	C	S	.	.	G	3₁₀ helix	trans	-62.3	-25.5	172.2	35.6	0	0	0	0	113.9	D1414 P1458 R1465	D1414-S1460 WeakPolarHBondContact OD2-CB 3.17Å; D1414-S1460 PolarHBondContact OD2-OG 3.25Å; P1458-S1460 PolarHBondContact O-N 2.78Å; S1460-R1465 PolarHBondContact O-NH2 2.89Å
1461	Y	69	Low	64.2	Low	72 Å²	72	74.2 Å²	74.2	28%	0.282	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-94.1	-9	174.2	-65.4	-99.1	0	0	0	113.1	I1412 D1414 W1418 P1458 I1459	I1412-Y1461 HydrophobicContact CG2-CD1 4.48Å; I1412-Y1461 HydrophobicContact CG2-CE1 4Å; I1412-Y1461 HydrophobicContact CG2-CE2 4.2Å; D1414-Y1461 HydrophobicContact CB-CE2 4.39Å; D1414-Y1461 PolarHBondContact N-OH 3.12Å; D1414-Y1461 VanDerWaalsContact O-CE2 3.3Å; D1414-Y1461 WeakPolarHBondContact O-CE2 3.48Å; W1418-Y1461 HydrophobicContact CZ2-CD2 4.36Å; W1418-Y1461 HydrophobicContact CZ2-CE2 4.1Å; P1458-Y1461 HydrophobicContact CG-CD2 3.88Å; P1458-Y1461 HydrophobicContact CG-CE2 4.1Å; P1458-Y1461 PolarHBondContact O-N 3.4Å; I1459-Y1461 VanDerWaalsContact C-N 3.26Å; I1459-Y1461 PolarHBondContact O-N 2.85Å
1462	L	68.9	Low	64.6	Low	94 Å²	94	74.5 Å²	74.5	49%	0.492	38%	0.384	S	S	.	.			trans	-99.2	158.6	-172.5	-56.1	179.9	0	0	0	112.9	I1459 R1465	I1459-L1462 PolarHBondContact O-N 3.29Å; I1459-L1462 VanDerWaalsContact O-N 3.16Å; L1462-R1465 VanDerWaalsContact O-CZ 3.24Å; L1462-R1465 PolarHBondContact O-NH1 3.38Å; L1462-R1465 PolarHBondContact O-NH2 3.14Å
1463	G	66.1	Low	65.1	Low	69 Å²	69	73.4 Å²	73.4	71%	0.711	38%	0.378	S	S	*	.	S	Bend	trans	108.3	-159.4	177	0	0	0	0	0	113.1	R1465	G1463-R1465 PolarHBondContact O-N 2.95Å
1464	N	59.6	Low	65.4	Low	119 Å²	119	75.6 Å²	75.6	64%	0.636	38%	0.383	S	S	*	.			trans	-69.2	127	172	-173.4	-5	0	0	0	109.5	L1466	N1464-L1466 WeakPolarHBondContact OD1-CB 3.42Å; N1464-L1466 WeakPolarHBondContact OD1-CG 3.33Å; N1464-L1466 PolarHBondContact OD1-N 3.42Å
1465	R	67.4	Low	65.3	Low	99 Å²	99	75.5 Å²	75.5	37%	0.374	38%	0.382	S	S	.	.			trans	-134.1	29.8	179.9	-68.3	-66.9	179.4	-82.5	-2.7	112.1	S1460 L1462 G1463 L1467 S1468	S1460-R1465 PolarHBondContact O-NH2 2.89Å; L1462-R1465 VanDerWaalsContact O-CZ 3.24Å; L1462-R1465 PolarHBondContact O-NH1 3.38Å; L1462-R1465 PolarHBondContact O-NH2 3.14Å; G1463-R1465 PolarHBondContact O-N 2.95Å; R1465-L1467 VanDerWaalsContact C-N 3.26Å; R1465-L1467 PolarHBondContact O-N 3.49Å; R1465-S1468 WeakPolarHBondContact O-CA 3.44Å; R1465-S1468 WeakPolarHBondContact O-CB 3.4Å; R1465-S1468 PolarHBondContact O-N 2.74Å
1466	L	60.8	Low	65	Low	66 Å²	66	78.2 Å²	78.2	35%	0.346	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-57.7	-36.3	176.2	-80.6	165.9	0	0	0	112.9	F1396 N1464 S1468 Y1469 E1563	F1396-L1466 HydrophobicContact CE2-CD1 4.23Å; F1396-L1466 HydrophobicContact CE2-CD2 3.95Å; F1396-L1466 HydrophobicContact CZ-CD1 4.1Å; F1396-L1466 HydrophobicContact CZ-CD2 3.82Å; N1464-L1466 WeakPolarHBondContact OD1-CB 3.42Å; N1464-L1466 WeakPolarHBondContact OD1-CG 3.33Å; N1464-L1466 PolarHBondContact OD1-N 3.42Å; L1466-S1468 PolarHBondContact O-N 2.77Å; L1466-S1468 VanDerWaalsContact O-N 3.08Å; L1466-Y1469 VanDerWaalsContact O-CB 3.25Å; L1466-Y1469 WeakPolarHBondContact O-CB 2.99Å; L1466-Y1469 PolarHBondContact O-N 3.42Å; L1466-Y1469 VanDerWaalsContact O-N 3.1Å; L1466-E1563 HydrophobicContact CD1-CG 4.25Å
1467	L	62.2	Low	64.6	Low	66 Å²	66	75.7 Å²	75.7	35%	0.346	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-70.8	3.8	173.1	-59.6	176.8	0	0	0	114.3	R1465 S1532 A1533	R1465-L1467 VanDerWaalsContact C-N 3.26Å; R1465-L1467 PolarHBondContact O-N 3.49Å; L1467-S1532 PolarHBondContact O-OG 2.94Å; L1467-A1533 HydrophobicContact CD2-CB 4.43Å; L1467-A1533 PolarHBondContact O-N 3.17Å
1468	S	59.7	Low	64.3	Low	26 Å²	26	77.1 Å²	77.1	18%	0.182	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-113.4	7	172.8	-47.9	0	0	0	0	112.7	R1465 L1466 G1471	R1465-S1468 WeakPolarHBondContact O-CA 3.44Å; R1465-S1468 WeakPolarHBondContact O-CB 3.4Å; R1465-S1468 PolarHBondContact O-N 2.74Å; L1466-S1468 PolarHBondContact O-N 2.77Å; L1466-S1468 VanDerWaalsContact O-N 3.08Å; S1468-G1471 WeakPolarHBondContact O-CA 3.02Å; S1468-G1471 PolarHBondContact O-N 3.03Å; S1468-G1471 VanDerWaalsContact O-N 3.07Å
1469	Y	54.9	Low	63.7	Low	131 Å²	131	79.6 Å²	79.6	51%	0.514	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	143	170.3	-170.1	-101.7	0	0	0	110.4	L1466 G1471	L1466-Y1469 VanDerWaalsContact O-CB 3.25Å; L1466-Y1469 WeakPolarHBondContact O-CB 2.99Å; L1466-Y1469 PolarHBondContact O-N 3.42Å; L1466-Y1469 VanDerWaalsContact O-N 3.1Å; Y1469-G1471 PolarHBondContact O-N 3.18Å
1470	G	53.9	Low	63.3	Low	13 Å²	13	80 Å²	80	13%	0.134	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.8	2.1	-165	0	0	0	0	0	114.3	L1524 M1530	G1470-L1524 VanDerWaalsContact CA-O 3.24Å; G1470-L1524 WeakPolarHBondContact CA-O 3.46Å; G1470-L1524 PolarHBondContact N-O 2.98Å; G1470-L1524 VanDerWaalsContact N-O 3.11Å; G1470-M1530 VanDerWaalsContact O-CA 3.26Å; G1470-M1530 WeakPolarHBondContact O-CA 3.33Å; G1470-M1530 VanDerWaalsContact O-CB 3.29Å; G1470-M1530 WeakPolarHBondContact O-CB 3.33Å; G1470-M1530 PolarHBondContact O-N 2.6Å
1471	G	58.3	Low	62.6	Low	2 Å²	2	81.3 Å²	81.3	2%	0.021	42%	0.422	C	S	.	.			trans	-64.5	172.9	-172.2	0	0	0	0	0	117.2	S1468 Y1469 T1523 L1524 M1530	S1468-G1471 WeakPolarHBondContact O-CA 3.02Å; S1468-G1471 PolarHBondContact O-N 3.03Å; S1468-G1471 VanDerWaalsContact O-N 3.07Å; Y1469-G1471 PolarHBondContact O-N 3.18Å; G1471-T1523 CarbonylContact O-C 3.4Å; G1471-T1523 VanDerWaalsContact O-CA 3.28Å; G1471-T1523 WeakPolarHBondContact O-CA 3.38Å; G1471-T1523 WeakPolarHBondContact O-CG2 3.39Å; G1471-L1524 PolarHBondContact O-N 2.84Å; G1471-M1530 WeakPolarHBondContact CA-SD 3.41Å
1472	R	60.8	Low	61.8	Low	149 Å²	149	81.3 Å²	81.3	56%	0.562	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.8	148.1	164.7	-65.4	-172.7	-168.5	-173	5.4	110.9	T1522 T1523 M1530	R1472-T1522 CarbonylContact C-O 3.56Å; R1472-T1522 WeakPolarHBondContact CA-O 3.01Å; R1472-T1523 HydrophobicContact CG-CG2 3.98Å; R1472-M1530 HydrophobicContact CB-CE 3.83Å; R1472-M1530 HydrophobicContact CB-SD 4.48Å; R1472-M1530 HydrophobicContact CG-CB 4.31Å; R1472-M1530 HydrophobicContact CG-CE 4.3Å; R1472-M1530 PolarHBondContact N-SD 3.01Å
1473	I	67	Low	60.9	Low	54 Å²	54	83.9 Å²	83.9	28%	0.277	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	131.8	169	-62.2	173.5	0	0	0	107.3	Y1475 L1494 M1496 T1522 L1524	I1473-Y1475 HydrophobicContact CG2-CD1 4.15Å; I1473-Y1475 HydrophobicContact CG2-CE1 4.46Å; I1473-L1494 HydrophobicContact CD1-CD2 3.79Å; I1473-L1494 HydrophobicContact CG2-CD2 4.41Å; I1473-M1496 HydrophobicContact CD1-SD 4.35Å; I1473-T1522 HydrophobicContact CB-CG2 3.89Å; I1473-T1522 PolarHBondContact N-O 2.89Å; I1473-T1522 PolarHBondContact O-N 2.9Å; I1473-L1524 HydrophobicContact CD1-CD1 4.39Å; I1473-L1524 HydrophobicContact CD1-CD2 3.99Å; I1473-L1524 HydrophobicContact CD1-CG 4.44Å
1474	E	67.3	Low	60.1	Low	129 Å²	129	89.8 Å²	89.8	60%	0.603	46%	0.455	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.5	132.5	-178.1	175.5	168.5	-141	0	0	109.4	I1520 Q1521	E1474-I1520 WeakPolarHBondContact CA-O 3.04Å; E1474-Q1521 HydrophobicContact CB-CG 4.34Å; E1474-Q1521 HydrophobicContact CG-CG 4.01Å; E1474-Q1521 PolarHBondContact OE1-NE2 2.93Å
1475	Y	69.7	Low	59.3	Low	58 Å²	58	93.5 Å²	93.5	23%	0.227	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	159.9	178.5	59.2	-75.9	0	0	0	111.7	I1473 V1477 D1493 I1520	I1473-Y1475 HydrophobicContact CG2-CD1 4.15Å; I1473-Y1475 HydrophobicContact CG2-CE1 4.46Å; Y1475-V1477 HydrophobicContact CD2-CG2 3.87Å; Y1475-V1477 HydrophobicContact CE2-CG2 4.04Å; Y1475-D1493 WeakPolarHBondContact OH-CB 3.17Å; Y1475-I1520 HydrophobicContact CD1-CB 4.21Å; Y1475-I1520 HydrophobicContact CD1-CG2 4.36Å; Y1475-I1520 HydrophobicContact CD2-CB 4.4Å; Y1475-I1520 HydrophobicContact CD2-CD1 4.46Å; Y1475-I1520 HydrophobicContact CE1-CB 3.81Å; Y1475-I1520 HydrophobicContact CE1-CG2 3.56Å; Y1475-I1520 HydrophobicContact CE2-CB 4.03Å; Y1475-I1520 HydrophobicContact CE2-CD1 3.62Å; Y1475-I1520 HydrophobicContact CE2-CG1 4.35Å; Y1475-I1520 HydrophobicContact CE2-CG2 4.37Å; Y1475-I1520 HydrophobicContact CG-CB 4.49Å; Y1475-I1520 PolarHBondContact N-O 3.31Å; Y1475-I1520 PolarHBondContact O-N 3.22Å
1476	M	66.2	Low	58.2	Low	139 Å²	139	92.5 Å²	92.5	69%	0.685	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.4	138.6	179.7	-67.6	178.5	-74	0	0	110.9	F1518	M1476-F1518 CarbonylContact C-O 3.6Å; M1476-F1518 VanDerWaalsContact CA-O 3.26Å; M1476-F1518 WeakPolarHBondContact CA-O 3.39Å
1477	V	65.1	Low	57.4	Low	69 Å²	69	94 Å²	94	42%	0.418	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	146.9	-179.6	-173	0	0	0	0	110.3	Y1475 F1518	Y1475-V1477 HydrophobicContact CD2-CG2 3.87Å; Y1475-V1477 HydrophobicContact CE2-CG2 4.04Å; V1477-F1518 PolarHBondContact N-O 2.04Å; V1477-F1518 PolarHBondContact O-N 3Å
1478	M	65.5	Low	56.8	Low	73 Å²	73	95 Å²	95	36%	0.36	50%	0.504	S	S	.	.			trans	-144.8	136.3	171.8	172.4	177.9	-80.2	0	0	107.8	M1480 Y1517	M1478-M1480 HydrophobicContact SD-CE 3.81Å; M1478-Y1517 HydrophobicContact CE-CD1 4.11Å; M1478-Y1517 HydrophobicContact CE-CD2 3.52Å; M1478-Y1517 HydrophobicContact CE-CE1 4.03Å; M1478-Y1517 HydrophobicContact CE-CE2 3.4Å; M1478-Y1517 HydrophobicContact CE-CG 3.88Å
1479	A	57.4	Low	56.3	Low	67 Å²	67	97.2 Å²	97.2	55%	0.554	52%	0.516	S	S	*	.			trans	-138.6	126.8	-178.8	0	0	0	0	0	110.9
1480	M	59.7	Low	56.3	Low	157 Å²	157	94.8 Å²	94.8	77%	0.773	52%	0.515	S	S	*	.			trans	-110	108.7	179.3	-63.6	178.7	-178	0	0	109.3	M1478	M1478-M1480 HydrophobicContact SD-CE 3.81Å
1481	P	54.6	Low	56.6	Low	56 Å²	56	95.1 Å²	95.1	36%	0.364	52%	0.515	S	S	.	.			trans	-74.3	151.4	176.5	32.3	-35.6	0	0	0	111.1	F1514	P1481-F1514 HydrophobicContact CG-CB 4.3Å; P1481-F1514 HydrophobicContact CG-CD1 3.67Å; P1481-F1514 HydrophobicContact CG-CD2 4.08Å; P1481-F1514 HydrophobicContact CG-CE1 3.9Å; P1481-F1514 HydrophobicContact CG-CE2 4.3Å; P1481-F1514 HydrophobicContact CG-CG 3.76Å; P1481-F1514 HydrophobicContact CG-CZ 4.21Å
1482	A	52.4	Low	57	Low	72 Å²	72	95.6 Å²	95.6	60%	0.595	52%	0.518	S	S	*	.	S	Bend	trans	-79.8	-20.1	178.6	0	0	0	0	0	113.8
1483	Q	51.4	Low	57.5	Low	148 Å²	148	90.6 Å²	90.6	69%	0.692	50%	0.502	S	S	*	.	S	Bend	trans	-146.8	153	-176.7	-62.3	-175.3	-0.3	0	0	110.5	E1485	Q1483-E1485 VanDerWaalsContact C-N 3.3Å; Q1483-E1485 PolarHBondContact O-N 2.82Å; Q1483-E1485 VanDerWaalsContact O-N 3.15Å
1484	E	48.8	Very low	57.9	Low	193 Å²	193	89.8 Å²	89.8	90%	0.902	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-7.1	-162.1	-62.6	-177.4	129.9	0	0	116.4
1485	E	41.6	Very low	58.1	Low	197 Å²	197	85.8 Å²	85.8	92%	0.921	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.8	16.9	-165.8	-60.3	-170.5	136.3	0	0	115.7	Q1483	Q1483-E1485 VanDerWaalsContact C-N 3.3Å; Q1483-E1485 PolarHBondContact O-N 2.82Å; Q1483-E1485 VanDerWaalsContact O-N 3.15Å
1486	S	45.3	Very low	58.3	Low	77 Å²	77	85.9 Å²	85.9	54%	0.538	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-94.8	122.2	-176	-63.5	0	0	0	0	114.1
1487	A	43.4	Very low	58.3	Low	98 Å²	98	88.4 Å²	88.4	81%	0.81	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-79	147.9	179.8	0	0	0	0	0	113.9
1488	I	50.3	Low	58	Low	88 Å²	88	87.3 Å²	87.3	45%	0.451	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-74.2	140.9	174.8	-59	173.7	0	0	0	109.6	P1511	I1488-P1511 HydrophobicContact CD1-CG 4.33Å
1489	T	48.3	Very low	57.3	Low	71 Å²	71	89.5 Å²	89.5	44%	0.436	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-80.2	138.7	-174.8	51.9	0	0	0	0	113.2	S1491	T1489-S1491 PolarHBondContact O-N 3.21Å; T1489-S1491 PolarHBondContact O-OG 3.27Å; T1489-S1491 VanDerWaalsContact O-OG 3.12Å; T1489-S1491 PolarHBondContact OG1-OG 2.72Å; T1489-S1491 VanDerWaalsContact OG1-OG 3.12Å
1490	V	54.9	Low	57.2	Low	80 Å²	80	94.7 Å²	94.7	49%	0.485	52%	0.52	S	S	.	.			trans	-78.3	86.8	176.5	-169.1	0	0	0	0	109.4	F987 W1506	F987-V1490 HydrophobicContact CD1-CB 4.47Å; F987-V1490 HydrophobicContact CD1-CG2 3.81Å; F987-V1490 HydrophobicContact CE1-CB 4.34Å; F987-V1490 HydrophobicContact CE1-CG2 3.99Å; V1490-W1506 HydrophobicContact CG1-CZ3 4.24Å
1491	S	61.7	Low	56.3	Low	20 Å²	20	93.1 Å²	93.1	14%	0.14	51%	0.512	C	S	.	.			trans	-150.3	145.9	-168.7	48.1	0	0	0	0	112.1	L1452 T1489 D1493	L1452-S1491 VanDerWaalsContact CD2-CB 3.41Å; L1452-S1491 WeakPolarHBondContact CD2-OG 3.43Å; T1489-S1491 PolarHBondContact O-N 3.21Å; T1489-S1491 PolarHBondContact O-OG 3.27Å; T1489-S1491 VanDerWaalsContact O-OG 3.12Å; T1489-S1491 PolarHBondContact OG1-OG 2.72Å; T1489-S1491 VanDerWaalsContact OG1-OG 3.12Å; S1491-D1493 PolarHBondContact O-N 3.04Å
1492	P	66.5	Low	56.3	Low	13 Å²	13	93.9 Å²	93.9	8%	0.084	52%	0.519	C	S	.	.			trans	-67	128.6	-177.1	26.4	-32.7	0	0	0	111.7	Y1454 L1494 I1495 E1504 Y1505 W1506	Y1454-P1492 WeakPolarHBondContact CE1-O 3.23Å; Y1454-P1492 WeakPolarHBondContact OH-CD 3.27Å; Y1454-P1492 PolarHBondContact OH-O 3.02Å; Y1454-P1492 VanDerWaalsContact OH-O 3.12Å; P1492-L1494 VanDerWaalsContact C-N 3.3Å; P1492-L1494 PolarHBondContact O-N 2.98Å; P1492-I1495 HydrophobicContact CB-CG1 4.39Å; P1492-I1495 HydrophobicContact CG-CD1 4.04Å; P1492-I1495 HydrophobicContact CG-CG1 3.97Å; P1492-E1504 HydrophobicContact CB-CB 4Å; P1492-E1504 HydrophobicContact CB-CG 4.48Å; P1492-E1504 HydrophobicContact CG-CB 4.44Å; P1492-E1504 HydrophobicContact CG-CG 4.42Å; P1492-Y1505 CarbonylContact C-O 3.24Å; P1492-Y1505 WeakPolarHBondContact CA-O 3.2Å; P1492-Y1505 WeakPolarHBondContact CB-O 3.24Å; P1492-W1506 HydrophobicContact CB-CD2 4.01Å; P1492-W1506 HydrophobicContact CB-CG 4.37Å; P1492-W1506 HydrophobicContact CB-CZ2 4.03Å; P1492-W1506 HydrophobicContact CG-CH2 4.48Å; P1492-W1506 HydrophobicContact CG-CZ2 4.07Å
1493	D	70.4	Confident	56.6	Low	44 Å²	44	95.5 Å²	95.5	24%	0.235	52%	0.517	C	S	.	.	S	Bend	trans	-69.1	-28.4	-175.8	-48.1	-91.4	0	0	0	112.8	Y1475 S1491 Y1505 S1507 Q1510 I1520	Y1475-D1493 WeakPolarHBondContact OH-CB 3.17Å; S1491-D1493 PolarHBondContact O-N 3.04Å; D1493-Y1505 PolarHBondContact N-O 3.15Å; D1493-S1507 PolarHBondContact OD2-N 3.46Å; D1493-Q1510 PolarHBondContact OD1-NE2 3.18Å; D1493-I1520 HydrophobicContact CB-CD1 4.17Å
1494	L	74.6	Confident	57.4	Low	37 Å²	37	92.8 Å²	92.8	19%	0.194	50%	0.504	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	131.2	177.7	174.1	70.3	0	0	0	110.9	I1473 P1492 M1496 E1504 Y1505 T1522	I1473-L1494 HydrophobicContact CD1-CD2 3.79Å; I1473-L1494 HydrophobicContact CG2-CD2 4.41Å; P1492-L1494 VanDerWaalsContact C-N 3.3Å; P1492-L1494 PolarHBondContact O-N 2.98Å; L1494-M1496 HydrophobicContact CG-CG 4.47Å; L1494-E1504 WeakPolarHBondContact O-CA 3.25Å; L1494-Y1505 PolarHBondContact N-O 2.82Å; L1494-Y1505 PolarHBondContact O-N 2.76Å; L1494-T1522 HydrophobicContact CD2-CG2 4.07Å
1495	I	73.5	Confident	58.4	Low	45 Å²	45	86.4 Å²	86.4	23%	0.231	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	117.9	175.5	-51.4	177.7	0	0	0	109.6	Y1454 P1492 R1497 E1504	Y1454-I1495 HydrophobicContact CD1-CD1 4.44Å; Y1454-I1495 HydrophobicContact CE1-CD1 3.74Å; Y1454-I1495 HydrophobicContact CE1-CG1 4.09Å; Y1454-I1495 HydrophobicContact CE2-CD1 4.31Å; P1492-I1495 HydrophobicContact CB-CG1 4.39Å; P1492-I1495 HydrophobicContact CG-CD1 4.04Å; P1492-I1495 HydrophobicContact CG-CG1 3.97Å; I1495-R1497 HydrophobicContact CG2-CG 4Å; I1495-E1504 HydrophobicContact CG1-CG 4.42Å; I1495-E1504 HydrophobicContact CG2-CG 4.32Å
1496	M	72.7	Confident	59.8	Low	60 Å²	60	83.2 Å²	83.2	30%	0.296	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	140.6	170.5	-62.3	178	-68.4	0	0	109.7	I1473 L1494 S1502 I1503 L1524	I1473-M1496 HydrophobicContact CD1-SD 4.35Å; L1494-M1496 HydrophobicContact CG-CG 4.47Å; M1496-S1502 CarbonylContact O-C 3.38Å; M1496-S1502 VanDerWaalsContact O-CA 3.29Å; M1496-S1502 WeakPolarHBondContact O-CA 3.08Å; M1496-I1503 HydrophobicContact CB-CB 4.4Å; M1496-I1503 HydrophobicContact CE-CB 3.95Å; M1496-I1503 HydrophobicContact CE-CD1 4.49Å; M1496-I1503 HydrophobicContact CE-CG2 3.73Å; M1496-I1503 PolarHBondContact N-O 3.39Å; M1496-I1503 PolarHBondContact O-N 3.3Å; M1496-L1524 HydrophobicContact CE-CD2 3.61Å; M1496-L1524 HydrophobicContact SD-CD2 3.77Å
1497	R	67.1	Low	60.7	Low	192 Å²	192	80.7 Å²	80.7	73%	0.725	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.4	131.2	-177.7	-62.1	-174.7	176	174.3	-1.2	111.2	I1495	I1495-R1497 HydrophobicContact CG2-CG 4Å
1498	G	58.6	Low	61.3	Low	46 Å²	46	85.1 Å²	85.1	47%	0.474	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.2	148.6	179.8	0	0	0	0	0	112.9	N1500 M1501	G1498-N1500 VanDerWaalsContact C-N 3.28Å; G1498-N1500 PolarHBondContact O-N 3.47Å; G1498-N1500 VanDerWaalsContact O-N 3.17Å; G1498-M1501 PolarHBondContact N-O 3.32Å; G1498-M1501 PolarHBondContact O-N 3.08Å; G1498-M1501 VanDerWaalsContact O-O 3.11Å
1499	N	50.4	Low	61.7	Low	118 Å²	118	85.9 Å²	85.9	63%	0.631	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.3	44.4	176.9	-159.8	47.3	0	0	0	115	M1501	N1499-M1501 PolarHBondContact O-N 2.73Å
1500	N	54.2	Low	62	Low	176 Å²	176	86.4 Å²	86.4	94%	0.941	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	62	19.2	-176.6	-147.7	59.6	0	0	0	115.8	G1498	G1498-N1500 VanDerWaalsContact C-N 3.28Å; G1498-N1500 PolarHBondContact O-N 3.47Å; G1498-N1500 VanDerWaalsContact O-N 3.17Å
1501	M	42.2	Very low	62.1	Low	124 Å²	124	84.5 Å²	84.5	61%	0.611	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.4	155.5	172.5	-58.6	-176.5	-64.6	0	0	110.8	G1498 N1499	G1498-M1501 PolarHBondContact N-O 3.32Å; G1498-M1501 PolarHBondContact O-N 3.08Å; G1498-M1501 VanDerWaalsContact O-O 3.11Å; N1499-M1501 PolarHBondContact O-N 2.73Å
1502	S	53.4	Low	61.5	Low	72 Å²	72	89.6 Å²	89.6	50%	0.503	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	138.5	170.1	45	0	0	0	0	110.1	M1496	M1496-S1502 CarbonylContact O-C 3.38Å; M1496-S1502 VanDerWaalsContact O-CA 3.29Å; M1496-S1502 WeakPolarHBondContact O-CA 3.08Å
1503	I	59.4	Low	61	Low	107 Å²	107	91.8 Å²	91.8	55%	0.549	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	127.7	176	-55.6	173.4	0	0	0	106.8	M1496	M1496-I1503 HydrophobicContact CB-CB 4.4Å; M1496-I1503 HydrophobicContact CE-CB 3.95Å; M1496-I1503 HydrophobicContact CE-CD1 4.49Å; M1496-I1503 HydrophobicContact CE-CG2 3.73Å; M1496-I1503 PolarHBondContact N-O 3.39Å; M1496-I1503 PolarHBondContact O-N 3.3Å
1504	E	68.1	Low	60.3	Low	91 Å²	91	94.4 Å²	94.4	43%	0.425	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	137.9	-174.5	-64	179.8	178.3	0	0	109.3	P1492 L1494 I1495	P1492-E1504 HydrophobicContact CB-CB 4Å; P1492-E1504 HydrophobicContact CB-CG 4.48Å; P1492-E1504 HydrophobicContact CG-CB 4.44Å; P1492-E1504 HydrophobicContact CG-CG 4.42Å; L1494-E1504 WeakPolarHBondContact O-CA 3.25Å; I1495-E1504 HydrophobicContact CG1-CG 4.42Å; I1495-E1504 HydrophobicContact CG2-CG 4.32Å
1505	Y	69.9	Low	59.5	Low	58 Å²	58	101.2 Å²	101.2	23%	0.227	52%	0.521	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	139	174.5	169.7	-92.5	0	0	0	109.8	P1492 D1493 L1494 I1520 T1522	P1492-Y1505 CarbonylContact C-O 3.24Å; P1492-Y1505 WeakPolarHBondContact CA-O 3.2Å; P1492-Y1505 WeakPolarHBondContact CB-O 3.24Å; D1493-Y1505 PolarHBondContact N-O 3.15Å; L1494-Y1505 PolarHBondContact N-O 2.82Å; L1494-Y1505 PolarHBondContact O-N 2.76Å; Y1505-I1520 HydrophobicContact CD1-CG2 4.49Å; Y1505-I1520 HydrophobicContact CE1-CG2 3.63Å; Y1505-T1522 HydrophobicContact CD1-CG2 4.31Å; Y1505-T1522 WeakPolarHBondContact CD2-OG1 3.36Å; Y1505-T1522 WeakPolarHBondContact CE2-OG1 3.21Å; Y1505-T1522 HydrophobicContact CG-CG2 4.31Å
1506	W	71.1	Confident	58.8	Low	131 Å²	131	101 Å²	101	50%	0.496	52%	0.524	S	S	.	.			trans	-126.8	125.2	-177.2	-57.8	75.4	0	0	0	107.2	V1490 P1492	V1490-W1506 HydrophobicContact CG1-CZ3 4.24Å; P1492-W1506 HydrophobicContact CB-CD2 4.01Å; P1492-W1506 HydrophobicContact CB-CG 4.37Å; P1492-W1506 HydrophobicContact CB-CZ2 4.03Å; P1492-W1506 HydrophobicContact CG-CH2 4.48Å; P1492-W1506 HydrophobicContact CG-CZ2 4.07Å
1507	S	64.1	Low	58.4	Low	24 Å²	24	104.5 Å²	104.5	17%	0.168	54%	0.535	C	S	.	.			trans	-80.7	128.4	178.3	-155.3	0	0	0	0	111.1	D1493 N1509	D1493-S1507 PolarHBondContact OD2-N 3.46Å; S1507-N1509 WeakPolarHBondContact CB-O 3.04Å; S1507-N1509 PolarHBondContact O-N 2.8Å; S1507-N1509 VanDerWaalsContact O-N 3.1Å; S1507-N1509 PolarHBondContact OG-O 2.96Å
1508	E	56.1	Low	58.2	Low	190 Å²	190	97 Å²	97	89%	0.888	51%	0.507	S	S	*	.	S	Bend	trans	-61.9	-14.8	175.9	-63.9	-177.9	159	0	0	113.3
1509	N	58.1	Low	58.5	Low	105 Å²	105	97.8 Å²	97.8	56%	0.561	51%	0.505	S	S	*	.			trans	-122.8	146	176.3	-67.9	-101.4	0	0	0	108.5	S1507 F1518	S1507-N1509 WeakPolarHBondContact CB-O 3.04Å; S1507-N1509 PolarHBondContact O-N 2.8Å; S1507-N1509 VanDerWaalsContact O-N 3.1Å; S1507-N1509 PolarHBondContact OG-O 2.96Å; N1509-F1518 HydrophobicContact CB-CE2 4.01Å; N1509-F1518 HydrophobicContact CB-CZ 3.79Å; N1509-F1518 VanDerWaalsContact O-CE1 3.29Å; N1509-F1518 WeakPolarHBondContact O-CE1 3.44Å; N1509-F1518 WeakPolarHBondContact O-CZ 3.31Å
1510	Q	55.3	Low	59.2	Low	82 Å²	82	92.3 Å²	92.3	38%	0.383	48%	0.476	S	S	.	.			trans	-126.7	153.2	166.9	-73.5	-69	-27.7	0	0	107.6	D1493 S1512	D1493-Q1510 PolarHBondContact OD1-NE2 3.18Å; Q1510-S1512 PolarHBondContact O-N 3.44Å; Q1510-S1512 VanDerWaalsContact O-N 3.16Å
1511	P	56.2	Low	59.7	Low	39 Å²	39	89.1 Å²	89.1	25%	0.253	46%	0.455	S	S	.	.			trans	-61.2	119.9	-173.4	19.5	-29.2	0	0	0	112.2	I1488 S1513 F1518	I1488-P1511 HydrophobicContact CD1-CG 4.33Å; P1511-S1513 PolarHBondContact O-N 3.25Å; P1511-F1518 HydrophobicContact CB-CB 4.08Å; P1511-F1518 HydrophobicContact CB-CD2 4.45Å; P1511-F1518 HydrophobicContact CB-CG 4.27Å; P1511-F1518 HydrophobicContact CG-CB 4.2Å; P1511-F1518 HydrophobicContact CG-CG 4.33Å
1512	S	49.6	Very low	60.4	Low	128 Å²	128	83.9 Å²	83.9	90%	0.895	43%	0.43	S	S	*	.	S	Bend	trans	-76.2	-0.9	179.2	56.8	0	0	0	0	114.3	Q1510	Q1510-S1512 PolarHBondContact O-N 3.44Å; Q1510-S1512 VanDerWaalsContact O-N 3.16Å
1513	S	55.8	Low	60.6	Low	58 Å²	58	82.7 Å²	82.7	41%	0.406	42%	0.42	S	S	.	.	S	Bend	trans	-152.7	141.9	172.7	70.5	0	0	0	0	112.8	P1511 E1515 S1516	P1511-S1513 PolarHBondContact O-N 3.25Å; S1513-E1515 PolarHBondContact O-N 2.03Å; S1513-E1515 VanDerWaalsContact O-N 3.13Å; S1513-S1516 PolarHBondContact O-N 3.4Å; S1513-S1516 PolarHBondContact O-OG 2.03Å; S1513-S1516 PolarHBondContact OG-OG 3.48Å
1514	F	55.9	Low	60.5	Low	99 Å²	99	79.8 Å²	79.8	43%	0.434	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-4.6	-177.8	-57.7	-65.6	0	0	0	115.2	P1481	P1481-F1514 HydrophobicContact CG-CB 4.3Å; P1481-F1514 HydrophobicContact CG-CD1 3.67Å; P1481-F1514 HydrophobicContact CG-CD2 4.08Å; P1481-F1514 HydrophobicContact CG-CE1 3.9Å; P1481-F1514 HydrophobicContact CG-CE2 4.3Å; P1481-F1514 HydrophobicContact CG-CG 3.76Å; P1481-F1514 HydrophobicContact CG-CZ 4.21Å
1515	E	57.4	Low	59.7	Low	181 Å²	181	79.3 Å²	79.3	85%	0.846	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.8	1.7	-179.1	-60.2	-169.1	139.4	0	0	113.3	S1513	S1513-E1515 PolarHBondContact O-N 2.03Å; S1513-E1515 VanDerWaalsContact O-N 3.13Å
1516	S	59.5	Low	58.3	Low	41 Å²	41	81.7 Å²	81.7	29%	0.287	43%	0.428	S	S	.	.	S	Bend	trans	-100.9	140.5	-176	64.5	0	0	0	0	113.1	S1513 F1518	S1513-S1516 PolarHBondContact O-N 3.4Å; S1513-S1516 PolarHBondContact O-OG 2.03Å; S1513-S1516 PolarHBondContact OG-OG 3.48Å; S1516-F1518 PolarHBondContact O-N 2.9Å
1517	Y	64.4	Low	56.6	Low	133 Å²	133	78.8 Å²	78.8	52%	0.522	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-72.5	122.3	165.1	-78.5	-89.6	0	0	0	108.6	K1435 M1478	K1435-Y1517 PolarHBondContact NZ-OH 2.88Å; M1478-Y1517 HydrophobicContact CE-CD1 4.11Å; M1478-Y1517 HydrophobicContact CE-CD2 3.52Å; M1478-Y1517 HydrophobicContact CE-CE1 4.03Å; M1478-Y1517 HydrophobicContact CE-CE2 3.4Å; M1478-Y1517 HydrophobicContact CE-CG 3.88Å
1518	F	61.9	Low	55.3	Low	35 Å²	35	80.8 Å²	80.8	15%	0.154	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	127	173.4	-167.5	-125.3	0	0	0	110.1	M1476 V1477 N1509 P1511 S1516 I1520	M1476-F1518 CarbonylContact C-O 3.6Å; M1476-F1518 VanDerWaalsContact CA-O 3.26Å; M1476-F1518 WeakPolarHBondContact CA-O 3.39Å; V1477-F1518 PolarHBondContact N-O 2.04Å; V1477-F1518 PolarHBondContact O-N 3Å; N1509-F1518 HydrophobicContact CB-CE2 4.01Å; N1509-F1518 HydrophobicContact CB-CZ 3.79Å; N1509-F1518 VanDerWaalsContact O-CE1 3.29Å; N1509-F1518 WeakPolarHBondContact O-CE1 3.44Å; N1509-F1518 WeakPolarHBondContact O-CZ 3.31Å; P1511-F1518 HydrophobicContact CB-CB 4.08Å; P1511-F1518 HydrophobicContact CB-CD2 4.45Å; P1511-F1518 HydrophobicContact CB-CG 4.27Å; P1511-F1518 HydrophobicContact CG-CB 4.2Å; P1511-F1518 HydrophobicContact CG-CG 4.33Å; S1516-F1518 PolarHBondContact O-N 2.9Å; F1518-I1520 HydrophobicContact CD1-CD1 3.79Å; F1518-I1520 HydrophobicContact CD1-CG1 3.56Å; F1518-I1520 HydrophobicContact CE1-CD1 3.73Å; F1518-I1520 HydrophobicContact CE1-CG1 3.36Å; F1518-I1520 HydrophobicContact CZ-CG1 4.25Å
1519	S	66.2	Low	54.3	Low	61 Å²	61	74 Å²	74	43%	0.427	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	118.4	178.9	-173.1	0	0	0	0	109.7
1520	I	63.9	Low	53.4	Low	3 Å²	3	71.9 Å²	71.9	2%	0.015	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	119.1	178.6	-62.3	170.6	0	0	0	108.4	E1474 Y1475 D1493 Y1505 F1518	E1474-I1520 WeakPolarHBondContact CA-O 3.04Å; Y1475-I1520 HydrophobicContact CD1-CB 4.21Å; Y1475-I1520 HydrophobicContact CD1-CG2 4.36Å; Y1475-I1520 HydrophobicContact CD2-CB 4.4Å; Y1475-I1520 HydrophobicContact CD2-CD1 4.46Å; Y1475-I1520 HydrophobicContact CE1-CB 3.81Å; Y1475-I1520 HydrophobicContact CE1-CG2 3.56Å; Y1475-I1520 HydrophobicContact CE2-CB 4.03Å; Y1475-I1520 HydrophobicContact CE2-CD1 3.62Å; Y1475-I1520 HydrophobicContact CE2-CG1 4.35Å; Y1475-I1520 HydrophobicContact CE2-CG2 4.37Å; Y1475-I1520 HydrophobicContact CG-CB 4.49Å; Y1475-I1520 PolarHBondContact N-O 3.31Å; Y1475-I1520 PolarHBondContact O-N 3.22Å; D1493-I1520 HydrophobicContact CB-CD1 4.17Å; Y1505-I1520 HydrophobicContact CD1-CG2 4.49Å; Y1505-I1520 HydrophobicContact CE1-CG2 3.63Å; F1518-I1520 HydrophobicContact CD1-CD1 3.79Å; F1518-I1520 HydrophobicContact CD1-CG1 3.56Å; F1518-I1520 HydrophobicContact CE1-CD1 3.73Å; F1518-I1520 HydrophobicContact CE1-CG1 3.36Å; F1518-I1520 HydrophobicContact CZ-CG1 4.25Å
1521	Q	65.1	Low	52.7	Low	109 Å²	109	69 Å²	69	51%	0.509	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	121.2	171.3	-68.3	-176.8	-2	0	0	108.9	E1474	E1474-Q1521 HydrophobicContact CB-CG 4.34Å; E1474-Q1521 HydrophobicContact CG-CG 4.01Å; E1474-Q1521 PolarHBondContact OE1-NE2 2.93Å
1522	T	56.3	Low	52.4	Low	14 Å²	14	67.8 Å²	67.8	9%	0.086	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	154	174	-172.3	0	0	0	0	110.8	R1472 I1473 L1494 Y1505	R1472-T1522 CarbonylContact C-O 3.56Å; R1472-T1522 WeakPolarHBondContact CA-O 3.01Å; I1473-T1522 HydrophobicContact CB-CG2 3.89Å; I1473-T1522 PolarHBondContact N-O 2.89Å; I1473-T1522 PolarHBondContact O-N 2.9Å; L1494-T1522 HydrophobicContact CD2-CG2 4.07Å; Y1505-T1522 HydrophobicContact CD1-CG2 4.31Å; Y1505-T1522 WeakPolarHBondContact CD2-OG1 3.36Å; Y1505-T1522 WeakPolarHBondContact CE2-OG1 3.21Å; Y1505-T1522 HydrophobicContact CG-CG2 4.31Å
1523	T	59	Low	52.4	Low	48 Å²	48	62 Å²	62	29%	0.294	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	130.8	-177.4	-46.9	0	0	0	0	109	G1471 R1472 L1525	G1471-T1523 CarbonylContact O-C 3.4Å; G1471-T1523 VanDerWaalsContact O-CA 3.28Å; G1471-T1523 WeakPolarHBondContact O-CA 3.38Å; G1471-T1523 WeakPolarHBondContact O-CG2 3.39Å; R1472-T1523 HydrophobicContact CG-CG2 3.98Å; T1523-L1525 HydrophobicContact CG2-CD1 3.88Å; T1523-L1525 HydrophobicContact CG2-CD2 3.5Å; T1523-L1525 HydrophobicContact CG2-CG 3.45Å; T1523-L1525 VanDerWaalsContact CG2-CG 3.45Å; T1523-L1525 PolarHBondContact O-N 2.75Å
1524	L	57.7	Low	52.6	Low	45 Å²	45	62.1 Å²	62.1	24%	0.236	34%	0.339	C	S	.	.			trans	-75.9	71.4	-178.4	-57.6	176.5	0	0	0	109.9	G1470 G1471 I1473 M1496	G1470-L1524 VanDerWaalsContact CA-O 3.24Å; G1470-L1524 WeakPolarHBondContact CA-O 3.46Å; G1470-L1524 PolarHBondContact N-O 2.98Å; G1470-L1524 VanDerWaalsContact N-O 3.11Å; G1471-L1524 PolarHBondContact O-N 2.84Å; I1473-L1524 HydrophobicContact CD1-CD1 4.39Å; I1473-L1524 HydrophobicContact CD1-CD2 3.99Å; I1473-L1524 HydrophobicContact CD1-CG 4.44Å; M1496-L1524 HydrophobicContact CE-CD2 3.61Å; M1496-L1524 HydrophobicContact SD-CD2 3.77Å
1525	L	49.5	Very low	52.8	Low	82 Å²	82	64 Å²	64	43%	0.429	35%	0.35	S	S	.	.	S	Bend	trans	-100.3	158.5	-169.8	-72.2	-170.7	0	0	0	112.3	T1523	T1523-L1525 HydrophobicContact CG2-CD1 3.88Å; T1523-L1525 HydrophobicContact CG2-CD2 3.5Å; T1523-L1525 HydrophobicContact CG2-CG 3.45Å; T1523-L1525 VanDerWaalsContact CG2-CG 3.45Å; T1523-L1525 PolarHBondContact O-N 2.75Å
1526	P	42.3	Very low	52.8	Low	108 Å²	108	60.1 Å²	60.1	70%	0.701	34%	0.335	S	S	*	.	S	Bend		-107	118.8	71.5	-10.3	29.6	0	0	0	115
1527	A	33.4	Very low	52.6	Low	70 Å²	70	65.5 Å²	65.5	58%	0.579	36%	0.36	S	S	*	.	S	Bend	trans	57.7	126	173.4	0	0	0	0	0	119.9
1528	V	37.6	Very low	52	Low	65 Å²	65	62 Å²	62	39%	0.394	35%	0.351	S	S	.	.	S	Bend	trans	81.5	108.4	161.4	-162.7	0	0	0	0	119.4
1529	S	34.4	Very low	51.7	Low	47 Å²	47	63.2 Å²	63.2	33%	0.329	37%	0.367	S	S	.	.			trans	37.2	128.8	158.4	63.8	0	0	0	0	124.2	N1547	S1529-N1547 PolarHBondContact O-ND2 3.21Å
1530	M	40.2	Very low	50.7	Low	61 Å²	61	70.4 Å²	70.4	30%	0.3	39%	0.394	S	S	.	.			trans	-84	127.5	173.2	177.6	174.1	63.1	0	0	115.2	K1409 G1470 G1471 R1472	K1409-M1530 PolarHBondContact NZ-O 3.1Å; G1470-M1530 VanDerWaalsContact O-CA 3.26Å; G1470-M1530 WeakPolarHBondContact O-CA 3.33Å; G1470-M1530 VanDerWaalsContact O-CB 3.29Å; G1470-M1530 WeakPolarHBondContact O-CB 3.33Å; G1470-M1530 PolarHBondContact O-N 2.6Å; G1471-M1530 WeakPolarHBondContact CA-SD 3.41Å; R1472-M1530 HydrophobicContact CB-CE 3.83Å; R1472-M1530 HydrophobicContact CB-SD 4.48Å; R1472-M1530 HydrophobicContact CG-CB 4.31Å; R1472-M1530 HydrophobicContact CG-CE 4.3Å; R1472-M1530 PolarHBondContact N-SD 3.01Å
1531	D	41.5	Very low	50.2	Low	22 Å²	22	74.3 Å²	74.3	12%	0.118	43%	0.434	C	S	.	.			trans	-125.9	136.7	141.9	-65.7	39.6	0	0	0	107.4	K1409 A1545 N1547	K1409-D1531 HydrophobicContact CD-CB 4.32Å; K1409-D1531 WeakPolarHBondContact CD-OD2 3.34Å; K1409-D1531 VanDerWaalsContact CE-CG 3.41Å; K1409-D1531 WeakPolarHBondContact CE-OD2 3.33Å; K1409-D1531 HydrophobicContact CG-CB 4.09Å; K1409-D1531 IonicContact NZ-OD1 3.36Å; K1409-D1531 PolarHBondContact NZ-OD1 2.85Å; K1409-D1531 IonicContact NZ-OD2 3.46Å; K1409-D1531 PolarHBondContact NZ-OD2 2.88Å; D1531-A1545 HydrophobicContact CB-CB 3.66Å; D1531-N1547 WeakPolarHBondContact CB-OD1 3.39Å; D1531-N1547 PolarHBondContact N-ND2 2.68Å; D1531-N1547 PolarHBondContact OD1-ND2 3.49Å; D1531-N1547 PolarHBondContact OD1-OD1 2.85Å
1532	S	48.7	Very low	49.9	Very low	14 Å²	14	73.1 Å²	73.1	10%	0.098	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	131.3	172.8	-176.3	0	0	0	0	109.1	K1408 K1409 T1410 L1467	K1408-S1532 VanDerWaalsContact O-O 3.1Å; K1409-S1532 CarbonylContact C-O 3.44Å; K1409-S1532 VanDerWaalsContact CA-O 3.26Å; K1409-S1532 WeakPolarHBondContact CA-O 3.32Å; T1410-S1532 PolarHBondContact N-O 2.04Å; T1410-S1532 WeakPolarHBondContact O-CB 3.14Å; L1467-S1532 PolarHBondContact O-OG 2.94Å
1533	A	49.6	Very low	49.9	Very low	6 Å²	6	78.9 Å²	78.9	5%	0.05	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	129.1	-171.5	0	0	0	0	0	113.6	F1407 K1408 L1467 A1545 V1548	F1407-A1533 HydrophobicContact CB-CB 3.58Å; F1407-A1533 HydrophobicContact CD2-CB 3.88Å; F1407-A1533 HydrophobicContact CG-CB 4.14Å; K1408-A1533 CarbonylContact O-C 3.21Å; K1408-A1533 WeakPolarHBondContact O-CA 3.22Å; L1467-A1533 HydrophobicContact CD2-CB 4.43Å; L1467-A1533 PolarHBondContact O-N 3.17Å; A1533-A1545 HydrophobicContact CB-CB 4.36Å; A1533-V1548 HydrophobicContact CB-CB 4.41Å; A1533-V1548 HydrophobicContact CB-CG1 4.14Å; A1533-V1548 HydrophobicContact CB-CG2 4.07Å
1534	D	59.9	Low	50	Low	60 Å²	60	78.5 Å²	78.5	32%	0.321	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	136.2	162.1	175.8	36.3	0	0	0	110.2	F1407 K1408 N1536	F1407-D1534 WeakPolarHBondContact CB-O 3.24Å; K1408-D1534 HydrophobicContact CB-CB 4.26Å; K1408-D1534 PolarHBondContact N-O 3.41Å; K1408-D1534 PolarHBondContact O-N 3.2Å; D1534-N1536 VanDerWaalsContact CG-ND2 3.28Å; D1534-N1536 PolarHBondContact O-N 3.24Å; D1534-N1536 PolarHBondContact OD1-ND2 2.83Å; D1534-N1536 VanDerWaalsContact OD1-ND2 3.1Å; D1534-N1536 PolarHBondContact OD2-ND2 2.82Å
1535	E	60.5	Low	50.3	Low	139 Å²	139	76.3 Å²	76.3	65%	0.65	45%	0.449	S	S	*	.	S	Bend	trans	-75.4	3.2	-165.2	-155.3	173.3	-153.7	0	0	113.8	F1407	F1407-E1535 HydrophobicContact CE1-CG 3.91Å; F1407-E1535 HydrophobicContact CZ-CG 4.25Å
1536	N	57.7	Low	51.2	Low	100 Å²	100	74.8 Å²	74.8	54%	0.535	44%	0.444	S	S	.	.	S	Bend	trans	-82.9	146.6	-179.6	-67.5	-67.7	0	0	0	112.9	D1534	D1534-N1536 VanDerWaalsContact CG-ND2 3.28Å; D1534-N1536 PolarHBondContact O-N 3.24Å; D1534-N1536 PolarHBondContact OD1-ND2 2.83Å; D1534-N1536 VanDerWaalsContact OD1-ND2 3.1Å; D1534-N1536 PolarHBondContact OD2-ND2 2.82Å
1537	D	54.9	Low	52.3	Low	153 Å²	153	71 Å²	71	82%	0.818	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-61	141.4	177.3	-72.5	-53	0	0	0	113.2
1538	L	52.6	Low	53.8	Low	61 Å²	61	68.7 Å²	68.7	32%	0.319	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-69.4	132.2	177.9	-75.8	159.4	0	0	0	113.1	T1406 E1542 A1544	T1406-L1538 WeakPolarHBondContact O-CD1 3.49Å; T1406-L1538 WeakPolarHBondContact O-CG 3.4Å; L1538-E1542 HydrophobicContact CD2-CB 3.93Å; L1538-A1544 HydrophobicContact CD1-CB 3.56Å
1539	A	55	Low	55.5	Low	60 Å²	60	66.8 Å²	66.8	50%	0.496	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-86.5	159.2	167.1	0	0	0	0	0	112	G1541 E1542	A1539-G1541 PolarHBondContact O-N 2.03Å; A1539-E1542 PolarHBondContact O-N 3.23Å; A1539-E1542 VanDerWaalsContact O-N 3.15Å
1540	E	45.5	Very low	57.5	Low	212 Å²	212	65.8 Å²	65.8	99%	0.991	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	114.8	175	-78.3	-169.6	125.7	0	0	111.5
1541	G	53.3	Low	59.3	Low	84 Å²	84	63.6 Å²	63.6	87%	0.866	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	102.9	-4.5	177.1	0	0	0	0	0	115.7	A1539	A1539-G1541 PolarHBondContact O-N 2.03Å
1542	E	58.9	Low	61.2	Low	85 Å²	85	68.6 Å²	68.6	40%	0.397	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-88.1	154.5	172.5	-61.1	-165	138.2	0	0	112.2	K1408 L1538 A1539	K1408-E1542 WeakPolarHBondContact CE-OE1 3.47Å; K1408-E1542 WeakPolarHBondContact CE-OE2 3.03Å; K1408-E1542 IonicContact NZ-OE1 2.69Å; K1408-E1542 PolarHBondContact NZ-OE1 3.47Å; K1408-E1542 IonicContact NZ-OE2 3.84Å; K1408-E1542 PolarHBondContact NZ-OE2 3.36Å; L1538-E1542 HydrophobicContact CD2-CB 3.93Å; A1539-E1542 PolarHBondContact O-N 3.23Å; A1539-E1542 VanDerWaalsContact O-N 3.15Å
1543	L	55.4	Low	62	Low	135 Å²	135	69.4 Å²	69.4	71%	0.707	39%	0.394	S	S	*	.	P	Polyproline II helix	trans	-94	130.7	-176.5	-73.8	167.2	0	0	0	111.7
1544	A	61.1	Low	62.5	Low	39 Å²	39	72 Å²	72	32%	0.322	41%	0.41	S	S	.	.	B	Isolated β-bridge	trans	-76.1	138.7	174.3	0	0	0	0	0	112	F1407 L1538 S1546	F1407-A1544 WeakPolarHBondContact O-CA 3.47Å; L1538-A1544 HydrophobicContact CD1-CB 3.56Å; A1544-S1546 PolarHBondContact O-N 2.92Å
1545	A	63.7	Low	62.3	Low	0 Å²	0	75.1 Å²	75.1	0%	0	43%	0.432	C	S	.	.			trans	-76.9	67.7	169.4	0	0	0	0	0	110.9	S1405 F1407 D1531 A1533 N1547 V1548	S1405-A1545 PolarHBondContact OG-O 2.77Å; F1407-A1545 PolarHBondContact O-N 2.71Å; D1531-A1545 HydrophobicContact CB-CB 3.66Å; A1533-A1545 HydrophobicContact CB-CB 4.36Å; A1545-N1547 PolarHBondContact O-N 2.77Å; A1545-V1548 HydrophobicContact CB-CB 4.36Å; A1545-V1548 HydrophobicContact CB-CG2 3.96Å; A1545-V1548 PolarHBondContact O-N 3.41Å
1546	S	68	Low	61.8	Low	49 Å²	49	69.4 Å²	69.4	34%	0.343	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-17	-172.9	65.2	0	0	0	0	114.7	N1381 S1404 A1544	N1381-S1546 WeakPolarHBondContact CB-O 3.15Å; N1381-S1546 PolarHBondContact OD1-O 2.04Å; N1381-S1546 PolarHBondContact OD1-OG 3.48Å; S1404-S1546 WeakPolarHBondContact CB-O 2.98Å; S1404-S1546 PolarHBondContact OG-O 3.07Å; A1544-S1546 PolarHBondContact O-N 2.92Å
1547	N	65.7	Low	61.7	Low	29 Å²	29	66.8 Å²	66.8	16%	0.155	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-4.3	171.7	51.9	-24.5	0	0	0	114.2	F1380 S1529 D1531 A1545	F1380-N1547 WeakPolarHBondContact CE2-O 3.11Å; S1529-N1547 PolarHBondContact O-ND2 3.21Å; D1531-N1547 WeakPolarHBondContact CB-OD1 3.39Å; D1531-N1547 PolarHBondContact N-ND2 2.68Å; D1531-N1547 PolarHBondContact OD1-ND2 3.49Å; D1531-N1547 PolarHBondContact OD1-OD1 2.85Å; A1545-N1547 PolarHBondContact O-N 2.77Å
1548	V	65.7	Low	61.8	Low	22 Å²	22	64.6 Å²	64.6	13%	0.133	37%	0.373	C	S	.	.	S	Bend	trans	-90.6	137.3	166.5	177.4	0	0	0	0	109.6	S1405 A1533 A1545	S1405-V1548 WeakPolarHBondContact CB-O 3.32Å; S1405-V1548 PolarHBondContact N-O 2.9Å; A1533-V1548 HydrophobicContact CB-CB 4.41Å; A1533-V1548 HydrophobicContact CB-CG1 4.14Å; A1533-V1548 HydrophobicContact CB-CG2 4.07Å; A1545-V1548 HydrophobicContact CB-CB 4.36Å; A1545-V1548 HydrophobicContact CB-CG2 3.96Å; A1545-V1548 PolarHBondContact O-N 3.41Å
1549	E	72.4	Confident	62.4	Low	25 Å²	25	63.2 Å²	63.2	12%	0.117	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	155	178.9	62.5	175.2	-154.7	0	0	113.3	F1380 F1394 C1395 C1402 R1403	F1380-E1549 HydrophobicContact CE1-CB 4.03Å; F1380-E1549 HydrophobicContact CE2-CB 4.13Å; F1380-E1549 HydrophobicContact CZ-CB 3.8Å; F1394-E1549 PolarHBondContact N-OE2 3.44Å; C1395-E1549 PolarHBondContact N-OE1 2.91Å; C1402-E1549 HydrophobicContact CB-CB 4.24Å; R1403-E1549 CarbonylContact O-C 3.28Å
1550	V	76.8	Confident	63	Low	25 Å²	25	63 Å²	63	15%	0.152	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	115.4	168.6	-178.2	0	0	0	0	108.9	C1402 R1403 F1407	C1402-V1550 CarbonylContact C-O 3.54Å; C1402-V1550 VanDerWaalsContact CA-O 3.26Å; C1402-V1550 WeakPolarHBondContact CA-O 3.22Å; R1403-V1550 HydrophobicContact CG-CB 4.19Å; R1403-V1550 PolarHBondContact N-O 3.09Å; R1403-V1550 PolarHBondContact O-N 2.89Å; F1407-V1550 HydrophobicContact CE2-CG2 3.86Å; F1407-V1550 HydrophobicContact CZ-CG2 4.33Å
1551	C	78.4	Confident	64	Low	15 Å²	15	53.8 Å²	53.8	10%	0.101	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	150.2	-168.1	-56	0	0	0	0	113.9	C1395 T1399 T1560	C1395-C1551 WeakPolarHBondContact CA-SG 3.1Å; C1395-C1551 HydrophobicContact CB-CB 3.75Å; C1395-C1551 WeakPolarHBondContact CB-SG 3.05Å; C1395-C1551 WeakPolarHBondContact SG-CB 3.14Å; C1395-C1551 CovalentContact SG-SG 2.03Å; C1395-C1551 PolarHBondContact SG-SG 3.13Å; T1399-C1551 HydrophobicContact CG2-CB 3.95Å; C1551-T1560 WeakPolarHBondContact CB-O 3.04Å; C1551-T1560 PolarHBondContact N-O 2.88Å; C1551-T1560 VanDerWaalsContact N-O 3.14Å
1552	H	80.6	Confident	64.7	Low	127 Å²	127	49.9 Å²	49.9	59%	0.588	29%	0.285	S	S	*	.			trans	-101.8	81.3	176.7	-171.2	71.6	0	0	0	112.4	N1401 P1554	N1401-H1552 HydrophobicContact CB-CB 4.2Å; N1401-H1552 WeakPolarHBondContact O-CB 3.39Å; N1401-H1552 PolarHBondContact O-N 3Å; H1552-P1554 VanDerWaalsContact O-CD 3.31Å; H1552-P1554 WeakPolarHBondContact O-CD 3.49Å
1553	C	65.8	Low	64.8	Low	31 Å²	31	49 Å²	49	21%	0.209	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-68.9	119.8	-169.9	-50.4	0	0	0	0	114.3	G1559 C1562	C1553-G1559 PolarHBondContact SG-O 3.05Å; C1553-G1559 VanDerWaalsContact SG-O 3.4Å; C1553-C1562 WeakPolarHBondContact CA-SG 3.49Å; C1553-C1562 HydrophobicContact CB-CB 3.86Å; C1553-C1562 WeakPolarHBondContact CB-SG 3.32Å; C1553-C1562 WeakPolarHBondContact SG-CA 3.39Å; C1553-C1562 WeakPolarHBondContact SG-CB 3.43Å; C1553-C1562 PolarHBondContact SG-N 2.61Å; C1553-C1562 VanDerWaalsContact SG-N 3.44Å; C1553-C1562 CovalentContact SG-SG 2.04Å; C1553-C1562 PolarHBondContact SG-SG 3.37Å
1554	P	61.4	Low	64.7	Low	61 Å²	61	46.1 Å²	46.1	40%	0.396	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-74.6	150.6	169.2	31.4	-35.7	0	0	0	112	V1398 H1552 Y1557	V1398-P1554 HydrophobicContact CG1-CG 4.38Å; H1552-P1554 VanDerWaalsContact O-CD 3.31Å; H1552-P1554 WeakPolarHBondContact O-CD 3.49Å; P1554-Y1557 PolarHBondContact O-N 3.09Å
1555	T	54.2	Low	64.1	Low	126 Å²	126	47 Å²	47	77%	0.773	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	135.2	165	40.6	0	0	0	0	110.3
1556	P	51.2	Low	63.3	Low	18 Å²	18	49.4 Å²	49.4	12%	0.117	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	cis	-89.3	6.3	17.2	33.8	-37.2	0	0	0	117.4	A1578 F1581 C1593	P1556-A1578 HydrophobicContact CB-CB 4.12Å; P1556-F1581 HydrophobicContact CG-CD1 3.98Å; P1556-F1581 HydrophobicContact CG-CE1 4.05Å; P1556-C1593 HydrophobicContact CG-CB 3.76Å
1557	Y	54.3	Low	62	Low	45 Å²	45	54.6 Å²	54.6	18%	0.176	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	161.7	-170.1	-56.3	-94.4	0	0	0	113.9	V1398 P1554 C1593	V1398-Y1557 HydrophobicContact CG1-CD1 4.15Å; V1398-Y1557 HydrophobicContact CG1-CD2 3.53Å; V1398-Y1557 HydrophobicContact CG1-CE2 4.23Å; V1398-Y1557 HydrophobicContact CG1-CG 3.52Å; V1398-Y1557 HydrophobicContact CG2-CD1 4.1Å; V1398-Y1557 HydrophobicContact CG2-CE1 4.41Å; V1398-Y1557 HydrophobicContact CG2-CG 4.3Å; P1554-Y1557 PolarHBondContact O-N 3.09Å; Y1557-C1593 PolarHBondContact OH-N 2.89Å; Y1557-C1593 PolarHBondContact OH-O 3.46Å
1558	K	57.5	Low	60.8	Low	107 Å²	107	62.8 Å²	62.8	47%	0.465	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	165.4	172.8	-71.5	-173.6	-179.3	163.2	0	110.5	C1562 E1563 V1564 S1566	K1558-C1562 CarbonylContact O-C 3.46Å; K1558-C1562 VanDerWaalsContact O-CA 3.3Å; K1558-C1562 WeakPolarHBondContact O-CA 3.43Å; K1558-E1563 PolarHBondContact O-N 3.12Å; K1558-V1564 CarbonylContact C-O 3.43Å; K1558-V1564 WeakPolarHBondContact CA-O 3.45Å; K1558-V1564 WeakPolarHBondContact CB-O 3.11Å; K1558-V1564 PolarHBondContact N-O 2.78Å; K1558-V1564 CarbonylContact O-C 3.5Å; K1558-V1564 WeakPolarHBondContact O-CA 3.15Å; K1558-V1564 PolarHBondContact O-N 3.33Å; K1558-S1566 WeakPolarHBondContact CE-OG 3.02Å; K1558-S1566 PolarHBondContact NZ-OG 3.09Å
1559	G	65.2	Low	59.4	Low	33 Å²	33	64.6 Å²	64.6	34%	0.34	36%	0.358	S	S	.	.	S	Bend	trans	137.4	176.4	179.4	0	0	0	0	0	111.3	C1553 E1563	C1553-G1559 PolarHBondContact SG-O 3.05Å; C1553-G1559 VanDerWaalsContact SG-O 3.4Å; G1559-E1563 VanDerWaalsContact CA-CD 3.49Å; G1559-E1563 WeakPolarHBondContact CA-OE1 3.05Å; G1559-E1563 VanDerWaalsContact CA-OE2 3.31Å; G1559-E1563 WeakPolarHBondContact CA-OE2 3.42Å
1560	T	67.4	Low	57.5	Low	55 Å²	55	68 Å²	68	34%	0.337	39%	0.391	S	S	.	.	S	Bend	trans	-80.8	-29.1	168.3	47.3	0	0	0	0	111.7	C1551 E1563	C1551-T1560 WeakPolarHBondContact CB-O 3.04Å; C1551-T1560 PolarHBondContact N-O 2.88Å; C1551-T1560 VanDerWaalsContact N-O 3.14Å; T1560-E1563 PolarHBondContact N-OE1 3.01Å; T1560-E1563 PolarHBondContact N-OE2 2.87Å; T1560-E1563 VanDerWaalsContact N-OE2 3.13Å
1561	S	67.1	Low	55.4	Low	18 Å²	18	74.6 Å²	74.6	13%	0.126	42%	0.424	C	S	.	.	S	Bend	trans	-118.3	21.1	170.5	-56.5	0	0	0	0	111.5	C1395 F1396 E1563	C1395-S1561 CarbonylContact C-O 3.57Å; F1396-S1561 VanDerWaalsContact CD2-O 3.25Å; F1396-S1561 WeakPolarHBondContact CD2-O 3.36Å; S1561-E1563 VanDerWaalsContact C-N 3.35Å; S1561-E1563 VanDerWaalsContact C-OE2 3.3Å; S1561-E1563 WeakPolarHBondContact CA-OE2 3Å; S1561-E1563 PolarHBondContact N-OE2 3.17Å; S1561-E1563 PolarHBondContact O-N 2.9Å
1562	C	68.2	Low	53.4	Low	3 Å²	3	82.7 Å²	82.7	2%	0.02	46%	0.458	C	S	.	.	S	Bend	trans	67.2	24.6	179.1	-46.5	0	0	0	0	116.4	V1398 C1553 K1558 V1564	V1398-C1562 HydrophobicContact CB-CB 3.58Å; V1398-C1562 HydrophobicContact CG1-CB 3.76Å; V1398-C1562 HydrophobicContact CG2-CB 3.81Å; C1553-C1562 WeakPolarHBondContact CA-SG 3.49Å; C1553-C1562 HydrophobicContact CB-CB 3.86Å; C1553-C1562 WeakPolarHBondContact CB-SG 3.32Å; C1553-C1562 WeakPolarHBondContact SG-CA 3.39Å; C1553-C1562 WeakPolarHBondContact SG-CB 3.43Å; C1553-C1562 PolarHBondContact SG-N 2.61Å; C1553-C1562 VanDerWaalsContact SG-N 3.44Å; C1553-C1562 CovalentContact SG-SG 2.04Å; C1553-C1562 PolarHBondContact SG-SG 3.37Å; K1558-C1562 CarbonylContact O-C 3.46Å; K1558-C1562 VanDerWaalsContact O-CA 3.3Å; K1558-C1562 WeakPolarHBondContact O-CA 3.43Å; C1562-V1564 VanDerWaalsContact C-N 3.33Å; C1562-V1564 PolarHBondContact O-N 3.21Å
1563	E	59.8	Low	51.1	Low	67 Å²	67	84.6 Å²	84.6	31%	0.313	47%	0.471	S	S	.	.			trans	-77.4	2.1	-171.5	72.3	-61.4	147.5	0	0	116.8	F1396 L1466 K1558 G1559 T1560 S1561	F1396-E1563 HydrophobicContact CD2-CB 4.11Å; F1396-E1563 HydrophobicContact CE1-CB 4.39Å; F1396-E1563 HydrophobicContact CE2-CB 3.85Å; F1396-E1563 HydrophobicContact CG-CB 4.48Å; F1396-E1563 HydrophobicContact CZ-CB 4Å; L1466-E1563 HydrophobicContact CD1-CG 4.25Å; K1558-E1563 PolarHBondContact O-N 3.12Å; G1559-E1563 VanDerWaalsContact CA-CD 3.49Å; G1559-E1563 WeakPolarHBondContact CA-OE1 3.05Å; G1559-E1563 VanDerWaalsContact CA-OE2 3.31Å; G1559-E1563 WeakPolarHBondContact CA-OE2 3.42Å; T1560-E1563 PolarHBondContact N-OE1 3.01Å; T1560-E1563 PolarHBondContact N-OE2 2.87Å; T1560-E1563 VanDerWaalsContact N-OE2 3.13Å; S1561-E1563 VanDerWaalsContact C-N 3.35Å; S1561-E1563 VanDerWaalsContact C-OE2 3.3Å; S1561-E1563 WeakPolarHBondContact CA-OE2 3Å; S1561-E1563 PolarHBondContact N-OE2 3.17Å; S1561-E1563 PolarHBondContact O-N 2.9Å
1564	V	53.4	Low	49.9	Very low	74 Å²	74	90.9 Å²	90.9	45%	0.448	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	113.7	-172.4	-174.8	0	0	0	0	112.6	K1558 C1562	K1558-V1564 CarbonylContact C-O 3.43Å; K1558-V1564 WeakPolarHBondContact CA-O 3.45Å; K1558-V1564 WeakPolarHBondContact CB-O 3.11Å; K1558-V1564 PolarHBondContact N-O 2.78Å; K1558-V1564 CarbonylContact O-C 3.5Å; K1558-V1564 WeakPolarHBondContact O-CA 3.15Å; K1558-V1564 PolarHBondContact O-N 3.33Å; C1562-V1564 VanDerWaalsContact C-N 3.33Å; C1562-V1564 PolarHBondContact O-N 3.21Å
1565	C	48.8	Very low	49	Very low	57 Å²	57	93.8 Å²	93.8	39%	0.385	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	136.2	163.3	-87.7	0	0	0	0	111	F1567	C1565-F1567 PolarHBondContact O-N 2.89Å; C1565-F1567 VanDerWaalsContact O-N 3.14Å
1566	S	47.8	Very low	48.8	Very low	50 Å²	50	95.2 Å²	95.2	35%	0.35	51%	0.508	S	S	.	.	S	Bend	trans	-78	104.8	-160.7	174	0	0	0	0	114.9	K1558	K1558-S1566 WeakPolarHBondContact CE-OG 3.02Å; K1558-S1566 PolarHBondContact NZ-OG 3.09Å
1567	F	41.4	Very low	48.7	Very low	159 Å²	159	95 Å²	95	70%	0.697	51%	0.507	S	S	*	.			trans	77.2	142.7	159.2	-89	-132.6	0	0	0	115.7	C1565	C1565-F1567 PolarHBondContact O-N 2.89Å; C1565-F1567 VanDerWaalsContact O-N 3.14Å
1568	Y	39	Very low	48.7	Very low	200 Å²	200	95 Å²	95	78%	0.784	52%	0.516	S	S	*	.			cis	-162.8	-165.4	-7.4	-150	-132.3	0	0	0	111
1569	G	35.9	Very low	48.7	Very low	61 Å²	61	97.2 Å²	97.2	63%	0.629	53%	0.528	S	S	*	.			trans	116.8	-8.5	133.2	0	0	0	0	0	121.1
1570	A	33	Very low	48.5	Very low	97 Å²	97	96.9 Å²	96.9	80%	0.802	53%	0.525	S	S	*	.			trans	66.8	147.7	173.4	0	0	0	0	0	119.1
1571	L	33.7	Very low	48.5	Very low	162 Å²	162	96.6 Å²	96.6	85%	0.848	52%	0.519	S	S	*	.	S	Bend	trans	71.1	95.9	175.1	-76.9	150.6	0	0	0	118.6
1572	K	35.4	Very low	48.5	Very low	186 Å²	186	97.4 Å²	97.4	81%	0.809	52%	0.52	S	S	*	.	S	Bend	trans	73.1	94	155.6	-63.4	-173.1	175	-175	0	120
1573	L	33.5	Very low	47.9	Very low	167 Å²	167	101.1 Å²	101.1	87%	0.874	53%	0.534	S	S	*	.	S	Bend	trans	64.8	58.1	131.6	-67.6	162.1	0	0	0	119.2
1574	L	40.1	Very low	47.8	Very low	163 Å²	163	99.8 Å²	99.8	85%	0.853	53%	0.53	S	S	*	.			trans	-155.1	163	152.1	-95.5	130.1	0	0	0	109.5
1575	Q	42.7	Very low	47.7	Very low	122 Å²	122	99.8 Å²	99.8	57%	0.57	55%	0.545	S	S	*	.			trans	-144.3	135.1	-177.8	-81.7	176	-53	0	0	110.8	R1583	Q1575-R1583 VanDerWaalsContact OE1-CZ 3.28Å
1576	E	49.2	Very low	47.5	Very low	155 Å²	155	102.1 Å²	102.1	72%	0.724	56%	0.562	S	S	*	*			trans	-125.3	162.4	-173.4	-63.2	-179.9	-162.9	0	0	112.4
1577	C	50.1	Low	47.2	Very low	14 Å²	14	101 Å²	101	10%	0.095	56%	0.557	C	S	.	*			trans	-110.8	169	176.9	-65.7	0	0	0	0	112.4	F1581 C1593	C1577-F1581 HydrophobicContact CB-CB 4.05Å; C1577-C1593 VanDerWaalsContact CA-SG 3.59Å; C1577-C1593 HydrophobicContact CB-CB 3.84Å; C1577-C1593 WeakPolarHBondContact CB-SG 3.29Å; C1577-C1593 VanDerWaalsContact SG-CA 3.51Å; C1577-C1593 WeakPolarHBondContact SG-CB 3.43Å; C1577-C1593 CovalentContact SG-SG 2.04Å; C1577-C1593 PolarHBondContact SG-SG 2.95Å
1578	A	53.3	Low	47.2	Very low	45 Å²	45	99.8 Å²	99.8	37%	0.372	57%	0.566	S	S	.	*			trans	-65.8	161.6	176.4	0	0	0	0	0	113	P1556 G1580 F1581	P1556-A1578 HydrophobicContact CB-CB 4.12Å; A1578-G1580 PolarHBondContact O-N 3.41Å; A1578-F1581 HydrophobicContact CB-CD2 3.97Å; A1578-F1581 WeakPolarHBondContact O-CB 3.22Å; A1578-F1581 PolarHBondContact O-N 2.61Å
1579	E	57.7	Low	47.3	Very low	153 Å²	153	94.2 Å²	94.2	72%	0.715	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	133.5	175.4	-173.4	146.4	-104.9	0	0	111.3	F1581 R1607	E1579-F1581 WeakPolarHBondContact O-CD2 3.16Å; E1579-R1607 IonicContact OE1-CZ 2.87Å; E1579-R1607 IonicContact OE1-NH2 2.72Å; E1579-R1607 PolarHBondContact OE1-NH2 3.05Å
1580	G	62.2	Low	47.9	Very low	27 Å²	27	96.5 Å²	96.5	28%	0.278	55%	0.547	S	S	.	.	T	Hydrogen-bonded Turn	trans	82	8.9	-167.3	0	0	0	0	0	114.6	A1578 P1595 C1596	A1578-G1580 PolarHBondContact O-N 3.41Å; G1580-P1595 CarbonylContact O-C 3.59Å; G1580-P1595 WeakPolarHBondContact O-CA 3.33Å; G1580-C1596 PolarHBondContact O-N 2.99Å; G1580-C1596 PolarHBondContact O-SG 3.2Å; G1580-C1596 VanDerWaalsContact O-SG 3.41Å
1581	F	65.7	Low	48.7	Very low	48 Å²	48	92.7 Å²	92.7	21%	0.211	52%	0.517	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	151.8	177.2	-62.2	-110.9	0	0	0	111.8	P1556 C1577 A1578 E1579 V1594 P1595	P1556-F1581 HydrophobicContact CG-CD1 3.98Å; P1556-F1581 HydrophobicContact CG-CE1 4.05Å; C1577-F1581 HydrophobicContact CB-CB 4.05Å; A1578-F1581 HydrophobicContact CB-CD2 3.97Å; A1578-F1581 WeakPolarHBondContact O-CB 3.22Å; A1578-F1581 PolarHBondContact O-N 2.61Å; E1579-F1581 WeakPolarHBondContact O-CD2 3.16Å; F1581-V1594 CarbonylContact C-O 3.27Å; F1581-V1594 WeakPolarHBondContact CA-O 3.42Å; F1581-V1594 WeakPolarHBondContact CB-O 3.32Å; F1581-V1594 VanDerWaalsContact CD1-C 3.45Å; F1581-P1595 HydrophobicContact CD1-CB 4.41Å; F1581-P1595 HydrophobicContact CD1-CG 4.07Å; F1581-P1595 HydrophobicContact CE1-CB 4.3Å; F1581-P1595 HydrophobicContact CE1-CG 3.67Å; F1581-P1595 HydrophobicContact CZ-CG 4.3Å
1582	Y	68.2	Low	49.6	Very low	36 Å²	36	87.1 Å²	87.1	14%	0.141	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	163.3	172.9	77.6	-82.7	0	0	0	111.8	V1584 C1593 V1594 D1606 R1607 G1610	Y1582-V1584 HydrophobicContact CD2-CG2 4.46Å; Y1582-V1584 HydrophobicContact CE2-CG2 3.85Å; Y1582-C1593 WeakPolarHBondContact O-CA 3.35Å; Y1582-V1594 HydrophobicContact CD1-CG2 3.75Å; Y1582-V1594 HydrophobicContact CE1-CG2 3.32Å; Y1582-V1594 HydrophobicContact CE2-CG2 4.21Å; Y1582-V1594 HydrophobicContact CG-CG2 4.35Å; Y1582-V1594 PolarHBondContact N-O 2.89Å; Y1582-V1594 PolarHBondContact O-N 2.81Å; Y1582-D1606 WeakPolarHBondContact CB-O 3.46Å; Y1582-R1607 WeakPolarHBondContact CA-O 3.47Å; Y1582-G1610 VanDerWaalsContact CD1-CA 3.48Å
1583	R	55.5	Low	50.8	Low	81 Å²	81	78.8 Å²	78.8	31%	0.306	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	120.9	-175.3	-166	-177.5	176.8	-162.5	4.8	112.9	Q1575 L1590 S1592 R1607	Q1575-R1583 VanDerWaalsContact OE1-CZ 3.28Å; R1583-L1590 PolarHBondContact NH2-O 3.4Å; R1583-S1592 WeakPolarHBondContact CA-O 3.31Å; R1583-R1607 PolarHBondContact N-O 3.45Å
1584	V	57.4	Low	52.1	Low	39 Å²	39	71.9 Å²	71.9	24%	0.236	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	120	170.2	-168.5	0	0	0	0	109.6	Y1582 S1586 G1591 S1592 V1594	Y1582-V1584 HydrophobicContact CD2-CG2 4.46Å; Y1582-V1584 HydrophobicContact CE2-CG2 3.85Å; V1584-S1586 VanDerWaalsContact C-N 3.29Å; V1584-S1586 PolarHBondContact O-N 3.46Å; V1584-G1591 CarbonylContact O-C 3.58Å; V1584-G1591 WeakPolarHBondContact O-CA 3.45Å; V1584-S1592 PolarHBondContact N-O 2.83Å; V1584-S1592 PolarHBondContact O-N 2.75Å; V1584-S1592 VanDerWaalsContact O-N 3.13Å; V1584-V1594 HydrophobicContact CG2-CG1 4.1Å; V1584-V1594 HydrophobicContact CG2-CG2 3.68Å
1585	G	51.1	Low	53.5	Low	74 Å²	74	67.6 Å²	67.6	76%	0.763	40%	0.403	S	S	*	.	S	Bend	trans	-71.1	-20.1	-178.2	0	0	0	0	0	114.8
1586	S	44.7	Very low	55	Low	106 Å²	106	62.9 Å²	62.9	74%	0.741	38%	0.383	S	S	*	.			trans	-98.6	88.4	179.1	37	0	0	0	0	111.4	V1584	V1584-S1586 VanDerWaalsContact C-N 3.29Å; V1584-S1586 PolarHBondContact O-N 3.46Å
1587	G	41.7	Very low	56.4	Low	25 Å²	25	62.9 Å²	62.9	26%	0.258	38%	0.376	S	S	.	.			trans	-146.4	146	168.9	0	0	0	0	0	110.3	L1589	G1587-L1589 PolarHBondContact O-N 3.34Å
1588	P	41.9	Very low	58.2	Low	135 Å²	135	62.3 Å²	62.3	88%	0.877	37%	0.372	S	S	*	.	S	Bend	trans	-64.2	-18.8	-167.9	24.9	-34.9	0	0	0	114.4
1589	L	41.1	Very low	59.6	Low	82 Å²	82	62.3 Å²	62.3	43%	0.429	37%	0.366	S	S	.	.	S	Bend	trans	-132.6	89.3	179.2	-69.2	162.2	0	0	0	109.4	F1394 F1396 G1587 G1591	F1394-L1589 HydrophobicContact CZ-CD1 4.35Å; F1396-L1589 HydrophobicContact CD1-CB 4.37Å; F1396-L1589 HydrophobicContact CD1-CD1 3.87Å; F1396-L1589 HydrophobicContact CD1-CD2 4.46Å; F1396-L1589 HydrophobicContact CD1-CG 4.46Å; F1396-L1589 HydrophobicContact CE1-CD2 4.45Å; G1587-L1589 PolarHBondContact O-N 3.34Å; L1589-G1591 PolarHBondContact O-N 3.42Å
1590	L	47.9	Very low	60.8	Low	110 Å²	110	57.8 Å²	57.8	58%	0.576	36%	0.36	S	S	*	.	S	Bend	trans	65.4	2.1	169.5	-62.8	158.4	0	0	0	118	R1583	R1583-L1590 PolarHBondContact NH2-O 3.4Å
1591	G	48.8	Very low	62	Low	17 Å²	17	56.5 Å²	56.5	18%	0.175	35%	0.347	C	S	.	.			trans	87.6	144.8	173	0	0	0	0	0	114.4	V1584 L1589	V1584-G1591 CarbonylContact O-C 3.58Å; V1584-G1591 WeakPolarHBondContact O-CA 3.45Å; L1589-G1591 PolarHBondContact O-N 3.42Å
1592	S	53	Low	62.9	Low	45 Å²	45	54.9 Å²	54.9	32%	0.315	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	139	-163.7	-55.2	0	0	0	0	113.2	R1583 V1584	R1583-S1592 WeakPolarHBondContact CA-O 3.31Å; V1584-S1592 PolarHBondContact N-O 2.83Å; V1584-S1592 PolarHBondContact O-N 2.75Å; V1584-S1592 VanDerWaalsContact O-N 3.13Å
1593	C	60.3	Low	63.3	Low	10 Å²	10	60.7 Å²	60.7	7%	0.068	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	117.2	163	-70.8	0	0	0	0	109.1	P1556 Y1557 C1577 Y1582	P1556-C1593 HydrophobicContact CG-CB 3.76Å; Y1557-C1593 PolarHBondContact OH-N 2.89Å; Y1557-C1593 PolarHBondContact OH-O 3.46Å; C1577-C1593 VanDerWaalsContact CA-SG 3.59Å; C1577-C1593 HydrophobicContact CB-CB 3.84Å; C1577-C1593 WeakPolarHBondContact CB-SG 3.29Å; C1577-C1593 VanDerWaalsContact SG-CA 3.51Å; C1577-C1593 WeakPolarHBondContact SG-CB 3.43Å; C1577-C1593 CovalentContact SG-SG 2.04Å; C1577-C1593 PolarHBondContact SG-SG 2.95Å; Y1582-C1593 WeakPolarHBondContact O-CA 3.35Å
1594	V	62.5	Low	64.3	Low	23 Å²	23	59.2 Å²	59.2	14%	0.139	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	150	179.7	-56.5	0	0	0	0	110.4	F1581 Y1582 V1584	F1581-V1594 CarbonylContact C-O 3.27Å; F1581-V1594 WeakPolarHBondContact CA-O 3.42Å; F1581-V1594 WeakPolarHBondContact CB-O 3.32Å; F1581-V1594 VanDerWaalsContact CD1-C 3.45Å; Y1582-V1594 HydrophobicContact CD1-CG2 3.75Å; Y1582-V1594 HydrophobicContact CE1-CG2 3.32Å; Y1582-V1594 HydrophobicContact CE2-CG2 4.21Å; Y1582-V1594 HydrophobicContact CG-CG2 4.35Å; Y1582-V1594 PolarHBondContact N-O 2.89Å; Y1582-V1594 PolarHBondContact O-N 2.81Å; V1584-V1594 HydrophobicContact CG2-CG1 4.1Å; V1584-V1594 HydrophobicContact CG2-CG2 3.68Å
1595	P	67.9	Low	65.4	Low	73 Å²	73	58 Å²	58	47%	0.474	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58	151.2	175.4	-22.2	31.8	0	0	0	112.1	G1580 F1581 R1597	G1580-P1595 CarbonylContact O-C 3.59Å; G1580-P1595 WeakPolarHBondContact O-CA 3.33Å; F1581-P1595 HydrophobicContact CD1-CB 4.41Å; F1581-P1595 HydrophobicContact CD1-CG 4.07Å; F1581-P1595 HydrophobicContact CE1-CB 4.3Å; F1581-P1595 HydrophobicContact CE1-CG 3.67Å; F1581-P1595 HydrophobicContact CZ-CG 4.3Å; P1595-R1597 WeakPolarHBondContact O-CG 3.13Å; P1595-R1597 PolarHBondContact O-N 2.98Å; P1595-R1597 VanDerWaalsContact O-N 3.11Å
1596	C	74.1	Confident	66.5	Low	22 Å²	22	56.9 Å²	56.9	15%	0.149	34%	0.342	C	S	.	.			trans	-55	113.6	166.4	-66.9	0	0	0	0	109.5	G1580 C1598 C1605	G1580-C1596 PolarHBondContact O-N 2.99Å; G1580-C1596 PolarHBondContact O-SG 3.2Å; G1580-C1596 VanDerWaalsContact O-SG 3.41Å; C1596-C1598 PolarHBondContact O-N 3.01Å; C1596-C1605 WeakPolarHBondContact CA-SG 3.25Å; C1596-C1605 HydrophobicContact CB-CB 3.6Å; C1596-C1605 WeakPolarHBondContact CB-SG 3.2Å; C1596-C1605 WeakPolarHBondContact SG-CB 3.13Å; C1596-C1605 PolarHBondContact SG-N 2.77Å; C1596-C1605 CovalentContact SG-SG 2.03Å; C1596-C1605 PolarHBondContact SG-SG 2.04Å
1597	R	80.4	Confident	67.4	Low	156 Å²	156	57.2 Å²	57.2	59%	0.589	33%	0.327	S	S	*	.			trans	-85.1	37.3	-169.7	-65.7	-167.6	171.5	-164.1	-3.1	113.3	P1595 N1599	P1595-R1597 WeakPolarHBondContact O-CG 3.13Å; P1595-R1597 PolarHBondContact O-N 2.98Å; P1595-R1597 VanDerWaalsContact O-N 3.11Å; R1597-N1599 PolarHBondContact O-N 3.21Å; R1597-N1599 PolarHBondContact O-ND2 2.81Å
1598	C	87.8	Confident	68.3	Low	1 Å²	1	62.7 Å²	62.7	1%	0.007	35%	0.349	C	S	.	.			trans	-71.4	25.8	-168.5	-48.9	0	0	0	0	115.5	C1596 G1600 H1601 S1602 C1612 N1623	C1596-C1598 PolarHBondContact O-N 3.01Å; C1598-G1600 PolarHBondContact O-N 2.64Å; C1598-H1601 WeakPolarHBondContact O-CA 3.05Å; C1598-H1601 WeakPolarHBondContact O-CB 3.24Å; C1598-H1601 PolarHBondContact O-N 3.43Å; C1598-S1602 WeakPolarHBondContact CB-O 3.26Å; C1598-S1602 PolarHBondContact O-N 2.89Å; C1598-C1612 WeakPolarHBondContact CA-SG 3.47Å; C1598-C1612 HydrophobicContact CB-CB 3.84Å; C1598-C1612 WeakPolarHBondContact CB-SG 3.03Å; C1598-C1612 WeakPolarHBondContact SG-CB 3.24Å; C1598-C1612 CovalentContact SG-SG 2.03Å; C1598-C1612 PolarHBondContact SG-SG 3.34Å; C1598-N1623 CarbonylContact C-O 3.5Å; C1598-N1623 WeakPolarHBondContact CA-O 3.35Å
1599	N	82.8	Confident	69.7	Low	45 Å²	45	60.9 Å²	60.9	24%	0.241	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	47.9	21.2	-178.5	-67.7	-72	0	0	0	116.2	R1597 H1601 N1623 E1625 A1635 G1638	R1597-N1599 PolarHBondContact O-N 3.21Å; R1597-N1599 PolarHBondContact O-ND2 2.81Å; N1599-H1601 PolarHBondContact O-CD2 3.02Å; N1599-H1601 VanDerWaalsContact O-CD2 3.26Å; N1599-H1601 PolarHBondContact O-N 2.95Å; N1599-N1623 PolarHBondContact ND2-O 2.88Å; N1599-E1625 WeakPolarHBondContact ND2-CB 3.05Å; N1599-A1635 WeakPolarHBondContact CB-O 3.39Å; N1599-G1638 WeakPolarHBondContact O-CA 3.47Å
1600	G	82.6	Confident	71.3	Confident	58 Å²	58	57.1 Å²	57.1	60%	0.598	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.7	-2.7	-171.6	0	0	0	0	0	114.7	C1598	C1598-G1600 PolarHBondContact O-N 2.64Å
1601	H	86.6	Confident	72.9	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-15.8	176.4	-69.4	-91.7	0	0	0	113.4	C1598 N1599 K1616 H1617 T1619 C1624 A1635 T1639 D1642	C1598-H1601 WeakPolarHBondContact O-CA 3.05Å; C1598-H1601 WeakPolarHBondContact O-CB 3.24Å; C1598-H1601 PolarHBondContact O-N 3.43Å; N1599-H1601 PolarHBondContact O-CD2 3.02Å; N1599-H1601 VanDerWaalsContact O-CD2 3.26Å; N1599-H1601 PolarHBondContact O-N 2.95Å; H1601-K1616 PolarHBondContact ND1-O 2.89Å; H1601-K1616 VanDerWaalsContact O-CB 3.22Å; H1601-K1616 WeakPolarHBondContact O-CB 3.11Å; H1601-K1616 VanDerWaalsContact O-CG 3.25Å; H1601-K1616 WeakPolarHBondContact O-CG 3.42Å; H1601-K1616 PolarHBondContact O-N 3.07Å; H1601-H1617 AromaticContact CE1-ND1 3.48Å; H1601-H1617 PolarHBondContact CE1-ND1 3.4Å; H1601-H1617 AromaticContact CG-ND1 3.99Å; H1601-H1617 AromaticContact ND1-CG 3.71Å; H1601-H1617 AromaticContact ND1-ND1 3.14Å; H1601-H1617 PolarHBondContact ND1-ND1 3.38Å; H1601-H1617 VanDerWaalsContact ND1-ND1 3.14Å; H1601-T1619 HydrophobicContact CB-CG2 4.45Å; H1601-T1619 WeakPolarHBondContact CB-OG1 3.29Å; H1601-T1619 VanDerWaalsContact CE1-CG2 3.43Å; H1601-T1619 WeakPolarHBondContact CE1-CG2 3.29Å; H1601-T1619 VanDerWaalsContact ND1-CG2 3.28Å; H1601-T1619 WeakPolarHBondContact ND1-CG2 3.42Å; H1601-T1619 PolarHBondContact ND1-OG1 2.82Å; H1601-C1624 HydrophobicContact CB-CB 3.66Å; H1601-A1635 PolarHBondContact CD2-O 2.59Å; H1601-T1639 PolarHBondContact CE1-O 2.74Å; H1601-D1642 IonicContact NE2-OD2 3.22Å; H1601-D1642 PolarHBondContact NE2-OD2 2.86Å
1602	S	84	Confident	74.6	Confident	15 Å²	15	58 Å²	58	11%	0.105	31%	0.309	C	S	.	.			trans	-140.3	160.9	165	-174.1	0	0	0	0	112.7	C1598 S1604 F1613	C1598-S1602 WeakPolarHBondContact CB-O 3.26Å; C1598-S1602 PolarHBondContact O-N 2.89Å; S1602-S1604 PolarHBondContact OG-N 2.89Å; S1602-S1604 PolarHBondContact OG-O 2.8Å; S1602-F1613 WeakPolarHBondContact CB-O 3.36Å; S1602-F1613 PolarHBondContact OG-O 2.78Å
1603	E	76.4	Confident	76.1	Confident	157 Å²	157	60.3 Å²	60.3	73%	0.734	31%	0.313	S	S	*	.	S	Bend	trans	-104.8	-2.8	177.4	-70	161.2	-115.1	0	0	112.2	K1616	E1603-K1616 IonicContact OE1-NZ 2.72Å; E1603-K1616 PolarHBondContact OE1-NZ 2.9Å
1604	S	78.1	Confident	77.2	Confident	51 Å²	51	66.6 Å²	66.6	36%	0.357	35%	0.346	S	S	.	.			trans	-142.1	143.5	-171.9	61.3	0	0	0	0	113.8	S1602 C1612 F1613	S1602-S1604 PolarHBondContact OG-N 2.89Å; S1602-S1604 PolarHBondContact OG-O 2.8Å; S1604-C1612 WeakPolarHBondContact O-CA 3.48Å; S1604-F1613 PolarHBondContact O-N 3.11Å
1605	C	80.1	Confident	78.3	Confident	12 Å²	12	67.4 Å²	67.4	8%	0.081	35%	0.352	C	S	.	.	B	Isolated β-bridge	trans	-146.4	165	175.6	74.3	0	0	0	0	112.6	C1596 G1610 R1611 F1613	C1596-C1605 WeakPolarHBondContact CA-SG 3.25Å; C1596-C1605 HydrophobicContact CB-CB 3.6Å; C1596-C1605 WeakPolarHBondContact CB-SG 3.2Å; C1596-C1605 WeakPolarHBondContact SG-CB 3.13Å; C1596-C1605 PolarHBondContact SG-N 2.77Å; C1596-C1605 CovalentContact SG-SG 2.03Å; C1596-C1605 PolarHBondContact SG-SG 2.04Å; C1605-G1610 WeakPolarHBondContact CB-O 3.37Å; C1605-R1611 CarbonylContact C-O 3.47Å; C1605-R1611 WeakPolarHBondContact CA-O 3.11Å; C1605-R1611 WeakPolarHBondContact CB-O 3.35Å; C1605-F1613 VanDerWaalsContact C-CE2 3.48Å
1606	D	74	Confident	79.2	Confident	52 Å²	52	68.1 Å²	68.1	28%	0.278	35%	0.348	S	S	.	.			trans	-65.7	127.8	172.2	-177.9	-89.4	0	0	0	111.4	Y1582 I1608 T1609 G1610 R1611 F1613	Y1582-D1606 WeakPolarHBondContact CB-O 3.46Å; D1606-I1608 PolarHBondContact O-N 2.75Å; D1606-I1608 PolarHBondContact OD1-N 2.76Å; D1606-T1609 VanDerWaalsContact CB-OG1 3.27Å; D1606-T1609 WeakPolarHBondContact CB-OG1 3.4Å; D1606-T1609 WeakPolarHBondContact OD1-CB 3.46Å; D1606-T1609 PolarHBondContact OD1-N 2.94Å; D1606-T1609 PolarHBondContact OD1-OG1 2.04Å; D1606-G1610 VanDerWaalsContact O-CA 3.27Å; D1606-G1610 WeakPolarHBondContact O-CA 3.22Å; D1606-G1610 PolarHBondContact O-N 3.12Å; D1606-R1611 HydrophobicContact CB-CB 4.24Å; D1606-R1611 PolarHBondContact N-O 2.03Å; D1606-F1613 HydrophobicContact CB-CE1 4.45Å; D1606-F1613 HydrophobicContact CB-CE2 4.2Å; D1606-F1613 HydrophobicContact CB-CZ 3.69Å
1607	R	63	Low	79.8	Confident	112 Å²	112	70.1 Å²	70.1	42%	0.423	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-11.3	-169.6	-59	-179.4	-175.2	178.3	-1	114.3	E1579 Y1582 R1583	E1579-R1607 IonicContact OE1-CZ 2.87Å; E1579-R1607 IonicContact OE1-NH2 2.72Å; E1579-R1607 PolarHBondContact OE1-NH2 3.05Å; Y1582-R1607 WeakPolarHBondContact CA-O 3.47Å; R1583-R1607 PolarHBondContact N-O 3.45Å
1608	I	61.8	Low	80.1	Confident	140 Å²	140	66.3 Å²	66.3	72%	0.718	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.7	-42.5	-178.2	-62.3	173.7	0	0	0	111	D1606	D1606-I1608 PolarHBondContact O-N 2.75Å; D1606-I1608 PolarHBondContact OD1-N 2.76Å
1609	T	70.1	Confident	80.2	Confident	98 Å²	98	66.6 Å²	66.6	60%	0.601	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	-18.6	-175.3	59.8	0	0	0	0	113.7	D1606 R1611	D1606-T1609 VanDerWaalsContact CB-OG1 3.27Å; D1606-T1609 WeakPolarHBondContact CB-OG1 3.4Å; D1606-T1609 WeakPolarHBondContact OD1-CB 3.46Å; D1606-T1609 PolarHBondContact OD1-N 2.94Å; D1606-T1609 PolarHBondContact OD1-OG1 2.04Å; T1609-R1611 PolarHBondContact O-N 2.64Å
1610	G	75.8	Confident	80.3	Confident	2 Å²	2	67.3 Å²	67.3	2%	0.021	35%	0.354	C	S	.	.			trans	80.5	-2.4	-175.5	0	0	0	0	0	115.1	Y1582 C1605 D1606 C1612	Y1582-G1610 VanDerWaalsContact CD1-CA 3.48Å; C1605-G1610 WeakPolarHBondContact CB-O 3.37Å; D1606-G1610 VanDerWaalsContact O-CA 3.27Å; D1606-G1610 WeakPolarHBondContact O-CA 3.22Å; D1606-G1610 PolarHBondContact O-N 3.12Å; G1610-C1612 PolarHBondContact O-N 2.01Å
1611	R	81.1	Confident	80.2	Confident	135 Å²	135	65.6 Å²	65.6	51%	0.509	34%	0.337	S	S	.	.			trans	-65.4	119.8	-174.2	-171.3	177.3	-149.6	-145	-2.7	112.5	C1605 D1606 T1609 D1622	C1605-R1611 CarbonylContact C-O 3.47Å; C1605-R1611 WeakPolarHBondContact CA-O 3.11Å; C1605-R1611 WeakPolarHBondContact CB-O 3.35Å; D1606-R1611 HydrophobicContact CB-CB 4.24Å; D1606-R1611 PolarHBondContact N-O 2.03Å; T1609-R1611 PolarHBondContact O-N 2.64Å; R1611-D1622 CarbonylContact C-O 3.55Å; R1611-D1622 WeakPolarHBondContact CA-O 3.32Å; R1611-D1622 HydrophobicContact CG-CB 4.1Å; R1611-D1622 IonicContact CZ-OD1 2.73Å; R1611-D1622 VanDerWaalsContact NE-CG 3.26Å; R1611-D1622 IonicContact NE-OD1 3.95Å; R1611-D1622 PolarHBondContact NE-OD1 3.5Å; R1611-D1622 IonicContact NE-OD2 3.13Å; R1611-D1622 PolarHBondContact NE-OD2 3.14Å; R1611-D1622 IonicContact NH2-OD1 2.96Å; R1611-D1622 PolarHBondContact NH2-OD1 3.37Å
1612	C	85.2	Confident	80	Confident	11 Å²	11	69.2 Å²	69.2	7%	0.074	36%	0.356	C	S	.	.	B	Isolated β-bridge	trans	-67.8	148	179.5	-63.8	0	0	0	0	112.9	C1598 S1604 G1610 D1622	C1598-C1612 WeakPolarHBondContact CA-SG 3.47Å; C1598-C1612 HydrophobicContact CB-CB 3.84Å; C1598-C1612 WeakPolarHBondContact CB-SG 3.03Å; C1598-C1612 WeakPolarHBondContact SG-CB 3.24Å; C1598-C1612 CovalentContact SG-SG 2.03Å; C1598-C1612 PolarHBondContact SG-SG 3.34Å; S1604-C1612 WeakPolarHBondContact O-CA 3.48Å; G1610-C1612 PolarHBondContact O-N 2.01Å; C1612-D1622 PolarHBondContact N-O 3.46Å
1613	F	83.3	Confident	80	Confident	94 Å²	94	70.5 Å²	70.5	41%	0.412	36%	0.362	S	S	.	.			trans	-110.4	154.6	174.3	-56	-57	0	0	0	110.3	S1602 S1604 C1605 D1606 C1615	S1602-F1613 WeakPolarHBondContact CB-O 3.36Å; S1602-F1613 PolarHBondContact OG-O 2.78Å; S1604-F1613 PolarHBondContact O-N 3.11Å; C1605-F1613 VanDerWaalsContact C-CE2 3.48Å; D1606-F1613 HydrophobicContact CB-CE1 4.45Å; D1606-F1613 HydrophobicContact CB-CE2 4.2Å; D1606-F1613 HydrophobicContact CB-CZ 3.69Å; F1613-C1615 PolarHBondContact O-N 3.13Å
1614	D	83.5	Confident	80.6	Confident	142 Å²	142	63 Å²	63	76%	0.759	33%	0.327	S	S	*	.	S	Bend	trans	47.8	52.3	169.6	-58.2	-18.7	0	0	0	115.5	K1616	D1614-K1616 PolarHBondContact O-N 2.84Å
1615	C	85.4	Confident	80.9	Confident	40 Å²	40	63.6 Å²	63.6	27%	0.27	32%	0.324	S	S	.	.			trans	-56.5	133.5	176.6	-62.4	0	0	0	0	112.8	F1613 T1619 C1624	F1613-C1615 PolarHBondContact O-N 3.13Å; C1615-T1619 WeakPolarHBondContact CB-O 3.21Å; C1615-C1624 VanDerWaalsContact CA-SG 3.57Å; C1615-C1624 HydrophobicContact CB-CB 3.78Å; C1615-C1624 WeakPolarHBondContact CB-SG 3.01Å; C1615-C1624 VanDerWaalsContact SG-CA 3.54Å; C1615-C1624 WeakPolarHBondContact SG-CB 3.32Å; C1615-C1624 CovalentContact SG-SG 2.04Å; C1615-C1624 PolarHBondContact SG-SG 2.8Å
1616	K	87.6	Confident	81.1	Confident	88 Å²	88	67.8 Å²	67.8	38%	0.383	35%	0.345	S	S	.	.			trans	-105.7	165.2	-175.7	-56.2	169.1	-170.5	175.8	0	111.8	H1601 E1603 D1614 N1618 T1619	H1601-K1616 PolarHBondContact ND1-O 2.89Å; H1601-K1616 VanDerWaalsContact O-CB 3.22Å; H1601-K1616 WeakPolarHBondContact O-CB 3.11Å; H1601-K1616 VanDerWaalsContact O-CG 3.25Å; H1601-K1616 WeakPolarHBondContact O-CG 3.42Å; H1601-K1616 PolarHBondContact O-N 3.07Å; E1603-K1616 IonicContact OE1-NZ 2.72Å; E1603-K1616 PolarHBondContact OE1-NZ 2.9Å; D1614-K1616 PolarHBondContact O-N 2.84Å; K1616-N1618 PolarHBondContact O-N 2.82Å; K1616-T1619 PolarHBondContact O-OG1 2.03Å
1617	H	87.1	Confident	81.7	Confident	63 Å²	63	66.6 Å²	66.6	29%	0.292	34%	0.34	S	S	.	.	S	Bend	trans	64.4	32.2	177	-31.1	129.8	0	0	0	115	H1601	H1601-H1617 AromaticContact CE1-ND1 3.48Å; H1601-H1617 PolarHBondContact CE1-ND1 3.4Å; H1601-H1617 AromaticContact CG-ND1 3.99Å; H1601-H1617 AromaticContact ND1-CG 3.71Å; H1601-H1617 AromaticContact ND1-ND1 3.14Å; H1601-H1617 PolarHBondContact ND1-ND1 3.38Å; H1601-H1617 VanDerWaalsContact ND1-ND1 3.14Å
1618	N	86.7	Confident	82.7	Confident	76 Å²	76	64.6 Å²	64.6	41%	0.406	34%	0.338	S	S	.	.	S	Bend	trans	61.2	47.4	179.8	-38.1	-51.6	0	0	0	113.1	K1616 D1628 F1631 C1643	K1616-N1618 PolarHBondContact O-N 2.82Å; N1618-D1628 WeakPolarHBondContact O-CB 3Å; N1618-D1628 PolarHBondContact O-N 2.79Å; N1618-F1631 HydrophobicContact CB-CD1 3.93Å; N1618-F1631 HydrophobicContact CB-CD2 3.88Å; N1618-F1631 HydrophobicContact CB-CE1 4Å; N1618-F1631 HydrophobicContact CB-CE2 3.94Å; N1618-F1631 HydrophobicContact CB-CG 3.88Å; N1618-F1631 HydrophobicContact CB-CZ 4.01Å; N1618-F1631 VanDerWaalsContact ND2-CE1 3.27Å; N1618-F1631 WeakPolarHBondContact ND2-CE1 3.27Å; N1618-C1643 WeakPolarHBondContact O-CB 3.15Å
1619	T	88.1	Confident	83.7	Confident	7 Å²	7	65.6 Å²	65.6	4%	0.043	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	157.3	171.3	56.2	0	0	0	0	111.6	H1601 C1615 K1616 L1626 A1635	H1601-T1619 HydrophobicContact CB-CG2 4.45Å; H1601-T1619 WeakPolarHBondContact CB-OG1 3.29Å; H1601-T1619 VanDerWaalsContact CE1-CG2 3.43Å; H1601-T1619 WeakPolarHBondContact CE1-CG2 3.29Å; H1601-T1619 VanDerWaalsContact ND1-CG2 3.28Å; H1601-T1619 WeakPolarHBondContact ND1-CG2 3.42Å; H1601-T1619 PolarHBondContact ND1-OG1 2.82Å; C1615-T1619 WeakPolarHBondContact CB-O 3.21Å; K1616-T1619 PolarHBondContact O-OG1 2.03Å; T1619-L1626 CarbonylContact C-O 3.54Å; T1619-L1626 WeakPolarHBondContact CA-O 3.09Å; T1619-L1626 VanDerWaalsContact CB-O 3.28Å; T1619-L1626 WeakPolarHBondContact CB-O 3.04Å; T1619-A1635 HydrophobicContact CG2-CB 3.62Å
1620	T	86.5	Confident	84.3	Confident	60 Å²	60	61 Å²	61	37%	0.368	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	-176	-179	-164	0	0	0	0	110.1	C1624 E1625 L1626 C1627 D1628	T1620-C1624 CarbonylContact O-C 3.47Å; T1620-C1624 VanDerWaalsContact O-C 3.24Å; T1620-C1624 VanDerWaalsContact O-CA 3.26Å; T1620-C1624 WeakPolarHBondContact O-CA 3Å; T1620-E1625 PolarHBondContact O-N 3.11Å; T1620-L1626 HydrophobicContact CG2-CB 3.9Å; T1620-L1626 PolarHBondContact N-O 2.93Å; T1620-L1626 WeakPolarHBondContact O-CB 3.11Å; T1620-L1626 PolarHBondContact O-N 2.84Å; T1620-C1627 WeakPolarHBondContact CG2-O 3.21Å; T1620-D1628 HydrophobicContact CG2-CB 4.44Å
1621	G	79.9	Confident	84.8	Confident	23 Å²	23	61.9 Å²	61.9	24%	0.237	31%	0.308	C	S	.	.	S	Bend	trans	91	170.2	-172.2	0	0	0	0	0	112.9	N1623 C1624 E1625	G1621-N1623 VanDerWaalsContact C-N 3.27Å; G1621-N1623 PolarHBondContact O-N 2.87Å; G1621-C1624 PolarHBondContact O-N 3.35Å; G1621-E1625 VanDerWaalsContact CA-OE2 3.26Å; G1621-E1625 WeakPolarHBondContact CA-OE2 3.05Å
1622	D	82.3	Confident	84.9	Confident	76 Å²	76	57 Å²	57	41%	0.406	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-15.4	-169.6	-76.2	8.1	0	0	0	113.2	R1611 C1612 E1625	R1611-D1622 CarbonylContact C-O 3.55Å; R1611-D1622 WeakPolarHBondContact CA-O 3.32Å; R1611-D1622 HydrophobicContact CG-CB 4.1Å; R1611-D1622 IonicContact CZ-OD1 2.73Å; R1611-D1622 VanDerWaalsContact NE-CG 3.26Å; R1611-D1622 IonicContact NE-OD1 3.95Å; R1611-D1622 PolarHBondContact NE-OD1 3.5Å; R1611-D1622 IonicContact NE-OD2 3.13Å; R1611-D1622 PolarHBondContact NE-OD2 3.14Å; R1611-D1622 IonicContact NH2-OD1 2.96Å; R1611-D1622 PolarHBondContact NH2-OD1 3.37Å; C1612-D1622 PolarHBondContact N-O 3.46Å; D1622-E1625 PolarHBondContact N-OE2 3.04Å
1623	N	84.3	Confident	84.7	Confident	42 Å²	42	58.8 Å²	58.8	23%	0.225	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.2	18.8	170.1	-56.7	-89.5	0	0	0	112	C1598 N1599 G1621 E1625	C1598-N1623 CarbonylContact C-O 3.5Å; C1598-N1623 WeakPolarHBondContact CA-O 3.35Å; N1599-N1623 PolarHBondContact ND2-O 2.88Å; G1621-N1623 VanDerWaalsContact C-N 3.27Å; G1621-N1623 PolarHBondContact O-N 2.87Å; N1623-E1625 WeakPolarHBondContact CA-OE2 3.17Å; N1623-E1625 HydrophobicContact CB-CB 4.32Å; N1623-E1625 HydrophobicContact CB-CG 4.49Å; N1623-E1625 VanDerWaalsContact CB-OE1 3.31Å; N1623-E1625 WeakPolarHBondContact CB-OE1 3.44Å; N1623-E1625 VanDerWaalsContact N-CD 3.34Å; N1623-E1625 PolarHBondContact N-OE1 3.43Å; N1623-E1625 PolarHBondContact N-OE2 2.03Å; N1623-E1625 PolarHBondContact ND2-OE1 3.12Å; N1623-E1625 PolarHBondContact O-N 2.8Å
1624	C	88.1	Confident	84.6	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	31%	0.311	C	S	.	.	S	Bend	trans	52.9	31.4	-169	-48.4	0	0	0	0	112.7	H1601 C1615 T1620 G1621	H1601-C1624 HydrophobicContact CB-CB 3.66Å; C1615-C1624 VanDerWaalsContact CA-SG 3.57Å; C1615-C1624 HydrophobicContact CB-CB 3.78Å; C1615-C1624 WeakPolarHBondContact CB-SG 3.01Å; C1615-C1624 VanDerWaalsContact SG-CA 3.54Å; C1615-C1624 WeakPolarHBondContact SG-CB 3.32Å; C1615-C1624 CovalentContact SG-SG 2.04Å; C1615-C1624 PolarHBondContact SG-SG 2.8Å; T1620-C1624 CarbonylContact O-C 3.47Å; T1620-C1624 VanDerWaalsContact O-C 3.24Å; T1620-C1624 VanDerWaalsContact O-CA 3.26Å; T1620-C1624 WeakPolarHBondContact O-CA 3Å; G1621-C1624 PolarHBondContact O-N 3.35Å
1625	E	84	Confident	84.5	Confident	63 Å²	63	50.9 Å²	50.9	29%	0.294	28%	0.276	S	S	.	.			trans	-90.1	-5.3	-170.9	69.6	-84	-109.5	0	0	114.3	N1599 T1620 G1621 D1622 N1623	N1599-E1625 WeakPolarHBondContact ND2-CB 3.05Å; T1620-E1625 PolarHBondContact O-N 3.11Å; G1621-E1625 VanDerWaalsContact CA-OE2 3.26Å; G1621-E1625 WeakPolarHBondContact CA-OE2 3.05Å; D1622-E1625 PolarHBondContact N-OE2 3.04Å; N1623-E1625 WeakPolarHBondContact CA-OE2 3.17Å; N1623-E1625 HydrophobicContact CB-CB 4.32Å; N1623-E1625 HydrophobicContact CB-CG 4.49Å; N1623-E1625 VanDerWaalsContact CB-OE1 3.31Å; N1623-E1625 WeakPolarHBondContact CB-OE1 3.44Å; N1623-E1625 VanDerWaalsContact N-CD 3.34Å; N1623-E1625 PolarHBondContact N-OE1 3.43Å; N1623-E1625 PolarHBondContact N-OE2 2.03Å; N1623-E1625 PolarHBondContact ND2-OE1 3.12Å; N1623-E1625 PolarHBondContact O-N 2.8Å
1626	L	84.7	Confident	84.4	Confident	100 Å²	100	52.5 Å²	52.5	52%	0.524	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	150.6	176.3	-55.6	176.5	0	0	0	109.5	T1619 T1620	T1619-L1626 CarbonylContact C-O 3.54Å; T1619-L1626 WeakPolarHBondContact CA-O 3.09Å; T1619-L1626 VanDerWaalsContact CB-O 3.28Å; T1619-L1626 WeakPolarHBondContact CB-O 3.04Å; T1620-L1626 HydrophobicContact CG2-CB 3.9Å; T1620-L1626 PolarHBondContact N-O 2.93Å; T1620-L1626 WeakPolarHBondContact O-CB 3.11Å; T1620-L1626 PolarHBondContact O-N 2.84Å
1627	C	86.3	Confident	84	Confident	26 Å²	26	55.6 Å²	55.6	18%	0.176	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	143.5	161.7	-67.1	0	0	0	0	110.3	T1620 F1631 C1643	T1620-C1627 WeakPolarHBondContact CG2-O 3.21Å; C1627-F1631 HydrophobicContact CB-CB 3.94Å; C1627-F1631 WeakPolarHBondContact CB-O 3.01Å; C1627-C1643 WeakPolarHBondContact CA-SG 3.23Å; C1627-C1643 HydrophobicContact CB-CB 3.8Å; C1627-C1643 WeakPolarHBondContact CB-SG 3.41Å; C1627-C1643 VanDerWaalsContact SG-CA 3.55Å; C1627-C1643 WeakPolarHBondContact SG-CB 3.4Å; C1627-C1643 CovalentContact SG-SG 2.04Å; C1627-C1643 PolarHBondContact SG-SG 3.38Å
1628	D	85.2	Confident	83.4	Confident	70 Å²	70	54.1 Å²	54.1	37%	0.374	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-70.2	161.5	173.3	-165.8	18.3	0	0	0	110.6	N1618 T1620 G1630 F1631	N1618-D1628 WeakPolarHBondContact O-CB 3Å; N1618-D1628 PolarHBondContact O-N 2.79Å; T1620-D1628 HydrophobicContact CG2-CB 4.44Å; D1628-G1630 PolarHBondContact O-N 3.13Å; D1628-F1631 WeakPolarHBondContact O-CB 3.09Å; D1628-F1631 WeakPolarHBondContact O-CD2 3.48Å; D1628-F1631 PolarHBondContact O-N 2.86Å
1629	R	83.4	Confident	83.1	Confident	162 Å²	162	53.1 Å²	53.1	61%	0.611	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	127	-168	-74	-173.4	172	-147	-0.7	112.9	L1659 E1675	R1629-L1659 WeakPolarHBondContact CA-O 3.35Å; R1629-L1659 HydrophobicContact CG-CD2 4.21Å; R1629-L1659 VanDerWaalsContact CZ-CD2 3.45Å; R1629-E1675 IonicContact CZ-OE1 3.94Å; R1629-E1675 IonicContact NH1-OE1 2.76Å; R1629-E1675 PolarHBondContact NH1-OE1 2.8Å
1630	G	82.7	Confident	82.7	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.01	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	86	7.3	-178.9	0	0	0	0	0	114.1	D1628 C1646 N1656 A1658 L1659	D1628-G1630 PolarHBondContact O-N 3.13Å; G1630-C1646 VanDerWaalsContact O-CB 3.24Å; G1630-C1646 WeakPolarHBondContact O-CB 3.01Å; G1630-C1646 PolarHBondContact O-N 2.75Å; G1630-N1656 VanDerWaalsContact CA-ND2 3.31Å; G1630-N1656 WeakPolarHBondContact CA-ND2 3.39Å; G1630-N1656 PolarHBondContact O-ND2 3.19Å; G1630-A1658 WeakPolarHBondContact CA-O 3.03Å; G1630-A1658 PolarHBondContact N-O 3.26Å; G1630-A1658 VanDerWaalsContact N-O 3.15Å; G1630-L1659 PolarHBondContact N-O 2.76Å
1631	F	85.9	Confident	82.5	Confident	20 Å²	20	60.9 Å²	60.9	9%	0.088	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	154.5	173.1	-63.4	-99.8	0	0	0	111.1	N1618 C1627 D1628 C1643 Q1644 L1645 M1653	N1618-F1631 HydrophobicContact CB-CD1 3.93Å; N1618-F1631 HydrophobicContact CB-CD2 3.88Å; N1618-F1631 HydrophobicContact CB-CE1 4Å; N1618-F1631 HydrophobicContact CB-CE2 3.94Å; N1618-F1631 HydrophobicContact CB-CG 3.88Å; N1618-F1631 HydrophobicContact CB-CZ 4.01Å; N1618-F1631 VanDerWaalsContact ND2-CE1 3.27Å; N1618-F1631 WeakPolarHBondContact ND2-CE1 3.27Å; C1627-F1631 HydrophobicContact CB-CB 3.94Å; C1627-F1631 WeakPolarHBondContact CB-O 3.01Å; D1628-F1631 WeakPolarHBondContact O-CB 3.09Å; D1628-F1631 WeakPolarHBondContact O-CD2 3.48Å; D1628-F1631 PolarHBondContact O-N 2.86Å; F1631-C1643 HydrophobicContact CB-CB 3.95Å; F1631-C1643 WeakPolarHBondContact CD1-O 3.07Å; F1631-Q1644 CarbonylContact C-O 3.11Å; F1631-Q1644 VanDerWaalsContact CA-O 3.24Å; F1631-Q1644 WeakPolarHBondContact CA-O 3.42Å; F1631-L1645 HydrophobicContact CD1-CB 4.39Å; F1631-L1645 HydrophobicContact CD1-CD1 4.35Å; F1631-L1645 HydrophobicContact CE1-CB 4.14Å; F1631-L1645 HydrophobicContact CE1-CD1 3.82Å; F1631-L1645 HydrophobicContact CE2-CD1 4.18Å; F1631-L1645 HydrophobicContact CZ-CD1 3.72Å; F1631-M1653 HydrophobicContact CE2-SD 4.25Å; F1631-M1653 HydrophobicContact CZ-CE 4.39Å; F1631-M1653 HydrophobicContact CZ-SD 3.83Å
1632	H	82.7	Confident	82.6	Confident	32 Å²	32	60.4 Å²	60.4	15%	0.148	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	163.4	179.1	72.6	-65.4	0	0	0	111.5	C1643 Q1644 C1661 V1663	H1632-C1643 CarbonylContact O-C 3.52Å; H1632-C1643 WeakPolarHBondContact O-CA 3.49Å; H1632-Q1644 PolarHBondContact CE1-O 3.49Å; H1632-Q1644 PolarHBondContact N-O 2.92Å; H1632-Q1644 PolarHBondContact ND1-O 2.99Å; H1632-Q1644 PolarHBondContact O-N 3.08Å; H1632-C1661 WeakPolarHBondContact CB-O 3.36Å; H1632-V1663 WeakPolarHBondContact CD2-CG2 3.17Å; H1632-V1663 VanDerWaalsContact NE2-CG2 3.34Å; H1632-V1663 WeakPolarHBondContact NE2-CG2 3.42Å
1633	G	81	Confident	82.8	Confident	50 Å²	50	57 Å²	57	52%	0.515	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	123	-154.4	-176.9	0	0	0	0	0	109.7	D1642	G1633-D1642 CarbonylContact C-O 3.47Å; G1633-D1642 VanDerWaalsContact CA-O 3.27Å; G1633-D1642 WeakPolarHBondContact CA-O 3.11Å
1634	V	81.7	Confident	82.8	Confident	67 Å²	67	60.5 Å²	60.5	41%	0.406	32%	0.323	S	S	.	.			trans	-127.4	91.7	-167.1	177.4	0	0	0	0	108.5	T1636 F1637 D1642	V1634-T1636 VanDerWaalsContact CG1-OG1 3.22Å; V1634-T1636 WeakPolarHBondContact CG1-OG1 3.2Å; V1634-T1636 PolarHBondContact O-N 2.91Å; V1634-F1637 HydrophobicContact CB-CD2 3.89Å; V1634-F1637 HydrophobicContact CB-CE2 3.55Å; V1634-F1637 HydrophobicContact CB-CZ 4.19Å; V1634-F1637 HydrophobicContact CG1-CD2 3.98Å; V1634-F1637 HydrophobicContact CG1-CE1 4.36Å; V1634-F1637 HydrophobicContact CG1-CE2 3.69Å; V1634-F1637 HydrophobicContact CG1-CG 4.45Å; V1634-F1637 HydrophobicContact CG1-CZ 3.89Å; V1634-F1637 HydrophobicContact CG2-CE2 4.21Å; V1634-F1637 PolarHBondContact O-N 2.95Å; V1634-D1642 PolarHBondContact N-O 3.15Å; V1634-D1642 WeakPolarHBondContact O-CB 3.27Å
1635	A	81.5	Confident	82.7	Confident	3 Å²	3	62.7 Å²	62.7	3%	0.025	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	15.1	-177.8	0	0	0	0	0	115.3	N1599 H1601 T1619	N1599-A1635 WeakPolarHBondContact CB-O 3.39Å; H1601-A1635 PolarHBondContact CD2-O 2.59Å; T1619-A1635 HydrophobicContact CG2-CB 3.62Å
1636	T	81.8	Confident	82.6	Confident	74 Å²	74	59.7 Å²	59.7	45%	0.454	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.7	-3.4	-175.9	62.1	0	0	0	0	113.6	V1634	V1634-T1636 VanDerWaalsContact CG1-OG1 3.22Å; V1634-T1636 WeakPolarHBondContact CG1-OG1 3.2Å; V1634-T1636 PolarHBondContact O-N 2.91Å
1637	F	79.1	Confident	82.5	Confident	152 Å²	152	56.3 Å²	56.3	67%	0.667	30%	0.304	S	S	*	.	S	Bend	trans	-80.4	-21.6	175.3	-62.2	-50.9	0	0	0	113.4	V1634 T1639 D1642	V1634-F1637 HydrophobicContact CB-CD2 3.89Å; V1634-F1637 HydrophobicContact CB-CE2 3.55Å; V1634-F1637 HydrophobicContact CB-CZ 4.19Å; V1634-F1637 HydrophobicContact CG1-CD2 3.98Å; V1634-F1637 HydrophobicContact CG1-CE1 4.36Å; V1634-F1637 HydrophobicContact CG1-CE2 3.69Å; V1634-F1637 HydrophobicContact CG1-CG 4.45Å; V1634-F1637 HydrophobicContact CG1-CZ 3.89Å; V1634-F1637 HydrophobicContact CG2-CE2 4.21Å; V1634-F1637 PolarHBondContact O-N 2.95Å; F1637-T1639 HydrophobicContact CB-CG2 4.27Å; F1637-D1642 WeakPolarHBondContact CA-OD2 3.09Å; F1637-D1642 WeakPolarHBondContact CB-OD2 3.19Å; F1637-D1642 PolarHBondContact N-OD2 3.06Å
1638	G	76.3	Confident	82.3	Confident	33 Å²	33	55 Å²	55	34%	0.34	30%	0.296	S	S	.	.			trans	77.1	29.7	178.3	0	0	0	0	0	115.1	N1599 D1642	N1599-G1638 WeakPolarHBondContact O-CA 3.47Å; G1638-D1642 WeakPolarHBondContact CA-OD2 3.28Å; G1638-D1642 PolarHBondContact N-OD2 2.04Å
1639	T	79.3	Confident	82	Confident	55 Å²	55	52.9 Å²	52.9	34%	0.337	29%	0.286	S	S	.	.			trans	-108.8	156.7	176.8	99.4	0	0	0	0	113.1	H1601 F1637 F1641 D1642	H1601-T1639 PolarHBondContact CE1-O 2.74Å; F1637-T1639 HydrophobicContact CB-CG2 4.27Å; T1639-F1641 PolarHBondContact O-N 2.06Å; T1639-F1641 PolarHBondContact OG1-N 2.83Å; T1639-D1642 WeakPolarHBondContact CA-OD1 3.49Å; T1639-D1642 WeakPolarHBondContact CB-OD1 3.06Å; T1639-D1642 WeakPolarHBondContact CG2-OD1 3.38Å; T1639-D1642 VanDerWaalsContact N-CG 3.31Å; T1639-D1642 PolarHBondContact N-OD1 2.82Å; T1639-D1642 PolarHBondContact N-OD2 3.25Å; T1639-D1642 VanDerWaalsContact O-CG 3.28Å; T1639-D1642 PolarHBondContact O-N 3.01Å; T1639-D1642 PolarHBondContact OG1-OD1 2.71Å
1640	P	80.6	Confident	81.6	Confident	76 Å²	76	49.4 Å²	49.4	49%	0.494	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-2.1	175.4	-22.2	34.9	0	0	0	116
1641	F	81.8	Confident	81	Confident	153 Å²	153	53.5 Å²	53.5	67%	0.671	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.8	9.1	-175.7	-54.4	-72.4	0	0	0	113.4	T1639 C1643 Q1644	T1639-F1641 PolarHBondContact O-N 2.06Å; T1639-F1641 PolarHBondContact OG1-N 2.83Å; F1641-C1643 VanDerWaalsContact C-N 3.27Å; F1641-C1643 PolarHBondContact O-N 2.86Å; F1641-Q1644 VanDerWaalsContact O-CG 3.26Å; F1641-Q1644 WeakPolarHBondContact O-CG 3.42Å; F1641-Q1644 PolarHBondContact O-NE2 3.17Å; F1641-Q1644 VanDerWaalsContact O-NE2 3.15Å
1642	D	81.5	Confident	80.5	Confident	13 Å²	13	55 Å²	55	7%	0.07	31%	0.314	C	S	.	.	S	Bend	trans	-65.6	-31	-177.2	-72.5	8.9	0	0	0	112.8	H1601 G1633 V1634 F1637 G1638 T1639	H1601-D1642 IonicContact NE2-OD2 3.22Å; H1601-D1642 PolarHBondContact NE2-OD2 2.86Å; G1633-D1642 CarbonylContact C-O 3.47Å; G1633-D1642 VanDerWaalsContact CA-O 3.27Å; G1633-D1642 WeakPolarHBondContact CA-O 3.11Å; V1634-D1642 PolarHBondContact N-O 3.15Å; V1634-D1642 WeakPolarHBondContact O-CB 3.27Å; F1637-D1642 WeakPolarHBondContact CA-OD2 3.09Å; F1637-D1642 WeakPolarHBondContact CB-OD2 3.19Å; F1637-D1642 PolarHBondContact N-OD2 3.06Å; G1638-D1642 WeakPolarHBondContact CA-OD2 3.28Å; G1638-D1642 PolarHBondContact N-OD2 2.04Å; T1639-D1642 WeakPolarHBondContact CA-OD1 3.49Å; T1639-D1642 WeakPolarHBondContact CB-OD1 3.06Å; T1639-D1642 WeakPolarHBondContact CG2-OD1 3.38Å; T1639-D1642 VanDerWaalsContact N-CG 3.31Å; T1639-D1642 PolarHBondContact N-OD1 2.82Å; T1639-D1642 PolarHBondContact N-OD2 3.25Å; T1639-D1642 VanDerWaalsContact O-CG 3.28Å; T1639-D1642 PolarHBondContact O-N 3.01Å; T1639-D1642 PolarHBondContact OG1-OD1 2.71Å
1643	C	87.4	Confident	80.1	Confident	6 Å²	6	59.9 Å²	59.9	4%	0.041	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	105.3	177.8	-69.1	0	0	0	0	110.5	N1618 C1627 F1631 H1632 F1641	N1618-C1643 WeakPolarHBondContact O-CB 3.15Å; C1627-C1643 WeakPolarHBondContact CA-SG 3.23Å; C1627-C1643 HydrophobicContact CB-CB 3.8Å; C1627-C1643 WeakPolarHBondContact CB-SG 3.41Å; C1627-C1643 VanDerWaalsContact SG-CA 3.55Å; C1627-C1643 WeakPolarHBondContact SG-CB 3.4Å; C1627-C1643 CovalentContact SG-SG 2.04Å; C1627-C1643 PolarHBondContact SG-SG 3.38Å; F1631-C1643 HydrophobicContact CB-CB 3.95Å; F1631-C1643 WeakPolarHBondContact CD1-O 3.07Å; H1632-C1643 CarbonylContact O-C 3.52Å; H1632-C1643 WeakPolarHBondContact O-CA 3.49Å; F1641-C1643 VanDerWaalsContact C-N 3.27Å; F1641-C1643 PolarHBondContact O-N 2.86Å
1644	Q	83.9	Confident	79.8	Confident	114 Å²	114	63.8 Å²	63.8	53%	0.533	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	150.7	-176.5	-58	-174.2	25.2	0	0	111.1	F1631 H1632 F1641 C1646	F1631-Q1644 CarbonylContact C-O 3.11Å; F1631-Q1644 VanDerWaalsContact CA-O 3.24Å; F1631-Q1644 WeakPolarHBondContact CA-O 3.42Å; H1632-Q1644 PolarHBondContact CE1-O 3.49Å; H1632-Q1644 PolarHBondContact N-O 2.92Å; H1632-Q1644 PolarHBondContact ND1-O 2.99Å; H1632-Q1644 PolarHBondContact O-N 3.08Å; F1641-Q1644 VanDerWaalsContact O-CG 3.26Å; F1641-Q1644 WeakPolarHBondContact O-CG 3.42Å; F1641-Q1644 PolarHBondContact O-NE2 3.17Å; F1641-Q1644 VanDerWaalsContact O-NE2 3.15Å; Q1644-C1646 PolarHBondContact O-N 2.77Å
1645	L	85.3	Confident	79.7	Confident	46 Å²	46	60.6 Å²	60.6	24%	0.241	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	128.8	-173.3	-169.8	73.5	0	0	0	111.8	F1631 P1647 M1653 N1656	F1631-L1645 HydrophobicContact CD1-CB 4.39Å; F1631-L1645 HydrophobicContact CD1-CD1 4.35Å; F1631-L1645 HydrophobicContact CE1-CB 4.14Å; F1631-L1645 HydrophobicContact CE1-CD1 3.82Å; F1631-L1645 HydrophobicContact CE2-CD1 4.18Å; F1631-L1645 HydrophobicContact CZ-CD1 3.72Å; L1645-P1647 WeakPolarHBondContact O-CD 3.45Å; L1645-M1653 HydrophobicContact CD1-CG 4.38Å; L1645-M1653 HydrophobicContact CD1-SD 3.43Å; L1645-M1653 WeakPolarHBondContact CD1-SD 3.38Å; L1645-M1653 HydrophobicContact CD2-CG 4.49Å; L1645-N1656 WeakPolarHBondContact CD1-ND2 3.38Å
1646	C	83.1	Confident	79.6	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	33%	0.327	C	S	.	.			trans	-69.3	125.2	174.4	-77.8	0	0	0	0	112.2	G1630 Q1644 C1648 N1656 A1658 C1661	G1630-C1646 VanDerWaalsContact O-CB 3.24Å; G1630-C1646 WeakPolarHBondContact O-CB 3.01Å; G1630-C1646 PolarHBondContact O-N 2.75Å; Q1644-C1646 PolarHBondContact O-N 2.77Å; C1646-C1648 HydrophobicContact CB-CB 4.36Å; C1646-C1648 PolarHBondContact O-N 2.79Å; C1646-N1656 PolarHBondContact O-OD1 2.85Å; C1646-A1658 HydrophobicContact CB-CB 4.14Å; C1646-C1661 WeakPolarHBondContact CA-SG 3.07Å; C1646-C1661 HydrophobicContact CB-CB 3.96Å; C1646-C1661 WeakPolarHBondContact CB-SG 3.44Å; C1646-C1661 WeakPolarHBondContact SG-CB 3.38Å; C1646-C1661 PolarHBondContact SG-N 3.31Å; C1646-C1661 CovalentContact SG-SG 2.05Å; C1646-C1661 PolarHBondContact SG-SG 2.77Å
1647	P	81.7	Confident	79.9	Confident	29 Å²	29	58 Å²	58	19%	0.188	31%	0.306	C	S	.	.			trans	-82.3	59.3	178.6	29.4	-27.6	0	0	0	112	L1645 P1649 P1651 L1669	L1645-P1647 WeakPolarHBondContact O-CD 3.45Å; P1647-P1649 CarbonylContact O-C 3.49Å; P1647-P1651 HydrophobicContact CB-CB 4.07Å; P1647-L1669 HydrophobicContact CB-CD2 4.45Å; P1647-L1669 HydrophobicContact CG-CB 4.05Å; P1647-L1669 HydrophobicContact CG-CD2 3.74Å; P1647-L1669 HydrophobicContact CG-CG 4.36Å; P1647-L1669 WeakPolarHBondContact O-CD2 3.47Å
1648	C	83.1	Confident	80	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.276	C	S	.	.	S	Bend	trans	-122.1	85.8	-166.7	-56.4	0	0	0	0	112.7	C1646 N1655 N1656 F1657 A1658 C1672 R1682 C1683	C1646-C1648 HydrophobicContact CB-CB 4.36Å; C1646-C1648 PolarHBondContact O-N 2.79Å; C1648-N1655 CarbonylContact C-O 3.09Å; C1648-N1656 WeakPolarHBondContact O-CA 3.24Å; C1648-F1657 PolarHBondContact O-N 3.03Å; C1648-A1658 HydrophobicContact CB-CB 3.67Å; C1648-C1672 HydrophobicContact CB-CB 3.76Å; C1648-C1672 WeakPolarHBondContact CB-SG 3.23Å; C1648-C1672 WeakPolarHBondContact SG-CB 3.43Å; C1648-C1672 CovalentContact SG-SG 2.02Å; C1648-C1672 PolarHBondContact SG-SG 3Å; C1648-R1682 CarbonylContact C-O 3.4Å; C1648-R1682 WeakPolarHBondContact CA-O 3.49Å; C1648-C1683 HydrophobicContact CB-CB 4.47Å
1649	P	78.4	Confident	80.4	Confident	25 Å²	25	52.1 Å²	52.1	16%	0.162	27%	0.274	C	S	.	.	B	Isolated β-bridge	cis	-89.8	-1	1.7	33.3	-37.3	0	0	0	115.1	P1647 N1655 R1682 E1684 P1694	P1647-P1649 CarbonylContact O-C 3.49Å; P1649-N1655 WeakPolarHBondContact CD-O 3.04Å; P1649-R1682 WeakPolarHBondContact CA-O 3.25Å; P1649-R1682 HydrophobicContact CB-CB 4.41Å; P1649-R1682 WeakPolarHBondContact CB-O 3.5Å; P1649-E1684 HydrophobicContact CB-CB 3.85Å; P1649-P1694 WeakPolarHBondContact CG-O 3.47Å
1650	H	74.6	Confident	80.5	Confident	89 Å²	89	52.6 Å²	52.6	41%	0.412	28%	0.275	S	S	.	.	S	Bend	trans	-141	143.2	-173.2	-152.4	-99.1	0	0	0	111.4	T1652 N1655	H1650-T1652 PolarHBondContact ND1-OG1 3.11Å; H1650-T1652 PolarHBondContact O-N 3.45Å; H1650-N1655 HydrophobicContact CB-CB 4.11Å; H1650-N1655 PolarHBondContact N-O 3.24Å
1651	P	70.4	Confident	80.7	Confident	86 Å²	86	49.3 Å²	49.3	56%	0.558	25%	0.254	S	S	*	.	S	Bend	trans	-73.7	56.3	-179.1	30.3	-36.6	0	0	0	113	P1647	P1647-P1651 HydrophobicContact CB-CB 4.07Å
1652	T	75.1	Confident	80.5	Confident	53 Å²	53	45.1 Å²	45.1	33%	0.325	24%	0.24	S	C	.	.	S	Bend	trans	-152.6	128.2	-173.9	43.3	0	0	0	0	110.2	H1650 E1654 N1655 N1656	H1650-T1652 PolarHBondContact ND1-OG1 3.11Å; H1650-T1652 PolarHBondContact O-N 3.45Å; T1652-E1654 PolarHBondContact O-N 2.93Å; T1652-N1655 CarbonylContact O-C 3.58Å; T1652-N1655 PolarHBondContact O-N 2.9Å; T1652-N1656 PolarHBondContact O-N 2.04Å
1653	M	73.5	Confident	79.8	Confident	134 Å²	134	46.5 Å²	46.5	66%	0.66	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	-52.5	-24.4	-177.3	-68.8	-72.5	-74.6	0	0	115.5	F1631 L1645 N1655	F1631-M1653 HydrophobicContact CE2-SD 4.25Å; F1631-M1653 HydrophobicContact CZ-CE 4.39Å; F1631-M1653 HydrophobicContact CZ-SD 3.83Å; L1645-M1653 HydrophobicContact CD1-CG 4.38Å; L1645-M1653 HydrophobicContact CD1-SD 3.43Å; L1645-M1653 WeakPolarHBondContact CD1-SD 3.38Å; L1645-M1653 HydrophobicContact CD2-CG 4.49Å; M1653-N1655 VanDerWaalsContact C-N 3.32Å
1654	E	76.7	Confident	78.7	Confident	131 Å²	131	47.7 Å²	47.7	61%	0.612	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-71.8	-26.4	177.2	-60.9	-173.8	146.7	0	0	113.3	T1652	T1652-E1654 PolarHBondContact O-N 2.93Å
1655	N	79.7	Confident	77.5	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.005	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-134.1	43.1	-173.1	-72.9	78.8	0	0	0	111.2	C1648 P1649 H1650 T1652 M1653 F1657 P1694 R1696 S1697 G1698	C1648-N1655 CarbonylContact C-O 3.09Å; P1649-N1655 WeakPolarHBondContact CD-O 3.04Å; H1650-N1655 HydrophobicContact CB-CB 4.11Å; H1650-N1655 PolarHBondContact N-O 3.24Å; T1652-N1655 CarbonylContact O-C 3.58Å; T1652-N1655 PolarHBondContact O-N 2.9Å; M1653-N1655 VanDerWaalsContact C-N 3.32Å; N1655-F1657 HydrophobicContact CB-CE2 4.16Å; N1655-F1657 HydrophobicContact CB-CZ 4.37Å; N1655-P1694 PolarHBondContact ND2-O 2.84Å; N1655-R1696 PolarHBondContact ND2-O 2.97Å; N1655-S1697 WeakPolarHBondContact OD1-CA 3.4Å; N1655-G1698 PolarHBondContact OD1-N 2.88Å
1656	N	78	Confident	75.9	Confident	20 Å²	20	56.8 Å²	56.8	11%	0.107	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-108.7	118.5	162.8	-174	5.1	0	0	0	107.2	G1630 L1645 C1646 C1648 T1652 A1658	G1630-N1656 VanDerWaalsContact CA-ND2 3.31Å; G1630-N1656 WeakPolarHBondContact CA-ND2 3.39Å; G1630-N1656 PolarHBondContact O-ND2 3.19Å; L1645-N1656 WeakPolarHBondContact CD1-ND2 3.38Å; C1646-N1656 PolarHBondContact O-OD1 2.85Å; C1648-N1656 WeakPolarHBondContact O-CA 3.24Å; T1652-N1656 PolarHBondContact O-N 2.04Å; N1656-A1658 PolarHBondContact OD1-N 2.98Å
1657	F	87.8	Confident	74.8	Confident	1 Å²	1	59.5 Å²	59.5	0%	0.004	33%	0.33	C	S	.	.			trans	-125.2	23.5	-178.5	-51.3	-61	0	0	0	111.7	C1648 N1655 E1675 Y1678 C1683 P1694 N1699 K1700	C1648-F1657 PolarHBondContact O-N 3.03Å; N1655-F1657 HydrophobicContact CB-CE2 4.16Å; N1655-F1657 HydrophobicContact CB-CZ 4.37Å; F1657-E1675 PolarHBondContact O-N 3.15Å; F1657-Y1678 HydrophobicContact CB-CD1 3.41Å; F1657-Y1678 VanDerWaalsContact CB-CD1 3.41Å; F1657-Y1678 HydrophobicContact CB-CD2 4.05Å; F1657-Y1678 HydrophobicContact CB-CE1 3.65Å; F1657-Y1678 HydrophobicContact CB-CE2 4.27Å; F1657-Y1678 HydrophobicContact CB-CG 3.64Å; F1657-Y1678 HydrophobicContact CD1-CD1 4.14Å; F1657-Y1678 AromaticContact CD1-CE1 3.43Å; F1657-Y1678 HydrophobicContact CD1-CE1 3.43Å; F1657-Y1678 VanDerWaalsContact CD1-CE1 3.43Å; F1657-Y1678 HydrophobicContact CD1-CE2 4.18Å; F1657-Y1678 AromaticContact CD1-CZ 3.46Å; F1657-Y1678 VanDerWaalsContact CD1-CZ 3.46Å; F1657-Y1678 AromaticContact CD2-CD1 3.8Å; F1657-Y1678 HydrophobicContact CD2-CD1 3.8Å; F1657-Y1678 AromaticContact CD2-CE1 3.57Å; F1657-Y1678 HydrophobicContact CD2-CE1 3.57Å; F1657-Y1678 AromaticContact CE1-CE1 3.93Å; F1657-Y1678 HydrophobicContact CE1-CE1 3.93Å; F1657-Y1678 AromaticContact CE1-CZ 3.98Å; F1657-Y1678 HydrophobicContact CE2-CE1 4.05Å; F1657-Y1678 AromaticContact CG-CD1 3.51Å; F1657-Y1678 HydrophobicContact CG-CD1 3.51Å; F1657-Y1678 AromaticContact CG-CE1 3.23Å; F1657-Y1678 HydrophobicContact CG-CE1 3.23Å; F1657-Y1678 HydrophobicContact CG-CE2 4.39Å; F1657-Y1678 HydrophobicContact CG-CG 4.2Å; F1657-Y1678 AromaticContact CG-CZ 3.74Å; F1657-Y1678 HydrophobicContact CZ-CE1 4.21Å; F1657-C1683 HydrophobicContact CB-CB 4.06Å; F1657-P1694 HydrophobicContact CD2-CB 3.56Å; F1657-P1694 HydrophobicContact CE2-CB 3.41Å; F1657-P1694 VanDerWaalsContact CE2-CB 3.41Å; F1657-P1694 HydrophobicContact CZ-CB 4.42Å; F1657-N1699 VanDerWaalsContact CZ-O 3.3Å; F1657-N1699 WeakPolarHBondContact CZ-O 3.48Å; F1657-K1700 HydrophobicContact CE1-CB 4.48Å; F1657-K1700 HydrophobicContact CE1-CD 3.89Å; F1657-K1700 HydrophobicContact CE1-CG 3.8Å; F1657-K1700 HydrophobicContact CZ-CD 4.49Å; F1657-K1700 HydrophobicContact CZ-CG 3.94Å
1658	A	83	Confident	74.1	Confident	3 Å²	3	62.8 Å²	62.8	3%	0.025	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	148.3	172.6	0	0	0	0	0	111.6	G1630 C1646 C1648 N1656 D1660 C1672 H1673	G1630-A1658 WeakPolarHBondContact CA-O 3.03Å; G1630-A1658 PolarHBondContact N-O 3.26Å; G1630-A1658 VanDerWaalsContact N-O 3.15Å; C1646-A1658 HydrophobicContact CB-CB 4.14Å; C1648-A1658 HydrophobicContact CB-CB 3.67Å; N1656-A1658 PolarHBondContact OD1-N 2.98Å; A1658-D1660 WeakPolarHBondContact CB-O 3.49Å; A1658-C1672 HydrophobicContact CB-CB 4.13Å; A1658-H1673 CarbonylContact C-O 3.37Å; A1658-H1673 WeakPolarHBondContact CA-O 3.48Å; A1658-H1673 WeakPolarHBondContact CB-O 3.05Å
1659	L	83.1	Confident	73.3	Confident	60 Å²	60	63.5 Å²	63.5	31%	0.314	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	-47.2	159.5	-64.5	170.1	0	0	0	109.5	R1629 G1630 H1673 C1674 E1675	R1629-L1659 WeakPolarHBondContact CA-O 3.35Å; R1629-L1659 HydrophobicContact CG-CD2 4.21Å; R1629-L1659 VanDerWaalsContact CZ-CD2 3.45Å; G1630-L1659 PolarHBondContact N-O 2.76Å; L1659-H1673 PolarHBondContact N-O 3.42Å; L1659-C1674 WeakPolarHBondContact CD1-O 3.45Å; L1659-E1675 HydrophobicContact CD2-CG 3.89Å; L1659-E1675 HydrophobicContact CG-CG 4.17Å
1660	D	82.8	Confident	72.8	Confident	64 Å²	64	67.5 Å²	67.5	34%	0.342	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	177.7	173.2	73	76.6	0	0	0	110.4	A1658 H1673	A1658-D1660 WeakPolarHBondContact CB-O 3.49Å; D1660-H1673 VanDerWaalsContact CG-ND1 3.31Å; D1660-H1673 PolarHBondContact O-N 3.05Å; D1660-H1673 IonicContact OD1-CE1 2.6Å; D1660-H1673 IonicContact OD1-CG 2.82Å; D1660-H1673 IonicContact OD1-ND1 3.81Å; D1660-H1673 PolarHBondContact OD1-ND1 2.87Å; D1660-H1673 IonicContact OD2-CG 2.66Å; D1660-H1673 IonicContact OD2-ND1 2.69Å; D1660-H1673 PolarHBondContact OD2-ND1 2.82Å; D1660-H1673 VanDerWaalsContact OD2-ND1 3.15Å
1661	C	83.7	Confident	72.9	Confident	8 Å²	8	65 Å²	65	5%	0.054	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	149.4	171.5	61.1	0	0	0	0	113.8	H1632 C1646 L1669 A1671 C1672	H1632-C1661 WeakPolarHBondContact CB-O 3.36Å; C1646-C1661 WeakPolarHBondContact CA-SG 3.07Å; C1646-C1661 HydrophobicContact CB-CB 3.96Å; C1646-C1661 WeakPolarHBondContact CB-SG 3.44Å; C1646-C1661 WeakPolarHBondContact SG-CB 3.38Å; C1646-C1661 PolarHBondContact SG-N 3.31Å; C1646-C1661 CovalentContact SG-SG 2.05Å; C1646-C1661 PolarHBondContact SG-SG 2.77Å; C1661-L1669 HydrophobicContact CB-CD1 3.56Å; C1661-A1671 CarbonylContact C-O 3.55Å; C1661-A1671 WeakPolarHBondContact CA-O 3.37Å; C1661-A1671 WeakPolarHBondContact CB-O 3.25Å; C1661-C1672 HydrophobicContact CB-CB 4.18Å
1662	T	78	Confident	73.5	Confident	64 Å²	64	61.5 Å²	61.5	39%	0.393	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	135.4	170.9	57.6	0	0	0	0	110.5	L1670 A1671	T1662-L1670 WeakPolarHBondContact O-CB 3.32Å; T1662-L1670 PolarHBondContact O-N 3.32Å; T1662-A1671 PolarHBondContact N-O 2.93Å; T1662-A1671 PolarHBondContact O-N 3.21Å; T1662-A1671 PolarHBondContact OG1-N 2.93Å; T1662-A1671 PolarHBondContact OG1-O 3.44Å
1663	V	67.1	Low	74	Confident	43 Å²	43	63.9 Å²	63.9	26%	0.261	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	137.6	-175.6	-179.1	0	0	0	0	108.6	H1632 G1667 L1669	H1632-V1663 WeakPolarHBondContact CD2-CG2 3.17Å; H1632-V1663 VanDerWaalsContact NE2-CG2 3.34Å; H1632-V1663 WeakPolarHBondContact NE2-CG2 3.42Å; V1663-G1667 VanDerWaalsContact CG1-C 3.47Å; V1663-L1669 HydrophobicContact CG2-CD1 4.03Å
1664	S	63.7	Low	74.6	Confident	31 Å²	31	58.9 Å²	58.9	22%	0.217	33%	0.327	C	S	.	.			trans	-73.1	164.6	-177.5	81.6	0	0	0	0	112.6	I1666 G1667 N1668	S1664-I1666 PolarHBondContact O-N 3.19Å; S1664-I1666 PolarHBondContact OG-N 3.46Å; S1664-G1667 PolarHBondContact O-N 3.15Å; S1664-N1668 PolarHBondContact N-O 3.29Å; S1664-N1668 PolarHBondContact OG-N 3.5Å
1665	E	57.9	Low	74.9	Confident	207 Å²	207	55.4 Å²	55.4	97%	0.967	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	-19.7	173.5	-60.6	175.3	-176.7	0	0	114.4
1666	I	53.1	Low	75	Confident	143 Å²	143	62.1 Å²	62.1	73%	0.733	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	5.3	179.6	-24.4	178.4	0	0	0	112.3	S1664 N1668	S1664-I1666 PolarHBondContact O-N 3.19Å; S1664-I1666 PolarHBondContact OG-N 3.46Å; I1666-N1668 VanDerWaalsContact C-N 3.34Å
1667	G	60.1	Low	75.4	Confident	57 Å²	57	61.3 Å²	61.3	59%	0.588	34%	0.338	S	S	*	.	S	Bend	trans	77.2	13.3	-175.5	0	0	0	0	0	114.7	V1663 S1664	V1663-G1667 VanDerWaalsContact CG1-C 3.47Å; S1664-G1667 PolarHBondContact O-N 3.15Å
1668	N	65.8	Low	75.5	Confident	99 Å²	99	62.3 Å²	62.3	53%	0.529	34%	0.342	S	S	.	.			trans	-88.7	118.8	177.4	-71.8	-46.5	0	0	0	110.5	S1664 I1666 L1670	S1664-N1668 PolarHBondContact N-O 3.29Å; S1664-N1668 PolarHBondContact OG-N 3.5Å; I1666-N1668 VanDerWaalsContact C-N 3.34Å; N1668-L1670 PolarHBondContact O-N 3.25Å
1669	L	68	Low	75.6	Confident	15 Å²	15	65.3 Å²	65.3	8%	0.079	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.7	118.3	173.3	173.3	66.7	0	0	0	111.2	P1647 C1661 V1663 C1672 R1682	P1647-L1669 HydrophobicContact CB-CD2 4.45Å; P1647-L1669 HydrophobicContact CG-CB 4.05Å; P1647-L1669 HydrophobicContact CG-CD2 3.74Å; P1647-L1669 HydrophobicContact CG-CG 4.36Å; P1647-L1669 WeakPolarHBondContact O-CD2 3.47Å; C1661-L1669 HydrophobicContact CB-CD1 3.56Å; V1663-L1669 HydrophobicContact CG2-CD1 4.03Å; L1669-C1672 VanDerWaalsContact CD2-SG 3.54Å; L1669-R1682 HydrophobicContact CD2-CG 3.95Å; L1669-R1682 PolarHBondContact O-NH2 2.04Å
1670	L	66.6	Low	75.4	Confident	108 Å²	108	63.3 Å²	63.3	57%	0.565	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.3	-57.4	-179	-70.5	168.4	0	0	0	110.9	T1662 N1668	T1662-L1670 WeakPolarHBondContact O-CB 3.32Å; T1662-L1670 PolarHBondContact O-N 3.32Å; N1668-L1670 PolarHBondContact O-N 3.25Å
1671	A	76.5	Confident	75.2	Confident	37 Å²	37	67 Å²	67	31%	0.306	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	151.3	176.1	0	0	0	0	0	111.7	C1661 T1662	C1661-A1671 CarbonylContact C-O 3.55Å; C1661-A1671 WeakPolarHBondContact CA-O 3.37Å; C1661-A1671 WeakPolarHBondContact CB-O 3.25Å; T1662-A1671 PolarHBondContact N-O 2.93Å; T1662-A1671 PolarHBondContact O-N 3.21Å; T1662-A1671 PolarHBondContact OG1-N 2.93Å; T1662-A1671 PolarHBondContact OG1-O 3.44Å
1672	C	84	Confident	75.3	Confident	12 Å²	12	71.8 Å²	71.8	8%	0.081	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	138.1	172.9	-47.2	0	0	0	0	111.2	C1648 A1658 C1661 L1669 E1681 R1682 C1683	C1648-C1672 HydrophobicContact CB-CB 3.76Å; C1648-C1672 WeakPolarHBondContact CB-SG 3.23Å; C1648-C1672 WeakPolarHBondContact SG-CB 3.43Å; C1648-C1672 CovalentContact SG-SG 2.02Å; C1648-C1672 PolarHBondContact SG-SG 3Å; A1658-C1672 HydrophobicContact CB-CB 4.13Å; C1661-C1672 HydrophobicContact CB-CB 4.18Å; L1669-C1672 VanDerWaalsContact CD2-SG 3.54Å; C1672-E1681 PolarHBondContact N-O 3.31Å; C1672-E1681 PolarHBondContact SG-O 2.9Å; C1672-R1682 VanDerWaalsContact SG-CA 3.59Å; C1672-C1683 VanDerWaalsContact CB-SG 3.58Å
1673	H	85	Confident	75.8	Confident	104 Å²	104	68.7 Å²	68.7	48%	0.481	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	123.6	163.6	-64.4	119.5	0	0	0	108.5	A1658 L1659 D1660	A1658-H1673 CarbonylContact C-O 3.37Å; A1658-H1673 WeakPolarHBondContact CA-O 3.48Å; A1658-H1673 WeakPolarHBondContact CB-O 3.05Å; L1659-H1673 PolarHBondContact N-O 3.42Å; D1660-H1673 VanDerWaalsContact CG-ND1 3.31Å; D1660-H1673 PolarHBondContact O-N 3.05Å; D1660-H1673 IonicContact OD1-CE1 2.6Å; D1660-H1673 IonicContact OD1-CG 2.82Å; D1660-H1673 IonicContact OD1-ND1 3.81Å; D1660-H1673 PolarHBondContact OD1-ND1 2.87Å; D1660-H1673 IonicContact OD2-CG 2.66Å; D1660-H1673 IonicContact OD2-ND1 2.69Å; D1660-H1673 PolarHBondContact OD2-ND1 2.82Å; D1660-H1673 VanDerWaalsContact OD2-ND1 3.15Å
1674	C	86.7	Confident	76.6	Confident	29 Å²	29	68.9 Å²	68.9	20%	0.196	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	151.9	-166.8	-58.1	0	0	0	0	114.1	L1659 Y1678 C1683	L1659-C1674 WeakPolarHBondContact CD1-O 3.45Å; C1674-Y1678 WeakPolarHBondContact CB-O 3.32Å; C1674-C1683 WeakPolarHBondContact CA-SG 3.08Å; C1674-C1683 HydrophobicContact CB-CB 3.93Å; C1674-C1683 WeakPolarHBondContact CB-SG 3.22Å; C1674-C1683 WeakPolarHBondContact SG-CA 3.07Å; C1674-C1683 WeakPolarHBondContact SG-CB 3.4Å; C1674-C1683 CovalentContact SG-SG 2.04Å; C1674-C1683 PolarHBondContact SG-SG 3.18Å
1675	E	83.4	Confident	77.8	Confident	57 Å²	57	74.4 Å²	74.4	27%	0.266	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-66.2	161.8	171.9	-65.2	-147	110.3	0	0	112.2	R1629 F1657 L1659 G1677 Y1678	R1629-E1675 IonicContact CZ-OE1 3.94Å; R1629-E1675 IonicContact NH1-OE1 2.76Å; R1629-E1675 PolarHBondContact NH1-OE1 2.8Å; F1657-E1675 PolarHBondContact O-N 3.15Å; L1659-E1675 HydrophobicContact CD2-CG 3.89Å; L1659-E1675 HydrophobicContact CG-CG 4.17Å; E1675-G1677 PolarHBondContact O-N 3.11Å; E1675-G1677 VanDerWaalsContact O-N 3.13Å; E1675-Y1678 HydrophobicContact CB-CD2 4.01Å; E1675-Y1678 HydrophobicContact CB-CE2 4.43Å; E1675-Y1678 PolarHBondContact O-N 3.35Å
1676	E	81	Confident	79.2	Confident	142 Å²	142	65 Å²	65	66%	0.664	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	122.7	176.2	-168.5	-168.5	155.4	0	0	110.2	W1690 R1703	E1676-W1690 HydrophobicContact CG-CZ2 4Å; E1676-R1703 IonicContact OE1-NH1 2.63Å; E1676-R1703 PolarHBondContact OE1-NH1 3.41Å; E1676-R1703 VanDerWaalsContact OE1-NH1 3.08Å
1677	G	86.9	Confident	80.8	Confident	3 Å²	3	59.4 Å²	59.4	3%	0.031	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	100.7	-2.9	-177.5	0	0	0	0	0	115.7	E1675 C1686 A1687 W1690 C1701	E1675-G1677 PolarHBondContact O-N 3.11Å; E1675-G1677 VanDerWaalsContact O-N 3.13Å; G1677-C1686 CarbonylContact O-C 3.54Å; G1677-C1686 VanDerWaalsContact O-CA 3.3Å; G1677-C1686 WeakPolarHBondContact O-CA 3.47Å; G1677-A1687 PolarHBondContact O-N 3.29Å; G1677-W1690 VanDerWaalsContact CA-CG 3.45Å; G1677-C1701 VanDerWaalsContact O-CB 3.27Å; G1677-C1701 WeakPolarHBondContact O-CB 3.48Å; G1677-C1701 PolarHBondContact O-SG 3.38Å
1678	Y	89.3	Confident	81.9	Confident	22 Å²	22	59.6 Å²	59.6	9%	0.086	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	151.5	-179.6	-57.6	-97.6	0	0	0	111.8	F1657 C1674 E1675 R1685 P1694 K1700 C1701	F1657-Y1678 HydrophobicContact CB-CD1 3.41Å; F1657-Y1678 VanDerWaalsContact CB-CD1 3.41Å; F1657-Y1678 HydrophobicContact CB-CD2 4.05Å; F1657-Y1678 HydrophobicContact CB-CE1 3.65Å; F1657-Y1678 HydrophobicContact CB-CE2 4.27Å; F1657-Y1678 HydrophobicContact CB-CG 3.64Å; F1657-Y1678 HydrophobicContact CD1-CD1 4.14Å; F1657-Y1678 AromaticContact CD1-CE1 3.43Å; F1657-Y1678 HydrophobicContact CD1-CE1 3.43Å; F1657-Y1678 VanDerWaalsContact CD1-CE1 3.43Å; F1657-Y1678 HydrophobicContact CD1-CE2 4.18Å; F1657-Y1678 AromaticContact CD1-CZ 3.46Å; F1657-Y1678 VanDerWaalsContact CD1-CZ 3.46Å; F1657-Y1678 AromaticContact CD2-CD1 3.8Å; F1657-Y1678 HydrophobicContact CD2-CD1 3.8Å; F1657-Y1678 AromaticContact CD2-CE1 3.57Å; F1657-Y1678 HydrophobicContact CD2-CE1 3.57Å; F1657-Y1678 AromaticContact CE1-CE1 3.93Å; F1657-Y1678 HydrophobicContact CE1-CE1 3.93Å; F1657-Y1678 AromaticContact CE1-CZ 3.98Å; F1657-Y1678 HydrophobicContact CE2-CE1 4.05Å; F1657-Y1678 AromaticContact CG-CD1 3.51Å; F1657-Y1678 HydrophobicContact CG-CD1 3.51Å; F1657-Y1678 AromaticContact CG-CE1 3.23Å; F1657-Y1678 HydrophobicContact CG-CE1 3.23Å; F1657-Y1678 HydrophobicContact CG-CE2 4.39Å; F1657-Y1678 HydrophobicContact CG-CG 4.2Å; F1657-Y1678 AromaticContact CG-CZ 3.74Å; F1657-Y1678 HydrophobicContact CZ-CE1 4.21Å; C1674-Y1678 WeakPolarHBondContact CB-O 3.32Å; E1675-Y1678 HydrophobicContact CB-CD2 4.01Å; E1675-Y1678 HydrophobicContact CB-CE2 4.43Å; E1675-Y1678 PolarHBondContact O-N 3.35Å; Y1678-R1685 WeakPolarHBondContact CA-O 3.44Å; Y1678-P1694 HydrophobicContact CD1-CB 4.11Å; Y1678-P1694 HydrophobicContact CD1-CG 4.38Å; Y1678-P1694 HydrophobicContact CE1-CB 4.07Å; Y1678-K1700 WeakPolarHBondContact OH-CB 3.48Å; Y1678-C1701 HydrophobicContact CD1-CB 3.93Å; Y1678-C1701 WeakPolarHBondContact CD1-SG 3.43Å; Y1678-C1701 HydrophobicContact CE1-CB 3.6Å; Y1678-C1701 WeakPolarHBondContact CE1-SG 3.43Å; Y1678-C1701 HydrophobicContact CE2-CB 4.22Å; Y1678-C1701 HydrophobicContact CG-CB 4.37Å; Y1678-C1701 PolarHBondContact OH-N 2.89Å; Y1678-C1701 VanDerWaalsContact OH-N 3.16Å
1679	T	84.2	Confident	82.8	Confident	66 Å²	66	55 Å²	55	41%	0.405	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	176.5	-179.4	-163.7	0	0	0	0	112.1	C1683 E1684 R1685 C1686	T1679-C1683 CarbonylContact O-C 3.36Å; T1679-C1683 VanDerWaalsContact O-CA 3.31Å; T1679-C1683 WeakPolarHBondContact O-CA 3.41Å; T1679-E1684 PolarHBondContact O-N 2.78Å; T1679-R1685 HydrophobicContact CG2-CB 3.79Å; T1679-R1685 PolarHBondContact N-O 2.83Å; T1679-R1685 CarbonylContact O-C 3.47Å; T1679-R1685 WeakPolarHBondContact O-CA 3.39Å; T1679-R1685 WeakPolarHBondContact O-CB 3.44Å; T1679-R1685 PolarHBondContact O-N 2.75Å; T1679-R1685 VanDerWaalsContact O-O 3.08Å; T1679-C1686 VanDerWaalsContact CG2-O 3.24Å; T1679-C1686 WeakPolarHBondContact CG2-O 3.29Å
1680	G	79.8	Confident	83.9	Confident	18 Å²	18	56.6 Å²	56.6	19%	0.186	28%	0.284	C	S	.	.	S	Bend	trans	89.3	157.1	-170.6	0	0	0	0	0	111.9	R1682 C1683 E1684	G1680-R1682 PolarHBondContact O-N 2.87Å; G1680-C1683 PolarHBondContact O-N 3.17Å; G1680-E1684 VanDerWaalsContact C-OE2 3.29Å; G1680-E1684 WeakPolarHBondContact CA-OE2 3.21Å
1681	E	79.2	Confident	84.9	Confident	141 Å²	141	54.6 Å²	54.6	66%	0.659	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-16.3	-173.5	-63.5	-178	156.6	0	0	113.9	C1672 E1684	C1672-E1681 PolarHBondContact N-O 3.31Å; C1672-E1681 PolarHBondContact SG-O 2.9Å; E1681-E1684 PolarHBondContact N-OE2 3.3Å
1682	R	85.5	Confident	85.4	Confident	109 Å²	109	53.5 Å²	53.5	41%	0.411	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.1	17.6	175.8	-57.7	-162	169.6	-141.5	-6.9	113.5	C1648 P1649 L1669 C1672 G1680 E1684	C1648-R1682 CarbonylContact C-O 3.4Å; C1648-R1682 WeakPolarHBondContact CA-O 3.49Å; P1649-R1682 WeakPolarHBondContact CA-O 3.25Å; P1649-R1682 HydrophobicContact CB-CB 4.41Å; P1649-R1682 WeakPolarHBondContact CB-O 3.5Å; L1669-R1682 HydrophobicContact CD2-CG 3.95Å; L1669-R1682 PolarHBondContact O-NH2 2.04Å; C1672-R1682 VanDerWaalsContact SG-CA 3.59Å; G1680-R1682 PolarHBondContact O-N 2.87Å; R1682-E1684 VanDerWaalsContact CA-OE2 3.3Å; R1682-E1684 WeakPolarHBondContact CA-OE2 3.5Å; R1682-E1684 HydrophobicContact CB-CB 4.44Å; R1682-E1684 PolarHBondContact N-OE2 2.83Å; R1682-E1684 PolarHBondContact O-N 3.41Å
1683	C	87.9	Confident	85.4	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	27%	0.269	C	S	.	.	S	Bend	trans	54	30.5	-171.6	-47.1	0	0	0	0	112.6	C1648 F1657 C1672 C1674 T1679 G1680 R1685	C1648-C1683 HydrophobicContact CB-CB 4.47Å; F1657-C1683 HydrophobicContact CB-CB 4.06Å; C1672-C1683 VanDerWaalsContact CB-SG 3.58Å; C1674-C1683 WeakPolarHBondContact CA-SG 3.08Å; C1674-C1683 HydrophobicContact CB-CB 3.93Å; C1674-C1683 WeakPolarHBondContact CB-SG 3.22Å; C1674-C1683 WeakPolarHBondContact SG-CA 3.07Å; C1674-C1683 WeakPolarHBondContact SG-CB 3.4Å; C1674-C1683 CovalentContact SG-SG 2.04Å; C1674-C1683 PolarHBondContact SG-SG 3.18Å; T1679-C1683 CarbonylContact O-C 3.36Å; T1679-C1683 VanDerWaalsContact O-CA 3.31Å; T1679-C1683 WeakPolarHBondContact O-CA 3.41Å; G1680-C1683 PolarHBondContact O-N 3.17Å; C1683-R1685 VanDerWaalsContact C-N 3.32Å
1684	E	85.2	Confident	85.3	Confident	46 Å²	46	50.6 Å²	50.6	22%	0.215	25%	0.247	C	C	.	.			trans	-85.4	-3.2	-174.4	80.3	-65.2	162.6	0	0	113.8	P1649 T1679 G1680 E1681 R1682 P1694	P1649-E1684 HydrophobicContact CB-CB 3.85Å; T1679-E1684 PolarHBondContact O-N 2.78Å; G1680-E1684 VanDerWaalsContact C-OE2 3.29Å; G1680-E1684 WeakPolarHBondContact CA-OE2 3.21Å; E1681-E1684 PolarHBondContact N-OE2 3.3Å; R1682-E1684 VanDerWaalsContact CA-OE2 3.3Å; R1682-E1684 WeakPolarHBondContact CA-OE2 3.5Å; R1682-E1684 HydrophobicContact CB-CB 4.44Å; R1682-E1684 PolarHBondContact N-OE2 2.83Å; R1682-E1684 PolarHBondContact O-N 3.41Å; E1684-P1694 WeakPolarHBondContact O-CG 3.22Å
1685	R	88.1	Confident	84.9	Confident	148 Å²	148	54.4 Å²	54.4	56%	0.558	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125	165.3	176.1	-71.5	171.1	-99.9	-171.1	-6.4	110.3	Y1678 T1679 C1683	Y1678-R1685 WeakPolarHBondContact CA-O 3.44Å; T1679-R1685 HydrophobicContact CG2-CB 3.79Å; T1679-R1685 PolarHBondContact N-O 2.83Å; T1679-R1685 CarbonylContact O-C 3.47Å; T1679-R1685 WeakPolarHBondContact O-CA 3.39Å; T1679-R1685 WeakPolarHBondContact O-CB 3.44Å; T1679-R1685 PolarHBondContact O-N 2.75Å; T1679-R1685 VanDerWaalsContact O-O 3.08Å; C1683-R1685 VanDerWaalsContact C-N 3.32Å
1686	C	88.1	Confident	84.7	Confident	9 Å²	9	58.2 Å²	58.2	6%	0.061	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	144.4	172.2	-57.2	0	0	0	0	111	G1677 T1679 W1690 G1692 C1701	G1677-C1686 CarbonylContact O-C 3.54Å; G1677-C1686 VanDerWaalsContact O-CA 3.3Å; G1677-C1686 WeakPolarHBondContact O-CA 3.47Å; T1679-C1686 VanDerWaalsContact CG2-O 3.24Å; T1679-C1686 WeakPolarHBondContact CG2-O 3.29Å; C1686-W1690 HydrophobicContact CB-CB 4.1Å; C1686-W1690 WeakPolarHBondContact CB-O 3.43Å; C1686-G1692 VanDerWaalsContact SG-CA 3.59Å; C1686-G1692 PolarHBondContact SG-N 3.05Å; C1686-C1701 WeakPolarHBondContact CA-SG 3.45Å; C1686-C1701 HydrophobicContact CB-CB 3.8Å; C1686-C1701 WeakPolarHBondContact CB-SG 3.42Å; C1686-C1701 WeakPolarHBondContact SG-CB 3.45Å; C1686-C1701 CovalentContact SG-SG 2.03Å; C1686-C1701 PolarHBondContact SG-SG 2.97Å
1687	A	84.8	Confident	84.1	Confident	25 Å²	25	55.7 Å²	55.7	21%	0.207	27%	0.268	C	S	.	.			trans	-70.6	165.8	-179.7	0	0	0	0	0	112.2	G1677 G1689 W1690	G1677-A1687 PolarHBondContact O-N 3.29Å; A1687-G1689 PolarHBondContact O-N 2.81Å; A1687-W1690 WeakPolarHBondContact O-CB 3.36Å; A1687-W1690 PolarHBondContact O-N 2.82Å
1688	T	84.5	Confident	83.5	Confident	61 Å²	61	58.1 Å²	58.1	37%	0.374	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.8	124.2	172.6	-63.5	0	0	0	0	112	S1713 V1714	T1688-S1713 WeakPolarHBondContact CG2-O 3.48Å; T1688-V1714 VanDerWaalsContact CG2-C 3.4Å; T1688-V1714 WeakPolarHBondContact CG2-O 3.45Å
1689	G	84.9	Confident	82.9	Confident	3 Å²	3	60.6 Å²	60.6	3%	0.031	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.7	7.8	-177	0	0	0	0	0	115.5	A1687 C1704	A1687-G1689 PolarHBondContact O-N 2.81Å; G1689-C1704 WeakPolarHBondContact O-CB 3.39Å; G1689-C1704 PolarHBondContact O-N 3.04Å
1690	W	89.8	Confident	82.8	Confident	49 Å²	49	63 Å²	63	19%	0.186	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	156.7	178.6	-61.9	69.9	0	0	0	112	E1676 G1677 C1686 A1687 C1701 Q1702 R1703	E1676-W1690 HydrophobicContact CG-CZ2 4Å; G1677-W1690 VanDerWaalsContact CA-CG 3.45Å; C1686-W1690 HydrophobicContact CB-CB 4.1Å; C1686-W1690 WeakPolarHBondContact CB-O 3.43Å; A1687-W1690 WeakPolarHBondContact O-CB 3.36Å; A1687-W1690 PolarHBondContact O-N 2.82Å; W1690-C1701 HydrophobicContact CE3-CB 4.42Å; W1690-Q1702 CarbonylContact C-O 3.49Å; W1690-Q1702 VanDerWaalsContact CA-O 3.23Å; W1690-Q1702 WeakPolarHBondContact CA-O 3.39Å; W1690-Q1702 WeakPolarHBondContact CB-O 3.45Å; W1690-R1703 HydrophobicContact CD2-CB 3.95Å; W1690-R1703 HydrophobicContact CD2-CG 4.34Å; W1690-R1703 HydrophobicContact CE3-CB 4.06Å; W1690-R1703 HydrophobicContact CH2-CB 4.23Å; W1690-R1703 HydrophobicContact CZ2-CB 4.14Å; W1690-R1703 HydrophobicContact CZ2-CG 4.32Å; W1690-R1703 HydrophobicContact CZ3-CB 4.19Å
1691	Y	88.5	Confident	83.2	Confident	66 Å²	66	62.5 Å²	62.5	26%	0.259	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	154.6	-177.9	80.2	-78.5	0	0	0	113.6	C1701 Q1702 D1719 P1720 S1722 G1723	Y1691-C1701 CarbonylContact O-C 3.18Å; Y1691-C1701 WeakPolarHBondContact O-CA 3.4Å; Y1691-Q1702 HydrophobicContact CD1-CB 4.17Å; Y1691-Q1702 WeakPolarHBondContact CD1-O 3.39Å; Y1691-Q1702 HydrophobicContact CE1-CB 3.65Å; Y1691-Q1702 PolarHBondContact N-O 2.88Å; Y1691-Q1702 PolarHBondContact O-N 3.28Å; Y1691-Q1702 PolarHBondContact OH-OE1 2.95Å; Y1691-D1719 WeakPolarHBondContact CB-O 3.32Å; Y1691-P1720 CarbonylContact C-O 3.58Å; Y1691-P1720 VanDerWaalsContact CA-O 3.29Å; Y1691-P1720 WeakPolarHBondContact CA-O 3.34Å; Y1691-S1722 WeakPolarHBondContact CD2-O 3.28Å; Y1691-S1722 WeakPolarHBondContact CE2-O 3.43Å; Y1691-G1723 VanDerWaalsContact CB-CA 3.42Å; Y1691-G1723 VanDerWaalsContact CD2-CA 3.45Å; Y1691-G1723 VanDerWaalsContact CD2-N 3.28Å
1692	G	87	Confident	83.5	Confident	14 Å²	14	61.1 Å²	61.1	14%	0.144	30%	0.299	C	S	.	.			trans	152.4	-171.5	178.7	0	0	0	0	0	113.7	C1686 P1720	C1686-G1692 VanDerWaalsContact SG-CA 3.59Å; C1686-G1692 PolarHBondContact SG-N 3.05Å; G1692-P1720 PolarHBondContact N-O 3.39Å
1693	K	83.4	Confident	83.5	Confident	54 Å²	54	62.5 Å²	62.5	24%	0.235	30%	0.304	C	S	.	.			trans	-133.8	66.9	-179.7	-67.8	171.4	-174.7	-90.8	0	110.8	Y1695 R1696 N1699 E1721	K1693-Y1695 HydrophobicContact CB-CD1 4.42Å; K1693-Y1695 HydrophobicContact CB-CE1 3.89Å; K1693-Y1695 HydrophobicContact CG-CE1 4.12Å; K1693-Y1695 PolarHBondContact O-N 3.18Å; K1693-R1696 PolarHBondContact O-N 3.07Å; K1693-N1699 WeakPolarHBondContact O-CB 3.03Å; K1693-E1721 IonicContact NZ-OE1 2.97Å; K1693-E1721 PolarHBondContact NZ-OE1 2.7Å; K1693-E1721 IonicContact NZ-OE2 2.71Å; K1693-E1721 PolarHBondContact NZ-OE2 2.79Å
1694	P	82.4	Confident	83.3	Confident	1 Å²	1	62.7 Å²	62.7	1%	0.006	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-19	-171.1	24.2	-34.3	0	0	0	114.5	P1649 N1655 F1657 Y1678 E1684 R1696	P1649-P1694 WeakPolarHBondContact CG-O 3.47Å; N1655-P1694 PolarHBondContact ND2-O 2.84Å; F1657-P1694 HydrophobicContact CD2-CB 3.56Å; F1657-P1694 HydrophobicContact CE2-CB 3.41Å; F1657-P1694 VanDerWaalsContact CE2-CB 3.41Å; F1657-P1694 HydrophobicContact CZ-CB 4.42Å; Y1678-P1694 HydrophobicContact CD1-CB 4.11Å; Y1678-P1694 HydrophobicContact CD1-CG 4.38Å; Y1678-P1694 HydrophobicContact CE1-CB 4.07Å; E1684-P1694 WeakPolarHBondContact O-CG 3.22Å; P1694-R1696 PolarHBondContact O-N 3.45Å
1695	Y	80.2	Confident	83.4	Confident	109 Å²	109	66.4 Å²	66.4	43%	0.427	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-3.8	172.7	67.1	-94.1	0	0	0	115	K1693 E1721	K1693-Y1695 HydrophobicContact CB-CD1 4.42Å; K1693-Y1695 HydrophobicContact CB-CE1 3.89Å; K1693-Y1695 HydrophobicContact CG-CE1 4.12Å; K1693-Y1695 PolarHBondContact O-N 3.18Å; Y1695-E1721 PolarHBondContact OH-OE1 3.24Å
1696	R	78.5	Confident	83.3	Confident	137 Å²	137	59.7 Å²	59.7	52%	0.517	30%	0.297	S	S	.	.	S	Bend	trans	-109.1	132	176.4	-63.8	-172.2	178.7	-154.2	-2.6	111.6	N1655 K1693 P1694 G1698 N1699	N1655-R1696 PolarHBondContact ND2-O 2.97Å; K1693-R1696 PolarHBondContact O-N 3.07Å; P1694-R1696 PolarHBondContact O-N 3.45Å; R1696-G1698 PolarHBondContact O-N 3.05Å; R1696-N1699 HydrophobicContact CB-CB 4.3Å; R1696-N1699 WeakPolarHBondContact O-CB 3.47Å; R1696-N1699 PolarHBondContact O-N 2.82Å; R1696-N1699 PolarHBondContact O-ND2 3.12Å
1697	S	68.4	Low	83.1	Confident	89 Å²	89	61 Å²	61	62%	0.622	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.7	129	179.3	-57.6	0	0	0	0	113.2	N1655 N1699	N1655-S1697 WeakPolarHBondContact OD1-CA 3.4Å; S1697-N1699 PolarHBondContact O-N 2.87Å; S1697-N1699 PolarHBondContact O-ND2 2.82Å
1698	G	73.1	Confident	82.9	Confident	53 Å²	53	66.9 Å²	66.9	55%	0.546	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.9	-5.5	179.9	0	0	0	0	0	116.6	N1655 R1696	N1655-G1698 PolarHBondContact OD1-N 2.88Å; R1696-G1698 PolarHBondContact O-N 3.05Å
1699	N	77.9	Confident	82.7	Confident	75 Å²	75	64 Å²	64	40%	0.401	31%	0.314	S	S	.	.			trans	-88	138.4	177.5	-67	-103.9	0	0	0	110.4	F1657 K1693 R1696 S1697	F1657-N1699 VanDerWaalsContact CZ-O 3.3Å; F1657-N1699 WeakPolarHBondContact CZ-O 3.48Å; K1693-N1699 WeakPolarHBondContact O-CB 3.03Å; R1696-N1699 HydrophobicContact CB-CB 4.3Å; R1696-N1699 WeakPolarHBondContact O-CB 3.47Å; R1696-N1699 PolarHBondContact O-N 2.82Å; R1696-N1699 PolarHBondContact O-ND2 3.12Å; S1697-N1699 PolarHBondContact O-N 2.87Å; S1697-N1699 PolarHBondContact O-ND2 2.82Å
1700	K	81.1	Confident	82.5	Confident	115 Å²	115	64.9 Å²	64.9	50%	0.5	32%	0.318	S	S	.	.			trans	-130	158	-175.9	-62.7	-152.7	174.7	-154.8	0	110.4	F1657 Y1678	F1657-K1700 HydrophobicContact CE1-CB 4.48Å; F1657-K1700 HydrophobicContact CE1-CD 3.89Å; F1657-K1700 HydrophobicContact CE1-CG 3.8Å; F1657-K1700 HydrophobicContact CZ-CD 4.49Å; F1657-K1700 HydrophobicContact CZ-CG 3.94Å; Y1678-K1700 WeakPolarHBondContact OH-CB 3.48Å
1701	C	88.8	Confident	82	Confident	8 Å²	8	65.7 Å²	65.7	5%	0.054	33%	0.326	C	S	.	.			trans	-76.1	142.5	172.3	-64.8	0	0	0	0	110.4	G1677 Y1678 C1686 W1690 Y1691	G1677-C1701 VanDerWaalsContact O-CB 3.27Å; G1677-C1701 WeakPolarHBondContact O-CB 3.48Å; G1677-C1701 PolarHBondContact O-SG 3.38Å; Y1678-C1701 HydrophobicContact CD1-CB 3.93Å; Y1678-C1701 WeakPolarHBondContact CD1-SG 3.43Å; Y1678-C1701 HydrophobicContact CE1-CB 3.6Å; Y1678-C1701 WeakPolarHBondContact CE1-SG 3.43Å; Y1678-C1701 HydrophobicContact CE2-CB 4.22Å; Y1678-C1701 HydrophobicContact CG-CB 4.37Å; Y1678-C1701 PolarHBondContact OH-N 2.89Å; Y1678-C1701 VanDerWaalsContact OH-N 3.16Å; C1686-C1701 WeakPolarHBondContact CA-SG 3.45Å; C1686-C1701 HydrophobicContact CB-CB 3.8Å; C1686-C1701 WeakPolarHBondContact CB-SG 3.42Å; C1686-C1701 WeakPolarHBondContact SG-CB 3.45Å; C1686-C1701 CovalentContact SG-SG 2.03Å; C1686-C1701 PolarHBondContact SG-SG 2.97Å; W1690-C1701 HydrophobicContact CE3-CB 4.42Å; Y1691-C1701 CarbonylContact O-C 3.18Å; Y1691-C1701 WeakPolarHBondContact O-CA 3.4Å
1702	Q	85.1	Confident	81.4	Confident	112 Å²	112	64.5 Å²	64.5	52%	0.523	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	143.7	177.1	-64.7	-172.9	2.9	0	0	110	W1690 Y1691	W1690-Q1702 CarbonylContact C-O 3.49Å; W1690-Q1702 VanDerWaalsContact CA-O 3.23Å; W1690-Q1702 WeakPolarHBondContact CA-O 3.39Å; W1690-Q1702 WeakPolarHBondContact CB-O 3.45Å; Y1691-Q1702 HydrophobicContact CD1-CB 4.17Å; Y1691-Q1702 WeakPolarHBondContact CD1-O 3.39Å; Y1691-Q1702 HydrophobicContact CE1-CB 3.65Å; Y1691-Q1702 PolarHBondContact N-O 2.88Å; Y1691-Q1702 PolarHBondContact O-N 3.28Å; Y1691-Q1702 PolarHBondContact OH-OE1 2.95Å
1703	R	84.9	Confident	81	Confident	138 Å²	138	68.1 Å²	68.1	52%	0.521	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	134.7	177.6	-163.1	-178.8	-168	102.4	-1.7	109.7	E1676 W1690	E1676-R1703 IonicContact OE1-NH1 2.63Å; E1676-R1703 PolarHBondContact OE1-NH1 3.41Å; E1676-R1703 VanDerWaalsContact OE1-NH1 3.08Å; W1690-R1703 HydrophobicContact CD2-CB 3.95Å; W1690-R1703 HydrophobicContact CD2-CG 4.34Å; W1690-R1703 HydrophobicContact CE3-CB 4.06Å; W1690-R1703 HydrophobicContact CH2-CB 4.23Å; W1690-R1703 HydrophobicContact CZ2-CB 4.14Å; W1690-R1703 HydrophobicContact CZ2-CG 4.32Å; W1690-R1703 HydrophobicContact CZ3-CB 4.19Å
1704	C	85.2	Confident	80.6	Confident	5 Å²	5	68.6 Å²	68.6	3%	0.034	35%	0.354	C	S	.	.			trans	-68.3	136.8	178.8	-67.5	0	0	0	0	111.2	G1689 L1712 C1718	G1689-C1704 WeakPolarHBondContact O-CB 3.39Å; G1689-C1704 PolarHBondContact O-N 3.04Å; C1704-L1712 HydrophobicContact CB-CD2 4.02Å; C1704-L1712 WeakPolarHBondContact O-CD1 3.17Å; C1704-C1718 HydrophobicContact CB-CB 3.62Å; C1704-C1718 WeakPolarHBondContact CB-SG 3.28Å; C1704-C1718 WeakPolarHBondContact SG-CB 3.37Å; C1704-C1718 CovalentContact SG-SG 2.03Å; C1704-C1718 PolarHBondContact SG-SG 3.13Å
1705	F	86.9	Confident	80.1	Confident	124 Å²	124	75.4 Å²	75.4	54%	0.544	39%	0.386	S	S	.	.			trans	-107.9	113.4	179.5	178.2	-102.8	0	0	0	109.5	N1707 C1725 H1736	F1705-N1707 WeakPolarHBondContact CE1-OD1 3.4Å; F1705-N1707 WeakPolarHBondContact CZ-OD1 3.43Å; F1705-C1725 PolarHBondContact O-SG 2.9Å; F1705-C1725 VanDerWaalsContact O-SG 3.36Å; F1705-H1736 HydrophobicContact CD1-CB 4.23Å; F1705-H1736 AromaticContact CD1-ND1 3.94Å; F1705-H1736 WeakPolarHBondContact O-CB 3.05Å; F1705-H1736 PolarHBondContact O-ND1 2.77Å
1706	C	86.6	Confident	79.8	Confident	6 Å²	6	74.2 Å²	74.2	4%	0.041	39%	0.387	C	S	.	.			trans	-128.3	29.6	-172.5	-56.4	0	0	0	0	113.1	D1708 N1709 N1710 C1725 H1736 C1737	C1706-D1708 PolarHBondContact O-N 3.25Å; C1706-N1709 PolarHBondContact O-N 2.72Å; C1706-N1710 HydrophobicContact CB-CB 3.49Å; C1706-N1710 VanDerWaalsContact CB-CB 3.49Å; C1706-N1710 PolarHBondContact SG-ND2 2.92Å; C1706-C1725 WeakPolarHBondContact CA-SG 3.47Å; C1706-C1725 HydrophobicContact CB-CB 4.02Å; C1706-C1725 WeakPolarHBondContact CB-SG 3.32Å; C1706-C1725 WeakPolarHBondContact SG-CB 3.17Å; C1706-C1725 CovalentContact SG-SG 2.03Å; C1706-C1725 PolarHBondContact SG-SG 2.97Å; C1706-H1736 CarbonylContact C-O 3.54Å; C1706-H1736 VanDerWaalsContact CA-O 3.26Å; C1706-H1736 WeakPolarHBondContact CA-O 3.35Å; C1706-C1737 HydrophobicContact CB-CB 4.37Å
1707	N	83.2	Confident	79.8	Confident	37 Å²	37	67.7 Å²	67.7	20%	0.198	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	45.5	35.4	-180	-64.4	-82.6	0	0	0	114.8	F1705 N1709 H1736 K1752	F1705-N1707 WeakPolarHBondContact CE1-OD1 3.4Å; F1705-N1707 WeakPolarHBondContact CZ-OD1 3.43Å; N1707-N1709 PolarHBondContact O-N 3.24Å; N1707-N1709 VanDerWaalsContact O-N 3.17Å; N1707-H1736 WeakPolarHBondContact ND2-CB 3.47Å; N1707-H1736 PolarHBondContact ND2-O 2.94Å; N1707-K1752 PolarHBondContact O-NZ 2.67Å
1708	D	79.8	Confident	80.6	Confident	149 Å²	149	63.6 Å²	63.6	80%	0.797	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	34.4	-174.1	-53.5	-27.4	0	0	0	113.9	C1706 K1752	C1706-D1708 PolarHBondContact O-N 3.25Å; D1708-K1752 PolarHBondContact O-NZ 2.93Å
1709	N	81.5	Confident	81.1	Confident	1 Å²	1	63.7 Å²	63.7	1%	0.005	32%	0.322	C	S	.	.			trans	-115.4	34.8	172.5	-69.1	-33.7	0	0	0	110.4	C1706 N1707 C1728 M1729 C1737 A1748 K1752	C1706-N1709 PolarHBondContact O-N 2.72Å; N1707-N1709 PolarHBondContact O-N 3.24Å; N1707-N1709 VanDerWaalsContact O-N 3.17Å; N1709-C1728 CarbonylContact O-C 3.38Å; N1709-C1728 WeakPolarHBondContact O-CA 3.32Å; N1709-M1729 PolarHBondContact O-N 2.97Å; N1709-C1737 HydrophobicContact CB-CB 3.71Å; N1709-C1737 PolarHBondContact ND2-O 2.75Å; N1709-A1748 PolarHBondContact ND2-O 3.19Å; N1709-K1752 WeakPolarHBondContact OD1-CG 3.38Å; N1709-K1752 PolarHBondContact OD1-NZ 2.88Å
1710	N	79.3	Confident	81.1	Confident	20 Å²	20	62.8 Å²	62.8	11%	0.107	32%	0.319	C	S	.	.	B	Isolated β-bridge	trans	-159.4	145.6	-179.7	-170.1	-10.1	0	0	0	109.1	C1706 A1717 F1727	C1706-N1710 HydrophobicContact CB-CB 3.49Å; C1706-N1710 VanDerWaalsContact CB-CB 3.49Å; C1706-N1710 PolarHBondContact SG-ND2 2.92Å; N1710-A1717 PolarHBondContact ND2-O 3.4Å; N1710-F1727 VanDerWaalsContact CG-O 3.32Å; N1710-F1727 PolarHBondContact OD1-O 3.43Å; N1710-F1727 VanDerWaalsContact OD1-O 3.04Å
1711	D	80.4	Confident	81.1	Confident	67 Å²	67	61.8 Å²	61.8	36%	0.358	32%	0.317	S	S	.	.			trans	-93	98.8	169.3	-173.8	-12.4	0	0	0	109.7	S1713 V1714 A1717 M1729	D1711-S1713 VanDerWaalsContact CG-OG 3.26Å; D1711-S1713 PolarHBondContact O-N 2.86Å; D1711-S1713 VanDerWaalsContact OD1-CB 3.28Å; D1711-S1713 WeakPolarHBondContact OD1-CB 3.28Å; D1711-S1713 PolarHBondContact OD1-N 3.26Å; D1711-S1713 PolarHBondContact OD1-OG 3.49Å; D1711-S1713 PolarHBondContact OD2-OG 2.78Å; D1711-V1714 HydrophobicContact CB-CG2 4.08Å; D1711-V1714 PolarHBondContact O-N 2.93Å; D1711-A1717 WeakPolarHBondContact O-CB 3.2Å; D1711-M1729 HydrophobicContact CB-CE 3.52Å; D1711-M1729 HydrophobicContact CB-SD 4.49Å
1712	L	75.9	Confident	80.9	Confident	40 Å²	40	64 Å²	64	21%	0.209	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-2.3	-179.9	-62.7	177.7	0	0	0	114.1	C1704 A1717	C1704-L1712 HydrophobicContact CB-CD2 4.02Å; C1704-L1712 WeakPolarHBondContact O-CD1 3.17Å; L1712-A1717 HydrophobicContact CD2-CB 4.42Å
1713	S	78.4	Confident	80.9	Confident	90 Å²	90	58.7 Å²	58.7	63%	0.629	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-14.6	172.6	73.9	0	0	0	0	114	T1688 D1711	T1688-S1713 WeakPolarHBondContact CG2-O 3.48Å; D1711-S1713 VanDerWaalsContact CG-OG 3.26Å; D1711-S1713 PolarHBondContact O-N 2.86Å; D1711-S1713 VanDerWaalsContact OD1-CB 3.28Å; D1711-S1713 WeakPolarHBondContact OD1-CB 3.28Å; D1711-S1713 PolarHBondContact OD1-N 3.26Å; D1711-S1713 PolarHBondContact OD1-OG 3.49Å; D1711-S1713 PolarHBondContact OD2-OG 2.78Å
1714	V	74.5	Confident	80.9	Confident	64 Å²	64	57.2 Å²	57.2	39%	0.388	30%	0.302	S	S	.	.	S	Bend	trans	-82.5	129.6	-178.1	-176.1	0	0	0	0	111	T1688 D1711 N1716 A1717 F1727	T1688-V1714 VanDerWaalsContact CG2-C 3.4Å; T1688-V1714 WeakPolarHBondContact CG2-O 3.45Å; D1711-V1714 HydrophobicContact CB-CG2 4.08Å; D1711-V1714 PolarHBondContact O-N 2.93Å; V1714-N1716 PolarHBondContact O-N 3.15Å; V1714-A1717 WeakPolarHBondContact O-CB 3.45Å; V1714-A1717 PolarHBondContact O-N 3.28Å; V1714-F1727 HydrophobicContact CB-CD2 4.26Å; V1714-F1727 HydrophobicContact CG1-CD2 3.8Å; V1714-F1727 HydrophobicContact CG1-CE2 3.81Å
1715	E	73	Confident	80.9	Confident	145 Å²	145	57 Å²	57	68%	0.678	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	124.9	-179.4	-166.8	-176.9	-163.9	0	0	111.7	F1727	E1715-F1727 WeakPolarHBondContact O-CE2 3.38Å
1716	N	73.1	Confident	80.7	Confident	83 Å²	83	55 Å²	55	44%	0.444	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.8	25.8	-167.4	-47.2	-83.6	0	0	0	115.9	V1714 C1718 L1726 F1727	V1714-N1716 PolarHBondContact O-N 3.15Å; N1716-C1718 PolarHBondContact O-N 2.77Å; N1716-L1726 HydrophobicContact CB-CD1 4.44Å; N1716-L1726 WeakPolarHBondContact O-CB 3.28Å; N1716-L1726 WeakPolarHBondContact O-CD1 3.34Å; N1716-F1727 HydrophobicContact CB-CE2 4.36Å
1717	A	77.9	Confident	80.5	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.314	C	S	.	.	S	Bend	trans	-51.6	-27.9	169.8	0	0	0	0	0	113.9	N1710 D1711 L1712 V1714 L1726 F1727	N1710-A1717 PolarHBondContact ND2-O 3.4Å; D1711-A1717 WeakPolarHBondContact O-CB 3.2Å; L1712-A1717 HydrophobicContact CD2-CB 4.42Å; V1714-A1717 WeakPolarHBondContact O-CB 3.45Å; V1714-A1717 PolarHBondContact O-N 3.28Å; A1717-L1726 PolarHBondContact O-N 3.45Å; A1717-F1727 PolarHBondContact O-N 2.74Å
1718	C	87.1	Confident	80.5	Confident	4 Å²	4	58.9 Å²	58.9	3%	0.027	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-140.7	160.1	169.9	55	0	0	0	0	110.9	C1704 N1716 R1724	C1704-C1718 HydrophobicContact CB-CB 3.62Å; C1704-C1718 WeakPolarHBondContact CB-SG 3.28Å; C1704-C1718 WeakPolarHBondContact SG-CB 3.37Å; C1704-C1718 CovalentContact SG-SG 2.03Å; C1704-C1718 PolarHBondContact SG-SG 3.13Å; N1716-C1718 PolarHBondContact O-N 2.77Å; C1718-R1724 CarbonylContact C-O 3.57Å; C1718-R1724 WeakPolarHBondContact CA-O 2.78Å; C1718-R1724 WeakPolarHBondContact CB-O 3.46Å
1719	D	82.7	Confident	80.7	Confident	55 Å²	55	56.1 Å²	56.1	29%	0.294	30%	0.297	S	S	.	.			trans	-66.6	119.1	175.1	176.8	-80.7	0	0	0	110.3	Y1691 E1721 S1722 G1723 R1724 L1726	Y1691-D1719 WeakPolarHBondContact CB-O 3.32Å; D1719-E1721 VanDerWaalsContact C-N 3.29Å; D1719-E1721 PolarHBondContact O-N 3.18Å; D1719-E1721 PolarHBondContact OD1-N 2.85Å; D1719-S1722 WeakPolarHBondContact CB-OG 3.21Å; D1719-S1722 PolarHBondContact O-N 2.92Å; D1719-S1722 WeakPolarHBondContact OD1-CB 3.24Å; D1719-S1722 PolarHBondContact OD1-N 2.83Å; D1719-S1722 PolarHBondContact OD1-OG 2.03Å; D1719-G1723 WeakPolarHBondContact O-CA 3.42Å; D1719-G1723 PolarHBondContact O-N 2.8Å; D1719-R1724 HydrophobicContact CB-CB 4.18Å; D1719-R1724 PolarHBondContact N-O 3.11Å; D1719-L1726 HydrophobicContact CB-CD1 4.38Å; D1719-L1726 HydrophobicContact CB-CD2 4.42Å; D1719-L1726 HydrophobicContact CB-CG 4.49Å
1720	P	78.5	Confident	80.6	Confident	55 Å²	55	60.4 Å²	60.4	36%	0.357	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-9.9	-167.7	28.6	-35.6	0	0	0	114.5	Y1691 G1692	Y1691-P1720 CarbonylContact C-O 3.58Å; Y1691-P1720 VanDerWaalsContact CA-O 3.29Å; Y1691-P1720 WeakPolarHBondContact CA-O 3.34Å; G1692-P1720 PolarHBondContact N-O 3.39Å
1721	E	81.2	Confident	80.8	Confident	95 Å²	95	62.9 Å²	62.9	44%	0.444	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-28.1	173.6	-75.1	-144.8	121.6	0	0	113.5	K1693 Y1695 D1719	K1693-E1721 IonicContact NZ-OE1 2.97Å; K1693-E1721 PolarHBondContact NZ-OE1 2.7Å; K1693-E1721 IonicContact NZ-OE2 2.71Å; K1693-E1721 PolarHBondContact NZ-OE2 2.79Å; Y1695-E1721 PolarHBondContact OH-OE1 3.24Å; D1719-E1721 VanDerWaalsContact C-N 3.29Å; D1719-E1721 PolarHBondContact O-N 3.18Å; D1719-E1721 PolarHBondContact OD1-N 2.85Å
1722	S	83.6	Confident	81.1	Confident	53 Å²	53	59.8 Å²	59.8	37%	0.371	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.5	-22.8	-170.3	68.2	0	0	0	0	115.4	Y1691 D1719 F1735	Y1691-S1722 WeakPolarHBondContact CD2-O 3.28Å; Y1691-S1722 WeakPolarHBondContact CE2-O 3.43Å; D1719-S1722 WeakPolarHBondContact CB-OG 3.21Å; D1719-S1722 PolarHBondContact O-N 2.92Å; D1719-S1722 WeakPolarHBondContact OD1-CB 3.24Å; D1719-S1722 PolarHBondContact OD1-N 2.83Å; D1719-S1722 PolarHBondContact OD1-OG 2.03Å; S1722-F1735 WeakPolarHBondContact O-CZ 3.44Å
1723	G	84.6	Confident	81.4	Confident	2 Å²	2	60.1 Å²	60.1	2%	0.021	32%	0.318	C	S	.	.			trans	86.2	5.5	178.9	0	0	0	0	0	115.4	Y1691 D1719 C1725	Y1691-G1723 VanDerWaalsContact CB-CA 3.42Å; Y1691-G1723 VanDerWaalsContact CD2-CA 3.45Å; Y1691-G1723 VanDerWaalsContact CD2-N 3.28Å; D1719-G1723 WeakPolarHBondContact O-CA 3.42Å; D1719-G1723 PolarHBondContact O-N 2.8Å; G1723-C1725 PolarHBondContact O-N 2.89Å
1724	R	84.9	Confident	81.5	Confident	106 Å²	106	56.2 Å²	56.2	40%	0.4	29%	0.293	S	S	.	.			trans	-61.9	125.9	172.9	-176.2	-175.4	174.2	173.7	1.2	109.7	C1718 D1719 D1733 F1735	C1718-R1724 CarbonylContact C-O 3.57Å; C1718-R1724 WeakPolarHBondContact CA-O 2.78Å; C1718-R1724 WeakPolarHBondContact CB-O 3.46Å; D1719-R1724 HydrophobicContact CB-CB 4.18Å; D1719-R1724 PolarHBondContact N-O 3.11Å; R1724-D1733 IonicContact NH2-OD1 2.77Å; R1724-D1733 PolarHBondContact NH2-OD1 3.22Å; R1724-F1735 HydrophobicContact CB-CD1 4.5Å; R1724-F1735 HydrophobicContact CB-CD2 3.91Å; R1724-F1735 HydrophobicContact CB-CE1 4.29Å; R1724-F1735 HydrophobicContact CB-CE2 3.67Å; R1724-F1735 HydrophobicContact CB-CG 4.33Å; R1724-F1735 HydrophobicContact CB-CZ 3.88Å; R1724-F1735 HydrophobicContact CG-CD2 3.95Å; R1724-F1735 HydrophobicContact CG-CE2 4.21Å; R1724-F1735 HydrophobicContact CG-CG 4.29Å
1725	C	86.3	Confident	81.8	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.007	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-65.4	136.2	172.3	-52.8	0	0	0	0	111.3	F1705 C1706 G1723 F1735 C1737	F1705-C1725 PolarHBondContact O-SG 2.9Å; F1705-C1725 VanDerWaalsContact O-SG 3.36Å; C1706-C1725 WeakPolarHBondContact CA-SG 3.47Å; C1706-C1725 HydrophobicContact CB-CB 4.02Å; C1706-C1725 WeakPolarHBondContact CB-SG 3.32Å; C1706-C1725 WeakPolarHBondContact SG-CB 3.17Å; C1706-C1725 CovalentContact SG-SG 2.03Å; C1706-C1725 PolarHBondContact SG-SG 2.97Å; G1723-C1725 PolarHBondContact O-N 2.89Å; C1725-F1735 PolarHBondContact N-O 3.4Å; C1725-F1735 PolarHBondContact SG-O 2.85Å; C1725-C1737 WeakPolarHBondContact CB-SG 3.34Å
1726	L	83.1	Confident	82.5	Confident	81 Å²	81	54 Å²	54	42%	0.424	28%	0.277	S	S	.	.	S	Bend	trans	-112.1	-31.7	-176.5	-59.6	-179.5	0	0	0	113.2	N1716 A1717 D1719	N1716-L1726 HydrophobicContact CB-CD1 4.44Å; N1716-L1726 WeakPolarHBondContact O-CB 3.28Å; N1716-L1726 WeakPolarHBondContact O-CD1 3.34Å; A1717-L1726 PolarHBondContact O-N 3.45Å; D1719-L1726 HydrophobicContact CB-CD1 4.38Å; D1719-L1726 HydrophobicContact CB-CD2 4.42Å; D1719-L1726 HydrophobicContact CB-CG 4.49Å
1727	F	81.2	Confident	83.2	Confident	98 Å²	98	50.1 Å²	50.1	43%	0.43	26%	0.256	S	S	.	.	S	Bend	trans	-109.7	61.1	-179.6	-60.3	-37	0	0	0	112.7	N1710 V1714 E1715 N1716 A1717 M1729	N1710-F1727 VanDerWaalsContact CG-O 3.32Å; N1710-F1727 PolarHBondContact OD1-O 3.43Å; N1710-F1727 VanDerWaalsContact OD1-O 3.04Å; V1714-F1727 HydrophobicContact CB-CD2 4.26Å; V1714-F1727 HydrophobicContact CG1-CD2 3.8Å; V1714-F1727 HydrophobicContact CG1-CE2 3.81Å; E1715-F1727 WeakPolarHBondContact O-CE2 3.38Å; N1716-F1727 HydrophobicContact CB-CE2 4.36Å; A1717-F1727 PolarHBondContact O-N 2.74Å; F1727-M1729 PolarHBondContact O-N 2.74Å
1728	C	84	Confident	83.6	Confident	28 Å²	28	51.6 Å²	51.6	19%	0.189	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-69.6	124.7	178.5	-64.6	0	0	0	0	112.5	N1709 T1732 C1737	N1709-C1728 CarbonylContact O-C 3.38Å; N1709-C1728 WeakPolarHBondContact O-CA 3.32Å; C1728-T1732 WeakPolarHBondContact CB-O 3.43Å; C1728-T1732 WeakPolarHBondContact CB-OG1 3.36Å; C1728-C1737 WeakPolarHBondContact CA-SG 3.21Å; C1728-C1737 HydrophobicContact CB-CB 3.72Å; C1728-C1737 WeakPolarHBondContact CB-SG 3.1Å; C1728-C1737 WeakPolarHBondContact SG-CA 3.36Å; C1728-C1737 WeakPolarHBondContact SG-CB 3.31Å; C1728-C1737 CovalentContact SG-SG 2.04Å; C1728-C1737 PolarHBondContact SG-SG 3.27Å
1729	M	83.5	Confident	83.4	Confident	91 Å²	91	57.2 Å²	57.2	45%	0.448	29%	0.289	S	S	.	.			trans	-89.7	176.2	-179.7	-65.2	-173.5	164.5	0	0	112.1	N1709 D1711 F1727 N1731 T1732	N1709-M1729 PolarHBondContact O-N 2.97Å; D1711-M1729 HydrophobicContact CB-CE 3.52Å; D1711-M1729 HydrophobicContact CB-SD 4.49Å; F1727-M1729 PolarHBondContact O-N 2.74Å; M1729-N1731 PolarHBondContact O-N 3.44Å; M1729-T1732 PolarHBondContact O-N 3.11Å; M1729-T1732 VanDerWaalsContact O-N 3.07Å; M1729-T1732 PolarHBondContact O-OG1 2.9Å
1730	N	79.8	Confident	83.5	Confident	91 Å²	91	55 Å²	55	49%	0.487	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.4	29.5	178.4	-61.2	-29.6	0	0	0	114.3	C1754	N1730-C1754 WeakPolarHBondContact O-CB 3.34Å
1731	N	83.4	Confident	83.7	Confident	71 Å²	71	53.5 Å²	53.5	38%	0.38	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.1	49.2	-174.6	-36	-59.4	0	0	0	113.3	M1729 S1741 F1744 C1754	M1729-N1731 PolarHBondContact O-N 3.44Å; N1731-S1741 WeakPolarHBondContact CA-OG 3.37Å; N1731-S1741 PolarHBondContact O-N 2.76Å; N1731-S1741 PolarHBondContact O-OG 2.79Å; N1731-F1744 HydrophobicContact CB-CB 4.09Å; N1731-F1744 HydrophobicContact CB-CD1 3.31Å; N1731-F1744 HydrophobicContact CB-CD2 3.91Å; N1731-F1744 HydrophobicContact CB-CE1 3.58Å; N1731-F1744 HydrophobicContact CB-CE2 4.13Å; N1731-F1744 HydrophobicContact CB-CG 3.5Å; N1731-F1744 HydrophobicContact CB-CZ 3.98Å; N1731-F1744 VanDerWaalsContact CG-CD1 3.47Å; N1731-F1744 WeakPolarHBondContact ND2-CE1 3.01Å; N1731-C1754 HydrophobicContact CB-CB 4.08Å; N1731-C1754 PolarHBondContact ND2-O 2.61Å; N1731-C1754 WeakPolarHBondContact O-CB 3.42Å
1732	T	86.1	Confident	83.6	Confident	3 Å²	3	53 Å²	53	2%	0.018	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	163.8	172.1	58	0	0	0	0	112.7	C1728 M1729 E1739 S1741 A1748	C1728-T1732 WeakPolarHBondContact CB-O 3.43Å; C1728-T1732 WeakPolarHBondContact CB-OG1 3.36Å; M1729-T1732 PolarHBondContact O-N 3.11Å; M1729-T1732 VanDerWaalsContact O-N 3.07Å; M1729-T1732 PolarHBondContact O-OG1 2.9Å; T1732-E1739 CarbonylContact C-O 3.5Å; T1732-E1739 WeakPolarHBondContact CA-O 3.22Å; T1732-E1739 VanDerWaalsContact CB-O 3.26Å; T1732-E1739 WeakPolarHBondContact CB-O 2.83Å; T1732-S1741 VanDerWaalsContact C-OG 3.22Å; T1732-S1741 PolarHBondContact N-OG 2.93Å; T1732-S1741 VanDerWaalsContact N-OG 3.1Å; T1732-S1741 PolarHBondContact O-OG 3.26Å; T1732-A1748 HydrophobicContact CG2-CB 3.64Å
1733	D	81.9	Confident	83.5	Confident	46 Å²	46	52.5 Å²	52.5	25%	0.246	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	-159.6	172.2	-172.1	-3.3	0	0	0	106.2	R1724 C1737 D1738 E1739 P1742	R1724-D1733 IonicContact NH2-OD1 2.77Å; R1724-D1733 PolarHBondContact NH2-OD1 3.22Å; D1733-C1737 CarbonylContact O-C 3.56Å; D1733-C1737 VanDerWaalsContact O-C 3.27Å; D1733-C1737 VanDerWaalsContact O-CA 3.24Å; D1733-C1737 WeakPolarHBondContact O-CA 3.4Å; D1733-D1738 PolarHBondContact O-N 3.41Å; D1733-E1739 PolarHBondContact N-O 2.77Å; D1733-E1739 PolarHBondContact O-N 2.75Å; D1733-E1739 VanDerWaalsContact O-O 3.06Å; D1733-P1742 WeakPolarHBondContact OD2-CD 3.25Å
1734	G	80.4	Confident	83.6	Confident	9 Å²	9	54.2 Å²	54.2	9%	0.093	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	85	169.9	-169.2	0	0	0	0	0	111	H1736 C1737	G1734-H1736 PolarHBondContact O-N 3Å; G1734-C1737 PolarHBondContact O-N 3.15Å
1735	F	82.4	Confident	83.7	Confident	96 Å²	96	53.1 Å²	53.1	42%	0.421	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-30.2	-168.7	-158.6	-83.9	0	0	0	112.7	S1722 R1724 C1725 D1738	S1722-F1735 WeakPolarHBondContact O-CZ 3.44Å; R1724-F1735 HydrophobicContact CB-CD1 4.5Å; R1724-F1735 HydrophobicContact CB-CD2 3.91Å; R1724-F1735 HydrophobicContact CB-CE1 4.29Å; R1724-F1735 HydrophobicContact CB-CE2 3.67Å; R1724-F1735 HydrophobicContact CB-CG 4.33Å; R1724-F1735 HydrophobicContact CB-CZ 3.88Å; R1724-F1735 HydrophobicContact CG-CD2 3.95Å; R1724-F1735 HydrophobicContact CG-CE2 4.21Å; R1724-F1735 HydrophobicContact CG-CG 4.29Å; C1725-F1735 PolarHBondContact N-O 3.4Å; C1725-F1735 PolarHBondContact SG-O 2.85Å; F1735-D1738 PolarHBondContact N-OD1 2.89Å
1736	H	86.9	Confident	83.6	Confident	67 Å²	67	54.2 Å²	54.2	31%	0.31	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.2	27.4	-178.7	-61.5	-66.3	0	0	0	112.7	F1705 C1706 N1707 G1734 D1738	F1705-H1736 HydrophobicContact CD1-CB 4.23Å; F1705-H1736 AromaticContact CD1-ND1 3.94Å; F1705-H1736 WeakPolarHBondContact O-CB 3.05Å; F1705-H1736 PolarHBondContact O-ND1 2.77Å; C1706-H1736 CarbonylContact C-O 3.54Å; C1706-H1736 VanDerWaalsContact CA-O 3.26Å; C1706-H1736 WeakPolarHBondContact CA-O 3.35Å; N1707-H1736 WeakPolarHBondContact ND2-CB 3.47Å; N1707-H1736 PolarHBondContact ND2-O 2.94Å; G1734-H1736 PolarHBondContact O-N 3Å; H1736-D1738 HydrophobicContact CB-CB 4.17Å; H1736-D1738 PolarHBondContact N-OD1 2.88Å; H1736-D1738 PolarHBondContact O-N 2.81Å
1737	C	87.2	Confident	83.5	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.4	43.3	-170.3	-54.3	0	0	0	0	112.2	C1706 N1709 C1725 C1728 D1733 G1734	C1706-C1737 HydrophobicContact CB-CB 4.37Å; N1709-C1737 HydrophobicContact CB-CB 3.71Å; N1709-C1737 PolarHBondContact ND2-O 2.75Å; C1725-C1737 WeakPolarHBondContact CB-SG 3.34Å; C1728-C1737 WeakPolarHBondContact CA-SG 3.21Å; C1728-C1737 HydrophobicContact CB-CB 3.72Å; C1728-C1737 WeakPolarHBondContact CB-SG 3.1Å; C1728-C1737 WeakPolarHBondContact SG-CA 3.36Å; C1728-C1737 WeakPolarHBondContact SG-CB 3.31Å; C1728-C1737 CovalentContact SG-SG 2.04Å; C1728-C1737 PolarHBondContact SG-SG 3.27Å; D1733-C1737 CarbonylContact O-C 3.56Å; D1733-C1737 VanDerWaalsContact O-C 3.27Å; D1733-C1737 VanDerWaalsContact O-CA 3.24Å; D1733-C1737 WeakPolarHBondContact O-CA 3.4Å; G1734-C1737 PolarHBondContact O-N 3.15Å
1738	D	86	Confident	83.4	Confident	32 Å²	32	49 Å²	49	17%	0.171	26%	0.257	C	S	.	.			trans	-120.2	3.7	-165.5	75.3	-64.8	0	0	0	113.8	D1733 F1735 H1736 K1749	D1733-D1738 PolarHBondContact O-N 3.41Å; F1735-D1738 PolarHBondContact N-OD1 2.89Å; H1736-D1738 HydrophobicContact CB-CB 4.17Å; H1736-D1738 PolarHBondContact N-OD1 2.88Å; H1736-D1738 PolarHBondContact O-N 2.81Å; D1738-K1749 HydrophobicContact CB-CD 4.33Å; D1738-K1749 HydrophobicContact CB-CG 4.24Å; D1738-K1749 WeakPolarHBondContact O-CE 3.17Å; D1738-K1749 IonicContact OD2-NZ 3.7Å; D1738-K1749 PolarHBondContact OD2-NZ 3.32Å
1739	E	84.1	Confident	83.2	Confident	121 Å²	121	52.6 Å²	52.6	57%	0.565	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.2	162.9	163	-58	-173.9	174.2	0	0	108.6	T1732 D1733 A1748	T1732-E1739 CarbonylContact C-O 3.5Å; T1732-E1739 WeakPolarHBondContact CA-O 3.22Å; T1732-E1739 VanDerWaalsContact CB-O 3.26Å; T1732-E1739 WeakPolarHBondContact CB-O 2.83Å; D1733-E1739 PolarHBondContact N-O 2.77Å; D1733-E1739 PolarHBondContact O-N 2.75Å; D1733-E1739 VanDerWaalsContact O-O 3.06Å; E1739-A1748 WeakPolarHBondContact O-CB 3.28Å
1740	C	84.9	Confident	82.9	Confident	8 Å²	8	57 Å²	57	5%	0.054	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	146.6	168.2	-66.4	0	0	0	0	110.3	F1744 Y1745 G1746 C1754 A1769	C1740-F1744 HydrophobicContact CB-CB 4.17Å; C1740-F1744 WeakPolarHBondContact CB-O 3.49Å; C1740-Y1745 VanDerWaalsContact SG-C 3.58Å; C1740-G1746 PolarHBondContact SG-N 3.34Å; C1740-C1754 WeakPolarHBondContact CA-SG 3.35Å; C1740-C1754 HydrophobicContact CB-CB 3.67Å; C1740-C1754 WeakPolarHBondContact CB-SG 3.48Å; C1740-C1754 WeakPolarHBondContact SG-CB 3.42Å; C1740-C1754 CovalentContact SG-SG 2.04Å; C1740-C1754 PolarHBondContact SG-SG 3.34Å; C1740-A1769 HydrophobicContact CB-CB 4.17Å
1741	S	82.4	Confident	82.8	Confident	24 Å²	24	54.7 Å²	54.7	17%	0.168	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-54.7	152	177.3	-53.9	0	0	0	0	110.8	N1731 T1732 W1743 F1744	N1731-S1741 WeakPolarHBondContact CA-OG 3.37Å; N1731-S1741 PolarHBondContact O-N 2.76Å; N1731-S1741 PolarHBondContact O-OG 2.79Å; T1732-S1741 VanDerWaalsContact C-OG 3.22Å; T1732-S1741 PolarHBondContact N-OG 2.93Å; T1732-S1741 VanDerWaalsContact N-OG 3.1Å; T1732-S1741 PolarHBondContact O-OG 3.26Å; S1741-W1743 PolarHBondContact O-N 2.79Å; S1741-F1744 PolarHBondContact O-N 3.07Å
1742	P	78.3	Confident	82.5	Confident	85 Å²	85	54.7 Å²	54.7	55%	0.552	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.3	128.7	167.9	-28.1	35.3	0	0	0	110.9	D1733	D1733-P1742 WeakPolarHBondContact OD2-CD 3.25Å
1743	W	82.6	Confident	82.3	Confident	42 Å²	42	58.8 Å²	58.8	16%	0.159	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.3	14	-173.8	-50	88	0	0	0	116.8	S1741 C1757 C1759 D1760 R1761 A1764	S1741-W1743 PolarHBondContact O-N 2.79Å; W1743-C1757 VanDerWaalsContact C-SG 3.54Å; W1743-C1757 PolarHBondContact O-N 2.79Å; W1743-C1757 PolarHBondContact O-SG 2.93Å; W1743-C1759 HydrophobicContact CE3-CB 3.95Å; W1743-C1759 HydrophobicContact CZ3-CB 3.57Å; W1743-D1760 WeakPolarHBondContact CH2-O 3.45Å; W1743-D1760 VanDerWaalsContact CZ3-O 3.31Å; W1743-D1760 WeakPolarHBondContact CZ3-O 3.17Å; W1743-R1761 HydrophobicContact CD2-CG 4.19Å; W1743-R1761 HydrophobicContact CE3-CG 3.98Å; W1743-R1761 HydrophobicContact CH2-CB 4.37Å; W1743-R1761 HydrophobicContact CH2-CG 4.36Å; W1743-R1761 HydrophobicContact CZ3-CB 4.46Å; W1743-R1761 HydrophobicContact CZ3-CG 4.03Å; W1743-A1764 HydrophobicContact CH2-CB 3.4Å; W1743-A1764 WeakPolarHBondContact CH2-O 3.49Å; W1743-A1764 WeakPolarHBondContact CZ2-O 3.33Å; W1743-A1764 HydrophobicContact CZ3-CB 3.6Å
1744	F	85.6	Confident	82.5	Confident	39 Å²	39	56.8 Å²	56.8	17%	0.171	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	157.1	170.2	-64.3	-102.5	0	0	0	111.5	N1731 C1740 S1741 C1754 T1755 A1756	N1731-F1744 HydrophobicContact CB-CB 4.09Å; N1731-F1744 HydrophobicContact CB-CD1 3.31Å; N1731-F1744 HydrophobicContact CB-CD2 3.91Å; N1731-F1744 HydrophobicContact CB-CE1 3.58Å; N1731-F1744 HydrophobicContact CB-CE2 4.13Å; N1731-F1744 HydrophobicContact CB-CG 3.5Å; N1731-F1744 HydrophobicContact CB-CZ 3.98Å; N1731-F1744 VanDerWaalsContact CG-CD1 3.47Å; N1731-F1744 WeakPolarHBondContact ND2-CE1 3.01Å; C1740-F1744 HydrophobicContact CB-CB 4.17Å; C1740-F1744 WeakPolarHBondContact CB-O 3.49Å; S1741-F1744 PolarHBondContact O-N 3.07Å; F1744-C1754 HydrophobicContact CB-CB 4.17Å; F1744-T1755 CarbonylContact C-O 3.33Å; F1744-T1755 WeakPolarHBondContact CA-O 3.44Å; F1744-T1755 WeakPolarHBondContact CB-O 3.45Å; F1744-A1756 VanDerWaalsContact CD1-CA 3.48Å; F1744-A1756 HydrophobicContact CD1-CB 4Å; F1744-A1756 HydrophobicContact CE1-CB 3.77Å; F1744-A1756 HydrophobicContact CZ-CB 4.43Å
1745	Y	86.9	Confident	82.6	Confident	82 Å²	82	59.6 Å²	59.6	32%	0.322	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	149.4	178	79.2	-74.4	0	0	0	112.9	C1740 C1754 T1755 A1769 G1772	C1740-Y1745 VanDerWaalsContact SG-C 3.58Å; Y1745-C1754 CarbonylContact O-C 3.55Å; Y1745-C1754 WeakPolarHBondContact O-CA 3.31Å; Y1745-T1755 WeakPolarHBondContact CD1-O 3.03Å; Y1745-T1755 WeakPolarHBondContact CE1-OG1 3.33Å; Y1745-T1755 PolarHBondContact N-O 3.07Å; Y1745-T1755 PolarHBondContact O-N 3.47Å; Y1745-T1755 PolarHBondContact O-OG1 3.5Å; Y1745-A1769 VanDerWaalsContact CA-O 3.25Å; Y1745-A1769 WeakPolarHBondContact CA-O 3.39Å; Y1745-G1772 VanDerWaalsContact CD1-CA 3.48Å; Y1745-G1772 VanDerWaalsContact CD2-N 3.31Å; Y1745-G1772 VanDerWaalsContact CG-N 3.28Å
1746	G	84.9	Confident	82.6	Confident	25 Å²	25	57.9 Å²	57.9	26%	0.258	31%	0.313	S	S	.	.	S	Bend	trans	153.9	-155.3	-177.8	0	0	0	0	0	111.4	C1740 A1769	C1740-G1746 PolarHBondContact SG-N 3.34Å; G1746-A1769 PolarHBondContact N-O 2.88Å; G1746-A1769 VanDerWaalsContact N-O 3.12Å
1747	D	81.8	Confident	82.4	Confident	65 Å²	65	55.4 Å²	55.4	35%	0.348	30%	0.304	S	S	.	.			trans	-104.6	118.8	164.4	175.4	24.6	0	0	0	109.8	K1749 E1750 G1751 K1752 N1753	D1747-K1749 PolarHBondContact OD1-N 2.82Å; D1747-E1750 WeakPolarHBondContact OD2-CA 3.35Å; D1747-E1750 PolarHBondContact OD2-N 3.42Å; D1747-G1751 PolarHBondContact OD2-N 3.39Å; D1747-K1752 WeakPolarHBondContact O-CA 3.49Å; D1747-K1752 PolarHBondContact O-N 3.46Å; D1747-N1753 PolarHBondContact N-OD1 2.93Å; D1747-N1753 PolarHBondContact O-N 3.16Å; D1747-N1753 PolarHBondContact O-OD1 2.03Å
1748	A	79.2	Confident	82.2	Confident	4 Å²	4	60 Å²	60	3%	0.033	34%	0.336	C	S	.	.	S	Bend	trans	-79.3	-24.6	176.2	0	0	0	0	0	113.2	N1709 T1732 E1739	N1709-A1748 PolarHBondContact ND2-O 3.19Å; T1732-A1748 HydrophobicContact CG2-CB 3.64Å; E1739-A1748 WeakPolarHBondContact O-CB 3.28Å
1749	K	79.1	Confident	82.1	Confident	103 Å²	103	59 Å²	59	45%	0.448	33%	0.331	S	S	.	.	S	Bend	trans	-92.2	-60.5	-165.3	-54.4	-167.5	-171	-132.3	0	113.1	D1738 D1747	D1738-K1749 HydrophobicContact CB-CD 4.33Å; D1738-K1749 HydrophobicContact CB-CG 4.24Å; D1738-K1749 WeakPolarHBondContact O-CE 3.17Å; D1738-K1749 IonicContact OD2-NZ 3.7Å; D1738-K1749 PolarHBondContact OD2-NZ 3.32Å; D1747-K1749 PolarHBondContact OD1-N 2.82Å
1750	E	77.7	Confident	82	Confident	184 Å²	184	56 Å²	56	86%	0.86	32%	0.318	S	S	*	.	S	Bend	trans	-97.2	-46.9	-179.7	-64.3	-169.7	169.7	0	0	111.5	D1747	D1747-E1750 WeakPolarHBondContact OD2-CA 3.35Å; D1747-E1750 PolarHBondContact OD2-N 3.42Å
1751	G	77.3	Confident	81.8	Confident	42 Å²	42	62.7 Å²	62.7	43%	0.433	34%	0.343	S	S	.	.	S	Bend	trans	-74.5	-24.9	-176.3	0	0	0	0	0	115.3	D1747 N1753	D1747-G1751 PolarHBondContact OD2-N 3.39Å; G1751-N1753 WeakPolarHBondContact O-CB 3.41Å; G1751-N1753 PolarHBondContact O-N 2.97Å; G1751-N1753 VanDerWaalsContact O-N 3.08Å
1752	K	76.2	Confident	81.6	Confident	71 Å²	71	63.1 Å²	63.1	31%	0.309	35%	0.345	S	S	.	.			trans	46.7	34.5	-176.2	-62.2	175.1	177.8	-85.7	0	113.4	N1707 D1708 N1709 D1747	N1707-K1752 PolarHBondContact O-NZ 2.67Å; D1708-K1752 PolarHBondContact O-NZ 2.93Å; N1709-K1752 WeakPolarHBondContact OD1-CG 3.38Å; N1709-K1752 PolarHBondContact OD1-NZ 2.88Å; D1747-K1752 WeakPolarHBondContact O-CA 3.49Å; D1747-K1752 PolarHBondContact O-N 3.46Å
1753	N	82.4	Confident	81.8	Confident	89 Å²	89	59 Å²	59	48%	0.476	32%	0.319	S	S	.	.			trans	-115.7	35.6	-163.8	69.9	-5.7	0	0	0	113.8	D1747 G1751 T1755	D1747-N1753 PolarHBondContact N-OD1 2.93Å; D1747-N1753 PolarHBondContact O-N 3.16Å; D1747-N1753 PolarHBondContact O-OD1 2.03Å; G1751-N1753 WeakPolarHBondContact O-CB 3.41Å; G1751-N1753 PolarHBondContact O-N 2.97Å; G1751-N1753 VanDerWaalsContact O-N 3.08Å; N1753-T1755 PolarHBondContact O-N 2.82Å
1754	C	85.9	Confident	81.8	Confident	5 Å²	5	57 Å²	57	3%	0.034	31%	0.311	C	S	.	.			trans	-64	101.8	179.3	-64.2	0	0	0	0	111.8	N1730 N1731 C1740 F1744 Y1745	N1730-C1754 WeakPolarHBondContact O-CB 3.34Å; N1731-C1754 HydrophobicContact CB-CB 4.08Å; N1731-C1754 PolarHBondContact ND2-O 2.61Å; N1731-C1754 WeakPolarHBondContact O-CB 3.42Å; C1740-C1754 WeakPolarHBondContact CA-SG 3.35Å; C1740-C1754 HydrophobicContact CB-CB 3.67Å; C1740-C1754 WeakPolarHBondContact CB-SG 3.48Å; C1740-C1754 WeakPolarHBondContact SG-CB 3.42Å; C1740-C1754 CovalentContact SG-SG 2.04Å; C1740-C1754 PolarHBondContact SG-SG 3.34Å; F1744-C1754 HydrophobicContact CB-CB 4.17Å; Y1745-C1754 CarbonylContact O-C 3.55Å; Y1745-C1754 WeakPolarHBondContact O-CA 3.31Å
1755	T	83	Confident	81.5	Confident	68 Å²	68	60.1 Å²	60.1	42%	0.417	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	149.4	179.3	54	0	0	0	0	111.7	F1744 Y1745 N1753	F1744-T1755 CarbonylContact C-O 3.33Å; F1744-T1755 WeakPolarHBondContact CA-O 3.44Å; F1744-T1755 WeakPolarHBondContact CB-O 3.45Å; Y1745-T1755 WeakPolarHBondContact CD1-O 3.03Å; Y1745-T1755 WeakPolarHBondContact CE1-OG1 3.33Å; Y1745-T1755 PolarHBondContact N-O 3.07Å; Y1745-T1755 PolarHBondContact O-N 3.47Å; Y1745-T1755 PolarHBondContact O-OG1 3.5Å; N1753-T1755 PolarHBondContact O-N 2.82Å
1756	A	81.4	Confident	81.2	Confident	60 Å²	60	61.7 Å²	61.7	50%	0.496	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	135.6	-178.5	0	0	0	0	0	111.5	F1744	F1744-A1756 VanDerWaalsContact CD1-CA 3.48Å; F1744-A1756 HydrophobicContact CD1-CB 4Å; F1744-A1756 HydrophobicContact CE1-CB 3.77Å; F1744-A1756 HydrophobicContact CZ-CB 4.43Å
1757	C	82.8	Confident	81.1	Confident	15 Å²	15	61 Å²	61	10%	0.101	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-72.7	145.9	173.1	-53.5	0	0	0	0	110.9	W1743 C1759 C1767	W1743-C1757 VanDerWaalsContact C-SG 3.54Å; W1743-C1757 PolarHBondContact O-N 2.79Å; W1743-C1757 PolarHBondContact O-SG 2.93Å; C1757-C1759 PolarHBondContact O-N 3.35Å; C1757-C1767 HydrophobicContact CB-CB 3.73Å; C1757-C1767 WeakPolarHBondContact CB-SG 3.37Å; C1757-C1767 WeakPolarHBondContact SG-CB 3.37Å; C1757-C1767 CovalentContact SG-SG 2.03Å; C1757-C1767 PolarHBondContact SG-SG 3.44Å
1758	S	83.6	Confident	81	Confident	97 Å²	97	62.1 Å²	62.1	68%	0.678	33%	0.329	S	S	*	.			trans	-74.4	-0.9	178.5	-54.2	0	0	0	0	114.8	N1784	S1758-N1784 WeakPolarHBondContact CB-OD1 3.18Å; S1758-N1784 VanDerWaalsContact O-CG 3.26Å; S1758-N1784 PolarHBondContact O-OD1 3.27Å
1759	C	84.6	Confident	80.8	Confident	9 Å²	9	63.6 Å²	63.6	6%	0.061	34%	0.341	C	S	.	.			trans	-65	137.6	-176.2	-47.8	0	0	0	0	113.4	W1743 C1757 A1764 C1774 N1784	W1743-C1759 HydrophobicContact CE3-CB 3.95Å; W1743-C1759 HydrophobicContact CZ3-CB 3.57Å; C1757-C1759 PolarHBondContact O-N 3.35Å; C1759-A1764 HydrophobicContact CB-CB 3.97Å; C1759-C1774 WeakPolarHBondContact CA-SG 3.02Å; C1759-C1774 HydrophobicContact CB-CB 3.81Å; C1759-C1774 WeakPolarHBondContact CB-SG 3.14Å; C1759-C1774 WeakPolarHBondContact SG-CA 3.37Å; C1759-C1774 WeakPolarHBondContact SG-CB 3.03Å; C1759-C1774 CovalentContact SG-SG 2.03Å; C1759-C1774 PolarHBondContact SG-SG 2.93Å; C1759-N1784 CarbonylContact C-O 3.3Å; C1759-N1784 WeakPolarHBondContact CA-O 3.47Å
1760	D	81.8	Confident	80.7	Confident	58 Å²	58	67 Å²	67	31%	0.31	36%	0.359	S	S	.	.			trans	-67.2	133.1	169.9	179.3	-81.3	0	0	0	111	W1743 C1762 G1763 A1764 N1784 D1786 F1795	W1743-D1760 WeakPolarHBondContact CH2-O 3.45Å; W1743-D1760 VanDerWaalsContact CZ3-O 3.31Å; W1743-D1760 WeakPolarHBondContact CZ3-O 3.17Å; D1760-C1762 WeakPolarHBondContact OD1-CA 3.42Å; D1760-C1762 WeakPolarHBondContact OD1-CB 3.26Å; D1760-C1762 PolarHBondContact OD1-N 2.92Å; D1760-G1763 PolarHBondContact OD1-N 3.35Å; D1760-A1764 WeakPolarHBondContact O-CB 3.23Å; D1760-A1764 PolarHBondContact O-N 3.2Å; D1760-N1784 PolarHBondContact N-O 3.06Å; D1760-D1786 HydrophobicContact CB-CB 4.3Å; D1760-F1795 HydrophobicContact CB-CZ 4.42Å; D1760-F1795 WeakPolarHBondContact OD1-CE1 3.39Å; D1760-F1795 VanDerWaalsContact OD1-CZ 3.24Å; D1760-F1795 WeakPolarHBondContact OD1-CZ 2.78Å
1761	R	79.8	Confident	80.9	Confident	150 Å²	150	62.1 Å²	62.1	57%	0.566	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-24.2	-173.2	-67.6	-176	178	-129.2	-2.6	114.1	W1743 K1777	W1743-R1761 HydrophobicContact CD2-CG 4.19Å; W1743-R1761 HydrophobicContact CE3-CG 3.98Å; W1743-R1761 HydrophobicContact CH2-CB 4.37Å; W1743-R1761 HydrophobicContact CH2-CG 4.36Å; W1743-R1761 HydrophobicContact CZ3-CB 4.46Å; W1743-R1761 HydrophobicContact CZ3-CG 4.03Å; R1761-K1777 PolarHBondContact O-NZ 3.19Å
1762	C	79.5	Confident	81	Confident	32 Å²	32	60.8 Å²	60.8	22%	0.216	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-31.9	174.1	-78.2	0	0	0	0	112.9	D1760 K1777 F1795 C1798	D1760-C1762 WeakPolarHBondContact OD1-CA 3.42Å; D1760-C1762 WeakPolarHBondContact OD1-CB 3.26Å; D1760-C1762 PolarHBondContact OD1-N 2.92Å; C1762-K1777 WeakPolarHBondContact O-CD 3.34Å; C1762-K1777 PolarHBondContact O-NZ 3.09Å; C1762-F1795 HydrophobicContact CB-CD1 4.37Å; C1762-F1795 HydrophobicContact CB-CE1 3.95Å; C1762-F1795 HydrophobicContact CB-CZ 4.43Å; C1762-C1798 WeakPolarHBondContact CA-SG 3.27Å; C1762-C1798 HydrophobicContact CB-CB 3.91Å; C1762-C1798 WeakPolarHBondContact CB-SG 3.37Å; C1762-C1798 WeakPolarHBondContact SG-CB 3.46Å; C1762-C1798 CovalentContact SG-SG 2.06Å; C1762-C1798 PolarHBondContact SG-SG 2.78Å
1763	G	81.3	Confident	81.2	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-33.4	-179	0	0	0	0	0	116.7	D1760 K1777 V1780 C1785 F1795	D1760-G1763 PolarHBondContact OD1-N 3.35Å; G1763-K1777 WeakPolarHBondContact O-CB 3.16Å; G1763-K1777 WeakPolarHBondContact O-CG 3.42Å; G1763-K1777 PolarHBondContact O-N 3.12Å; G1763-V1780 WeakPolarHBondContact O-CG1 3.03Å; G1763-C1785 CarbonylContact C-O 3.54Å; G1763-C1785 WeakPolarHBondContact CA-O 3.21Å; G1763-F1795 VanDerWaalsContact CA-CZ 3.49Å
1764	A	83.9	Confident	81.4	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	141.7	172.7	0	0	0	0	0	112.3	W1743 C1759 D1760 C1774 K1775 K1777 C1785	W1743-A1764 HydrophobicContact CH2-CB 3.4Å; W1743-A1764 WeakPolarHBondContact CH2-O 3.49Å; W1743-A1764 WeakPolarHBondContact CZ2-O 3.33Å; W1743-A1764 HydrophobicContact CZ3-CB 3.6Å; C1759-A1764 HydrophobicContact CB-CB 3.97Å; D1760-A1764 WeakPolarHBondContact O-CB 3.23Å; D1760-A1764 PolarHBondContact O-N 3.2Å; A1764-C1774 HydrophobicContact CB-CB 4.37Å; A1764-K1775 CarbonylContact C-O 3.56Å; A1764-K1775 WeakPolarHBondContact CA-O 3.35Å; A1764-K1777 WeakPolarHBondContact O-CE 3.38Å; A1764-K1777 PolarHBondContact O-NZ 3.1Å; A1764-C1785 HydrophobicContact CB-CB 3.79Å
1765	E	79.2	Confident	81.3	Confident	103 Å²	103	65 Å²	65	48%	0.481	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	-37.8	173.1	-168.3	-165	-114.5	0	0	110.1	K1775 K1777	E1765-K1775 PolarHBondContact N-O 2.04Å; E1765-K1775 IonicContact OE1-NZ 2.73Å; E1765-K1775 WeakPolarHBondContact OE2-CD 3.37Å; E1765-K1775 WeakPolarHBondContact OE2-CE 3.37Å; E1765-K1775 IonicContact OE2-NZ 3.19Å; E1765-K1775 PolarHBondContact OE2-NZ 3.44Å; E1765-K1777 HydrophobicContact CB-CG 3.78Å; E1765-K1777 HydrophobicContact CG-CG 4.38Å
1766	K	79.1	Confident	81.4	Confident	115 Å²	115	63.6 Å²	63.6	50%	0.5	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160	164.2	170.1	64.8	170.8	-169.9	164.5	0	111.9	K1775	K1766-K1775 HydrophobicContact CG-CB 4.1Å; K1766-K1775 HydrophobicContact CG-CD 4.33Å; K1766-K1775 PolarHBondContact N-O 3.5Å; K1766-K1775 PolarHBondContact O-N 3.01Å
1767	C	83.3	Confident	81.4	Confident	12 Å²	12	62.7 Å²	62.7	8%	0.081	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	153.9	161.1	-176.1	0	0	0	0	110.8	C1757 G1772 K1773	C1757-C1767 HydrophobicContact CB-CB 3.73Å; C1757-C1767 WeakPolarHBondContact CB-SG 3.37Å; C1757-C1767 WeakPolarHBondContact SG-CB 3.37Å; C1757-C1767 CovalentContact SG-SG 2.03Å; C1757-C1767 PolarHBondContact SG-SG 3.44Å; C1767-G1772 VanDerWaalsContact SG-CA 3.58Å; C1767-G1772 PolarHBondContact SG-O 3.18Å; C1767-G1772 VanDerWaalsContact SG-O 3.4Å; C1767-K1773 CarbonylContact C-O 3.5Å; C1767-K1773 WeakPolarHBondContact CA-O 3.48Å
1768	E	80.8	Confident	81.4	Confident	88 Å²	88	71.5 Å²	71.5	41%	0.411	35%	0.352	S	S	.	.			trans	-83.1	112.2	168.1	-76.8	-177	176.5	0	0	111.5	Q1770 T1771 G1772 K1773	E1768-Q1770 PolarHBondContact O-N 2.93Å; E1768-T1771 WeakPolarHBondContact CB-OG1 3.5Å; E1768-T1771 PolarHBondContact O-N 2.04Å; E1768-T1771 VanDerWaalsContact O-N 3.08Å; E1768-T1771 PolarHBondContact OE2-OG1 2.76Å; E1768-G1772 PolarHBondContact O-N 2.89Å; E1768-K1773 HydrophobicContact CB-CB 4.31Å; E1768-K1773 HydrophobicContact CG-CB 4.46Å; E1768-K1773 PolarHBondContact N-O 2.91Å
1769	A	73.7	Confident	81.4	Confident	34 Å²	34	68.2 Å²	68.2	28%	0.281	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-8.3	-171.2	0	0	0	0	0	116.8	C1740 Y1745 G1746	C1740-A1769 HydrophobicContact CB-CB 4.17Å; Y1745-A1769 VanDerWaalsContact CA-O 3.25Å; Y1745-A1769 WeakPolarHBondContact CA-O 3.39Å; G1746-A1769 PolarHBondContact N-O 2.88Å; G1746-A1769 VanDerWaalsContact N-O 3.12Å
1770	Q	76.9	Confident	81.4	Confident	175 Å²	175	68.4 Å²	68.4	82%	0.818	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.1	-20.7	175.3	-68.2	-177.6	-6.3	0	0	113.6	E1768	E1768-Q1770 PolarHBondContact O-N 2.93Å
1771	T	82.6	Confident	81.4	Confident	82 Å²	82	69.5 Å²	69.5	50%	0.503	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.8	-16.3	-166.7	64	0	0	0	0	113.7	E1768 K1773	E1768-T1771 WeakPolarHBondContact CB-OG1 3.5Å; E1768-T1771 PolarHBondContact O-N 2.04Å; E1768-T1771 VanDerWaalsContact O-N 3.08Å; E1768-T1771 PolarHBondContact OE2-OG1 2.76Å; T1771-K1773 PolarHBondContact O-N 3Å; T1771-K1773 WeakPolarHBondContact OG1-CB 3.41Å; T1771-K1773 PolarHBondContact OG1-N 3.4Å
1772	G	78.6	Confident	81.4	Confident	13 Å²	13	63.6 Å²	63.6	13%	0.134	32%	0.317	C	S	.	.			trans	78.4	1.2	-174.7	0	0	0	0	0	114	Y1745 C1767 E1768	Y1745-G1772 VanDerWaalsContact CD1-CA 3.48Å; Y1745-G1772 VanDerWaalsContact CD2-N 3.31Å; Y1745-G1772 VanDerWaalsContact CG-N 3.28Å; C1767-G1772 VanDerWaalsContact SG-CA 3.58Å; C1767-G1772 PolarHBondContact SG-O 3.18Å; C1767-G1772 VanDerWaalsContact SG-O 3.4Å; E1768-G1772 PolarHBondContact O-N 2.89Å
1773	K	81.9	Confident	81.4	Confident	131 Å²	131	70.8 Å²	70.8	57%	0.57	35%	0.347	S	S	*	.			trans	-77.5	135.8	-170.9	-169.8	173.4	-177	175.2	0	113	C1767 E1768 T1771	C1767-K1773 CarbonylContact C-O 3.5Å; C1767-K1773 WeakPolarHBondContact CA-O 3.48Å; E1768-K1773 HydrophobicContact CB-CB 4.31Å; E1768-K1773 HydrophobicContact CG-CB 4.46Å; E1768-K1773 PolarHBondContact N-O 2.91Å; T1771-K1773 PolarHBondContact O-N 3Å; T1771-K1773 WeakPolarHBondContact OG1-CB 3.41Å; T1771-K1773 PolarHBondContact OG1-N 3.4Å
1774	C	85.2	Confident	81.5	Confident	21 Å²	21	73.7 Å²	73.7	14%	0.142	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	135.1	-179.6	-45.6	0	0	0	0	111.9	C1759 A1764 E1783	C1759-C1774 WeakPolarHBondContact CA-SG 3.02Å; C1759-C1774 HydrophobicContact CB-CB 3.81Å; C1759-C1774 WeakPolarHBondContact CB-SG 3.14Å; C1759-C1774 WeakPolarHBondContact SG-CA 3.37Å; C1759-C1774 WeakPolarHBondContact SG-CB 3.03Å; C1759-C1774 CovalentContact SG-SG 2.03Å; C1759-C1774 PolarHBondContact SG-SG 2.93Å; A1764-C1774 HydrophobicContact CB-CB 4.37Å; C1774-E1783 WeakPolarHBondContact CB-O 3.34Å; C1774-E1783 PolarHBondContact SG-O 2.91Å
1775	K	85.4	Confident	81.6	Confident	102 Å²	102	73.7 Å²	73.7	44%	0.443	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	117.2	166.4	-173.3	-159.7	172.8	-155.8	0	108.5	A1764 E1765 K1766	A1764-K1775 CarbonylContact C-O 3.56Å; A1764-K1775 WeakPolarHBondContact CA-O 3.35Å; E1765-K1775 PolarHBondContact N-O 2.04Å; E1765-K1775 IonicContact OE1-NZ 2.73Å; E1765-K1775 WeakPolarHBondContact OE2-CD 3.37Å; E1765-K1775 WeakPolarHBondContact OE2-CE 3.37Å; E1765-K1775 IonicContact OE2-NZ 3.19Å; E1765-K1775 PolarHBondContact OE2-NZ 3.44Å; K1766-K1775 HydrophobicContact CG-CB 4.1Å; K1766-K1775 HydrophobicContact CG-CD 4.33Å; K1766-K1775 PolarHBondContact N-O 3.5Å; K1766-K1775 PolarHBondContact O-N 3.01Å
1776	C	85.1	Confident	81.8	Confident	39 Å²	39	72.3 Å²	72.3	26%	0.264	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	149.8	-173.9	-49.4	0	0	0	0	113.4	V1780 C1785	C1776-V1780 HydrophobicContact CB-CB 4.04Å; C1776-V1780 HydrophobicContact CB-CG1 3.9Å; C1776-V1780 VanDerWaalsContact CB-O 3.25Å; C1776-V1780 WeakPolarHBondContact CB-O 3.32Å; C1776-C1785 WeakPolarHBondContact CA-SG 3.47Å; C1776-C1785 HydrophobicContact CB-CB 3.71Å; C1776-C1785 WeakPolarHBondContact CB-SG 3.18Å; C1776-C1785 PolarHBondContact N-SG 2.87Å; C1776-C1785 WeakPolarHBondContact SG-CB 3.33Å; C1776-C1785 CovalentContact SG-SG 2.04Å; C1776-C1785 PolarHBondContact SG-SG 3.04Å
1777	K	80.3	Confident	82.1	Confident	41 Å²	41	70.5 Å²	70.5	18%	0.178	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-66.3	169.3	169.4	-70.6	-179.2	-172.5	136.6	0	110.2	R1761 C1762 G1763 A1764 E1765 N1779 V1780 C1798	R1761-K1777 PolarHBondContact O-NZ 3.19Å; C1762-K1777 WeakPolarHBondContact O-CD 3.34Å; C1762-K1777 PolarHBondContact O-NZ 3.09Å; G1763-K1777 WeakPolarHBondContact O-CB 3.16Å; G1763-K1777 WeakPolarHBondContact O-CG 3.42Å; G1763-K1777 PolarHBondContact O-N 3.12Å; A1764-K1777 WeakPolarHBondContact O-CE 3.38Å; A1764-K1777 PolarHBondContact O-NZ 3.1Å; E1765-K1777 HydrophobicContact CB-CG 3.78Å; E1765-K1777 HydrophobicContact CG-CG 4.38Å; K1777-N1779 PolarHBondContact O-N 2.83Å; K1777-V1780 HydrophobicContact CB-CG2 4.26Å; K1777-V1780 PolarHBondContact O-N 3.45Å; K1777-V1780 VanDerWaalsContact O-N 3.14Å; K1777-C1798 WeakPolarHBondContact CE-O 3.4Å; K1777-C1798 PolarHBondContact NZ-O 3.06Å
1778	R	83.7	Confident	82	Confident	200 Å²	200	70.7 Å²	70.7	76%	0.755	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	131.8	175.6	-175.8	175.2	-178	-177.8	0.8	110.2	V1780 G1800 C1801	R1778-V1780 PolarHBondContact O-N 2.69Å; R1778-G1800 WeakPolarHBondContact O-CA 3.48Å; R1778-C1801 PolarHBondContact O-N 2.97Å
1779	N	82.7	Confident	82.2	Confident	28 Å²	28	68.7 Å²	68.7	15%	0.15	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.7	27.7	179.5	-51.1	-21.8	0	0	0	114.5	K1777 C1788 I1789 A1792 C1801 M1803	K1777-N1779 PolarHBondContact O-N 2.83Å; N1779-C1788 WeakPolarHBondContact O-CA 3.27Å; N1779-I1789 HydrophobicContact CB-CD1 4.01Å; N1779-I1789 HydrophobicContact CB-CG1 3.9Å; N1779-I1789 PolarHBondContact O-N 3.22Å; N1779-A1792 HydrophobicContact CB-CB 3.97Å; N1779-C1801 HydrophobicContact CB-CB 3.86Å; N1779-C1801 WeakPolarHBondContact CB-O 3.32Å; N1779-C1801 PolarHBondContact ND2-O 3.3Å; N1779-C1801 WeakPolarHBondContact O-CB 3.4Å; N1779-M1803 HydrophobicContact CB-CE 4.38Å
1780	V	84.7	Confident	82.5	Confident	12 Å²	12	71.3 Å²	71.3	7%	0.073	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	143.4	170.6	170.3	0	0	0	0	110.5	G1763 C1776 K1777 R1778 C1785 H1787 F1795	G1763-V1780 WeakPolarHBondContact O-CG1 3.03Å; C1776-V1780 HydrophobicContact CB-CB 4.04Å; C1776-V1780 HydrophobicContact CB-CG1 3.9Å; C1776-V1780 VanDerWaalsContact CB-O 3.25Å; C1776-V1780 WeakPolarHBondContact CB-O 3.32Å; K1777-V1780 HydrophobicContact CB-CG2 4.26Å; K1777-V1780 PolarHBondContact O-N 3.45Å; K1777-V1780 VanDerWaalsContact O-N 3.14Å; R1778-V1780 PolarHBondContact O-N 2.69Å; V1780-C1785 HydrophobicContact CG1-CB 3.84Å; V1780-H1787 CarbonylContact C-O 3.54Å; V1780-H1787 WeakPolarHBondContact CA-O 3.03Å; V1780-H1787 WeakPolarHBondContact CG1-O 3.46Å; V1780-F1795 HydrophobicContact CG1-CE2 3.84Å; V1780-F1795 HydrophobicContact CG2-CD2 4.05Å; V1780-F1795 HydrophobicContact CG2-CE2 4.07Å
1781	E	82.5	Confident	82.7	Confident	82 Å²	82	66.7 Å²	66.7	38%	0.383	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	-169	168.3	65.9	-178.2	-93.4	0	0	112.1	C1785 D1786 H1787 I1789	E1781-C1785 CarbonylContact O-C 3.59Å; E1781-C1785 VanDerWaalsContact O-CA 3.29Å; E1781-C1785 WeakPolarHBondContact O-CA 3.19Å; E1781-D1786 PolarHBondContact O-N 3.18Å; E1781-H1787 PolarHBondContact N-O 3.48Å; E1781-H1787 PolarHBondContact O-N 2.95Å; E1781-I1789 HydrophobicContact CB-CG2 3.91Å; E1781-I1789 HydrophobicContact CG-CG2 3.9Å; E1781-I1789 WeakPolarHBondContact OE2-CB 3.22Å; E1781-I1789 VanDerWaalsContact OE2-CG2 3.24Å; E1781-I1789 WeakPolarHBondContact OE2-CG2 3.47Å
1782	G	79.2	Confident	82.7	Confident	26 Å²	26	62.8 Å²	62.8	27%	0.268	32%	0.318	S	S	.	.	S	Bend	trans	98.9	152.4	-166.1	0	0	0	0	0	112.9	C1785 D1786	G1782-C1785 WeakPolarHBondContact O-CA 3.42Å; G1782-C1785 PolarHBondContact O-N 3.31Å; G1782-D1786 WeakPolarHBondContact CA-OD1 3.36Å
1783	E	80.2	Confident	82.9	Confident	183 Å²	183	63.3 Å²	63.3	86%	0.855	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-36.9	-178.6	-173.2	167.2	-132.7	0	0	111.8	C1774 C1785	C1774-E1783 WeakPolarHBondContact CB-O 3.34Å; C1774-E1783 PolarHBondContact SG-O 2.91Å; E1783-C1785 VanDerWaalsContact C-N 3.26Å
1784	N	82.2	Confident	82.8	Confident	60 Å²	60	57.1 Å²	57.1	32%	0.321	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	2.5	167.5	-65.7	-43.5	0	0	0	112.8	S1758 C1759 D1760	S1758-N1784 WeakPolarHBondContact CB-OD1 3.18Å; S1758-N1784 VanDerWaalsContact O-CG 3.26Å; S1758-N1784 PolarHBondContact O-OD1 3.27Å; C1759-N1784 CarbonylContact C-O 3.3Å; C1759-N1784 WeakPolarHBondContact CA-O 3.47Å; D1760-N1784 PolarHBondContact N-O 3.06Å
1785	C	85.7	Confident	82.6	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.007	29%	0.29	C	S	.	.			trans	56.5	60.2	-168.5	-56	0	0	0	0	112.8	G1763 A1764 C1776 V1780 E1781 G1782 E1783 F1795	G1763-C1785 CarbonylContact C-O 3.54Å; G1763-C1785 WeakPolarHBondContact CA-O 3.21Å; A1764-C1785 HydrophobicContact CB-CB 3.79Å; C1776-C1785 WeakPolarHBondContact CA-SG 3.47Å; C1776-C1785 HydrophobicContact CB-CB 3.71Å; C1776-C1785 WeakPolarHBondContact CB-SG 3.18Å; C1776-C1785 PolarHBondContact N-SG 2.87Å; C1776-C1785 WeakPolarHBondContact SG-CB 3.33Å; C1776-C1785 CovalentContact SG-SG 2.04Å; C1776-C1785 PolarHBondContact SG-SG 3.04Å; V1780-C1785 HydrophobicContact CG1-CB 3.84Å; E1781-C1785 CarbonylContact O-C 3.59Å; E1781-C1785 VanDerWaalsContact O-CA 3.29Å; E1781-C1785 WeakPolarHBondContact O-CA 3.19Å; G1782-C1785 WeakPolarHBondContact O-CA 3.42Å; G1782-C1785 PolarHBondContact O-N 3.31Å; E1783-C1785 VanDerWaalsContact C-N 3.26Å; C1785-F1795 WeakPolarHBondContact O-CZ 3.46Å
1786	D	83.2	Confident	82.2	Confident	74 Å²	74	59.7 Å²	59.7	40%	0.396	30%	0.3	S	S	.	.			trans	-108.3	1.2	-165.8	48.3	21.5	0	0	0	115.3	D1760 E1781 G1782 F1795	D1760-D1786 HydrophobicContact CB-CB 4.3Å; E1781-D1786 PolarHBondContact O-N 3.18Å; G1782-D1786 WeakPolarHBondContact CA-OD1 3.36Å; D1786-F1795 WeakPolarHBondContact O-CZ 3.28Å
1787	H	85.4	Confident	81.8	Confident	76 Å²	76	63.8 Å²	63.8	35%	0.352	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	164.8	176.9	58	-74.2	0	0	0	114.7	V1780 E1781 F1795	V1780-H1787 CarbonylContact C-O 3.54Å; V1780-H1787 WeakPolarHBondContact CA-O 3.03Å; V1780-H1787 WeakPolarHBondContact CG1-O 3.46Å; E1781-H1787 PolarHBondContact N-O 3.48Å; E1781-H1787 PolarHBondContact O-N 2.95Å; H1787-F1795 VanDerWaalsContact N-CE2 3.31Å
1788	C	82.7	Confident	81.7	Confident	16 Å²	16	64.5 Å²	64.5	11%	0.108	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	148.6	174.2	-61.9	0	0	0	0	112.3	N1779 A1792 W1793 C1801	N1779-C1788 WeakPolarHBondContact O-CA 3.27Å; C1788-A1792 HydrophobicContact CB-CB 4.21Å; C1788-W1793 VanDerWaalsContact SG-C 3.55Å; C1788-C1801 WeakPolarHBondContact CA-SG 3.26Å; C1788-C1801 HydrophobicContact CB-CB 3.74Å; C1788-C1801 WeakPolarHBondContact CB-SG 3.34Å; C1788-C1801 WeakPolarHBondContact SG-CB 3.5Å; C1788-C1801 CovalentContact SG-SG 2.04Å; C1788-C1801 PolarHBondContact SG-SG 2.85Å
1789	I	83.4	Confident	81.4	Confident	46 Å²	46	62.6 Å²	62.6	24%	0.236	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-66.3	160.9	163.4	74.2	176.1	0	0	0	110.6	N1779 E1781 A1792 M1803	N1779-I1789 HydrophobicContact CB-CD1 4.01Å; N1779-I1789 HydrophobicContact CB-CG1 3.9Å; N1779-I1789 PolarHBondContact O-N 3.22Å; E1781-I1789 HydrophobicContact CB-CG2 3.91Å; E1781-I1789 HydrophobicContact CG-CG2 3.9Å; E1781-I1789 WeakPolarHBondContact OE2-CB 3.22Å; E1781-I1789 VanDerWaalsContact OE2-CG2 3.24Å; E1781-I1789 WeakPolarHBondContact OE2-CG2 3.47Å; I1789-A1792 HydrophobicContact CG1-CB 4.19Å; I1789-A1792 WeakPolarHBondContact O-CB 3.06Å; I1789-A1792 PolarHBondContact O-N 2.05Å; I1789-M1803 HydrophobicContact CD1-CE 3.66Å; I1789-M1803 HydrophobicContact CG1-CE 4.09Å
1790	S	80.8	Confident	81.1	Confident	89 Å²	89	61.6 Å²	61.6	62%	0.622	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	143.4	178.9	-42.2	0	0	0	0	113.4	A1792	S1790-A1792 VanDerWaalsContact C-N 3.28Å
1791	N	81.8	Confident	81.1	Confident	78 Å²	78	61.4 Å²	61.4	42%	0.417	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.1	29.9	-170.7	-61.7	-14.3	0	0	0	114.1	C1804 G1813 Q1814	N1791-C1804 VanDerWaalsContact C-SG 3.51Å; N1791-C1804 WeakPolarHBondContact O-CB 3.44Å; N1791-C1804 PolarHBondContact O-N 3.07Å; N1791-C1804 PolarHBondContact O-SG 3.44Å; N1791-G1813 PolarHBondContact OD1-O 2.77Å; N1791-Q1814 PolarHBondContact OD1-N 3.23Å
1792	A	82.6	Confident	81.1	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	162	172.2	0	0	0	0	0	112.9	N1779 C1788 I1789 S1790 C1801 Q1802 M1803 Q1814	N1779-A1792 HydrophobicContact CB-CB 3.97Å; C1788-A1792 HydrophobicContact CB-CB 4.21Å; I1789-A1792 HydrophobicContact CG1-CB 4.19Å; I1789-A1792 WeakPolarHBondContact O-CB 3.06Å; I1789-A1792 PolarHBondContact O-N 2.05Å; S1790-A1792 VanDerWaalsContact C-N 3.28Å; A1792-C1801 HydrophobicContact CB-CB 3.77Å; A1792-Q1802 CarbonylContact C-O 3.58Å; A1792-Q1802 WeakPolarHBondContact CA-O 3.37Å; A1792-Q1802 VanDerWaalsContact CB-O 3.22Å; A1792-Q1802 WeakPolarHBondContact CB-O 3.37Å; A1792-M1803 HydrophobicContact CB-CE 4.34Å; A1792-Q1814 PolarHBondContact O-NE2 2.72Å
1793	W	83	Confident	81.2	Confident	24 Å²	24	64.4 Å²	64.4	9%	0.091	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	172.4	-173.4	66.8	-80.1	0	0	0	112.9	C1788 Y1797 C1801 Q1802 C1815 D1816 M1819 G1820 L1831	C1788-W1793 VanDerWaalsContact SG-C 3.55Å; W1793-Y1797 AromaticContact CE3-CE2 3.97Å; W1793-Y1797 HydrophobicContact CE3-CE2 3.97Å; W1793-Y1797 HydrophobicContact CH2-CE2 4.48Å; W1793-Y1797 HydrophobicContact CZ3-CD2 4.3Å; W1793-Y1797 AromaticContact CZ3-CE2 3.51Å; W1793-Y1797 HydrophobicContact CZ3-CE2 3.51Å; W1793-C1801 CarbonylContact O-C 3.56Å; W1793-C1801 WeakPolarHBondContact O-CA 3.16Å; W1793-C1801 WeakPolarHBondContact O-CB 3.07Å; W1793-Q1802 HydrophobicContact CD2-CB 3.99Å; W1793-Q1802 HydrophobicContact CG-CB 4.21Å; W1793-Q1802 HydrophobicContact CZ2-CB 3.81Å; W1793-Q1802 HydrophobicContact CZ2-CG 4.01Å; W1793-Q1802 PolarHBondContact N-O 3.14Å; W1793-Q1802 PolarHBondContact O-N 3.08Å; W1793-C1815 VanDerWaalsContact CB-SG 3.57Å; W1793-C1815 VanDerWaalsContact CG-SG 3.52Å; W1793-D1816 WeakPolarHBondContact CB-O 3.43Å; W1793-M1819 VanDerWaalsContact CZ3-C 3.45Å; W1793-M1819 WeakPolarHBondContact CZ3-O 3.22Å; W1793-G1820 VanDerWaalsContact CE2-CA 3.41Å; W1793-G1820 VanDerWaalsContact CG-CA 3.45Å; W1793-L1831 HydrophobicContact CH2-CD2 4.24Å; W1793-L1831 HydrophobicContact CZ2-CD2 3.89Å
1794	G	78.5	Confident	81.2	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.01	28%	0.282	C	S	.	.			trans	88.3	22.9	167.6	0	0	0	0	0	114.1	H1796 Y1797 L1817	G1794-H1796 PolarHBondContact O-N 3.39Å; G1794-Y1797 WeakPolarHBondContact O-CB 3.44Å; G1794-Y1797 WeakPolarHBondContact O-CD2 3.44Å; G1794-Y1797 PolarHBondContact O-N 2.8Å; G1794-L1817 PolarHBondContact N-O 3.46Å
1795	F	82.2	Confident	81.3	Confident	36 Å²	36	58.1 Å²	58.1	16%	0.158	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-48.3	-43.5	176.3	-169.3	-91.7	0	0	0	112.4	D1760 C1762 G1763 V1780 C1785 D1786 H1787 Y1797 C1798	D1760-F1795 HydrophobicContact CB-CZ 4.42Å; D1760-F1795 WeakPolarHBondContact OD1-CE1 3.39Å; D1760-F1795 VanDerWaalsContact OD1-CZ 3.24Å; D1760-F1795 WeakPolarHBondContact OD1-CZ 2.78Å; C1762-F1795 HydrophobicContact CB-CD1 4.37Å; C1762-F1795 HydrophobicContact CB-CE1 3.95Å; C1762-F1795 HydrophobicContact CB-CZ 4.43Å; G1763-F1795 VanDerWaalsContact CA-CZ 3.49Å; V1780-F1795 HydrophobicContact CG1-CE2 3.84Å; V1780-F1795 HydrophobicContact CG2-CD2 4.05Å; V1780-F1795 HydrophobicContact CG2-CE2 4.07Å; C1785-F1795 WeakPolarHBondContact O-CZ 3.46Å; D1786-F1795 WeakPolarHBondContact O-CZ 3.28Å; H1787-F1795 VanDerWaalsContact N-CE2 3.31Å; F1795-Y1797 PolarHBondContact O-N 2.78Å; F1795-C1798 PolarHBondContact O-N 2.62Å
1796	H	77	Confident	81.1	Confident	141 Å²	141	59.4 Å²	59.4	65%	0.653	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-65.1	-17.6	-179.6	-164.4	-63.9	0	0	0	114	G1794 C1798	G1794-H1796 PolarHBondContact O-N 3.39Å; H1796-C1798 PolarHBondContact O-N 2.62Å
1797	Y	75.2	Confident	81.1	Confident	126 Å²	126	57.3 Å²	57.3	49%	0.494	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-76.6	-1.5	171.2	-57.6	-67.6	0	0	0	113	W1793 G1794 F1795 Q1799 Q1818	W1793-Y1797 AromaticContact CE3-CE2 3.97Å; W1793-Y1797 HydrophobicContact CE3-CE2 3.97Å; W1793-Y1797 HydrophobicContact CH2-CE2 4.48Å; W1793-Y1797 HydrophobicContact CZ3-CD2 4.3Å; W1793-Y1797 AromaticContact CZ3-CE2 3.51Å; W1793-Y1797 HydrophobicContact CZ3-CE2 3.51Å; G1794-Y1797 WeakPolarHBondContact O-CB 3.44Å; G1794-Y1797 WeakPolarHBondContact O-CD2 3.44Å; G1794-Y1797 PolarHBondContact O-N 2.8Å; F1795-Y1797 PolarHBondContact O-N 2.78Å; Y1797-Q1799 WeakPolarHBondContact O-CG 3.25Å; Y1797-Q1799 PolarHBondContact O-N 2.78Å; Y1797-Q1818 WeakPolarHBondContact CE2-O 2.83Å; Y1797-Q1818 PolarHBondContact OH-O 3.19Å
1798	C	79.5	Confident	80.9	Confident	55 Å²	55	56.6 Å²	56.6	37%	0.372	30%	0.304	S	S	.	.	S	Bend	trans	65.2	8.4	170.5	-125.1	0	0	0	0	114.7	C1762 K1777 F1795 H1796	C1762-C1798 WeakPolarHBondContact CA-SG 3.27Å; C1762-C1798 HydrophobicContact CB-CB 3.91Å; C1762-C1798 WeakPolarHBondContact CB-SG 3.37Å; C1762-C1798 WeakPolarHBondContact SG-CB 3.46Å; C1762-C1798 CovalentContact SG-SG 2.06Å; C1762-C1798 PolarHBondContact SG-SG 2.78Å; K1777-C1798 WeakPolarHBondContact CE-O 3.4Å; K1777-C1798 PolarHBondContact NZ-O 3.06Å; F1795-C1798 PolarHBondContact O-N 2.62Å; H1796-C1798 PolarHBondContact O-N 2.62Å
1799	Q	77.7	Confident	80.8	Confident	161 Å²	161	55.8 Å²	55.8	75%	0.752	30%	0.299	S	S	*	.	S	Bend	trans	-100.8	6.4	-175.2	-72.3	172.9	26.8	0	0	113.7	Y1797	Y1797-Q1799 WeakPolarHBondContact O-CG 3.25Å; Y1797-Q1799 PolarHBondContact O-N 2.78Å
1800	G	76.7	Confident	80.7	Confident	7 Å²	7	54.8 Å²	54.8	7%	0.072	30%	0.296	C	S	.	.			trans	79	174.2	-157.3	0	0	0	0	0	110.6	R1778	R1778-G1800 WeakPolarHBondContact O-CA 3.48Å
1801	C	83.6	Confident	80.7	Confident	7 Å²	7	55 Å²	55	5%	0.047	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-94	140.6	-172.1	-58.6	0	0	0	0	112.8	R1778 N1779 C1788 A1792 W1793	R1778-C1801 PolarHBondContact O-N 2.97Å; N1779-C1801 HydrophobicContact CB-CB 3.86Å; N1779-C1801 WeakPolarHBondContact CB-O 3.32Å; N1779-C1801 PolarHBondContact ND2-O 3.3Å; N1779-C1801 WeakPolarHBondContact O-CB 3.4Å; C1788-C1801 WeakPolarHBondContact CA-SG 3.26Å; C1788-C1801 HydrophobicContact CB-CB 3.74Å; C1788-C1801 WeakPolarHBondContact CB-SG 3.34Å; C1788-C1801 WeakPolarHBondContact SG-CB 3.5Å; C1788-C1801 CovalentContact SG-SG 2.04Å; C1788-C1801 PolarHBondContact SG-SG 2.85Å; A1792-C1801 HydrophobicContact CB-CB 3.77Å; W1793-C1801 CarbonylContact O-C 3.56Å; W1793-C1801 WeakPolarHBondContact O-CA 3.16Å; W1793-C1801 WeakPolarHBondContact O-CB 3.07Å
1802	Q	81.8	Confident	80.5	Confident	111 Å²	111	53.8 Å²	53.8	52%	0.519	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	144.6	170.2	-71.2	-87.9	-8.7	0	0	109.1	A1792 W1793	A1792-Q1802 CarbonylContact C-O 3.58Å; A1792-Q1802 WeakPolarHBondContact CA-O 3.37Å; A1792-Q1802 VanDerWaalsContact CB-O 3.22Å; A1792-Q1802 WeakPolarHBondContact CB-O 3.37Å; W1793-Q1802 HydrophobicContact CD2-CB 3.99Å; W1793-Q1802 HydrophobicContact CG-CB 4.21Å; W1793-Q1802 HydrophobicContact CZ2-CB 3.81Å; W1793-Q1802 HydrophobicContact CZ2-CG 4.01Å; W1793-Q1802 PolarHBondContact N-O 3.14Å; W1793-Q1802 PolarHBondContact O-N 3.08Å
1803	M	81.4	Confident	80.3	Confident	60 Å²	60	55.4 Å²	55.4	30%	0.296	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	139.5	171.4	-82.8	-81.5	153.9	0	0	109.9	N1779 I1789 A1792 N1805	N1779-M1803 HydrophobicContact CB-CE 4.38Å; I1789-M1803 HydrophobicContact CD1-CE 3.66Å; I1789-M1803 HydrophobicContact CG1-CE 4.09Å; A1792-M1803 HydrophobicContact CB-CE 4.34Å; M1803-N1805 VanDerWaalsContact C-N 3.32Å; M1803-N1805 WeakPolarHBondContact CB-OD1 3.38Å; M1803-N1805 PolarHBondContact O-N 3Å
1804	C	81.8	Confident	80.2	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	31%	0.314	C	S	.	.			trans	-67.4	-29.2	-176.8	-73.1	0	0	0	0	113.4	N1791 C1806 G1813 C1815 C1822 F1832	N1791-C1804 VanDerWaalsContact C-SG 3.51Å; N1791-C1804 WeakPolarHBondContact O-CB 3.44Å; N1791-C1804 PolarHBondContact O-N 3.07Å; N1791-C1804 PolarHBondContact O-SG 3.44Å; C1804-C1806 PolarHBondContact O-N 3.47Å; C1804-G1813 WeakPolarHBondContact CB-O 3.19Å; C1804-C1815 WeakPolarHBondContact CA-SG 3.18Å; C1804-C1815 HydrophobicContact CB-CB 3.61Å; C1804-C1815 WeakPolarHBondContact CB-SG 2.96Å; C1804-C1815 WeakPolarHBondContact SG-CB 3.43Å; C1804-C1815 PolarHBondContact SG-N 2.91Å; C1804-C1815 CovalentContact SG-SG 2.04Å; C1804-C1815 PolarHBondContact SG-SG 3.03Å; C1804-C1822 PolarHBondContact O-SG 3.4Å; C1804-F1832 WeakPolarHBondContact O-CD1 3.46Å
1805	N	83	Confident	80.4	Confident	111 Å²	111	57 Å²	57	59%	0.594	32%	0.316	S	S	*	.			trans	48.6	28.9	171.6	-65	-25.7	0	0	0	115.4	M1803 A1807 F1832	M1803-N1805 VanDerWaalsContact C-N 3.32Å; M1803-N1805 WeakPolarHBondContact CB-OD1 3.38Å; M1803-N1805 PolarHBondContact O-N 3Å; N1805-A1807 PolarHBondContact O-N 2.73Å; N1805-F1832 HydrophobicContact CB-CD1 4.11Å; N1805-F1832 HydrophobicContact CB-CE1 4.2Å
1806	C	82.8	Confident	80.3	Confident	28 Å²	28	58.8 Å²	58.8	19%	0.189	33%	0.328	C	S	.	.			trans	-60.8	130.8	-171.3	-54.8	0	0	0	0	112.1	C1804 S1810 S1812 C1822	C1804-C1806 PolarHBondContact O-N 3.47Å; C1806-S1810 WeakPolarHBondContact CB-OG 3.46Å; C1806-S1812 PolarHBondContact SG-O 2.94Å; C1806-S1812 VanDerWaalsContact SG-O 3.41Å; C1806-C1822 WeakPolarHBondContact CA-SG 3.14Å; C1806-C1822 HydrophobicContact CB-CB 3.79Å; C1806-C1822 WeakPolarHBondContact CB-SG 2.88Å; C1806-C1822 WeakPolarHBondContact SG-CB 3.17Å; C1806-C1822 CovalentContact SG-SG 2.03Å; C1806-C1822 PolarHBondContact SG-SG 3.47Å
1807	A	82.4	Confident	80.2	Confident	30 Å²	30	56.5 Å²	56.5	25%	0.248	32%	0.319	C	S	.	.			trans	-82.2	-179.4	-177.4	0	0	0	0	0	112	N1805 A1809 S1810 F1832 D1834 Y1843	N1805-A1807 PolarHBondContact O-N 2.73Å; A1807-A1809 PolarHBondContact O-N 2.66Å; A1807-A1809 VanDerWaalsContact O-N 3.09Å; A1807-S1810 WeakPolarHBondContact O-CB 3.23Å; A1807-S1810 PolarHBondContact O-N 3.25Å; A1807-S1810 PolarHBondContact O-OG 2.81Å; A1807-F1832 WeakPolarHBondContact CB-O 3.14Å; A1807-F1832 PolarHBondContact N-O 2.99Å; A1807-D1834 HydrophobicContact CB-CB 4.35Å; A1807-Y1843 VanDerWaalsContact CB-OH 3.31Å; A1807-Y1843 WeakPolarHBondContact CB-OH 3.25Å
1808	A	81.5	Confident	80.1	Confident	61 Å²	61	56.3 Å²	56.3	50%	0.504	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-28.8	-169.1	0	0	0	0	0	114.6	S1810 Y1843 V1845	A1808-S1810 VanDerWaalsContact C-N 3.33Å; A1808-Y1843 HydrophobicContact CB-CE1 4.31Å; A1808-Y1843 PolarHBondContact N-OH 3.26Å; A1808-V1845 HydrophobicContact CB-CG1 4.08Å; A1808-V1845 WeakPolarHBondContact O-CA 3.23Å
1809	A	80.6	Confident	79.9	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	24.3	178.7	0	0	0	0	0	114.1	A1807 Q1825 A1828 Y1843 S1844	A1807-A1809 PolarHBondContact O-N 2.66Å; A1807-A1809 VanDerWaalsContact O-N 3.09Å; A1809-Q1825 VanDerWaalsContact O-CB 3.28Å; A1809-Q1825 WeakPolarHBondContact O-CB 3.43Å; A1809-Q1825 WeakPolarHBondContact O-CG 3.15Å; A1809-Q1825 PolarHBondContact O-N 3.37Å; A1809-A1828 HydrophobicContact CB-CB 3.5Å; A1809-A1828 VanDerWaalsContact CB-CB 3.5Å; A1809-Y1843 HydrophobicContact CB-CD2 4.14Å; A1809-Y1843 HydrophobicContact CB-CE1 4.3Å; A1809-Y1843 HydrophobicContact CB-CE2 3.37Å; A1809-Y1843 VanDerWaalsContact CB-CZ 3.46Å; A1809-Y1843 WeakPolarHBondContact CB-OH 3.4Å; A1809-Y1843 PolarHBondContact N-OH 2.9Å; A1809-Y1843 VanDerWaalsContact N-OH 3.09Å; A1809-S1844 WeakPolarHBondContact CB-O 2.95Å
1810	S	79.9	Confident	79.9	Confident	24 Å²	24	52.2 Å²	52.2	17%	0.168	30%	0.3	C	S	.	.	B	Isolated β-bridge	trans	-91	156.2	171.9	64.5	0	0	0	0	112.5	C1806 A1807 A1808 S1812 P1823	C1806-S1810 WeakPolarHBondContact CB-OG 3.46Å; A1807-S1810 WeakPolarHBondContact O-CB 3.23Å; A1807-S1810 PolarHBondContact O-N 3.25Å; A1807-S1810 PolarHBondContact O-OG 2.81Å; A1808-S1810 VanDerWaalsContact C-N 3.33Å; S1810-S1812 PolarHBondContact OG-O 2.76Å; S1810-P1823 CarbonylContact C-O 3.38Å; S1810-P1823 WeakPolarHBondContact CA-O 3.11Å
1811	V	81.2	Confident	80.1	Confident	94 Å²	94	55.4 Å²	55.4	57%	0.57	31%	0.313	S	S	*	.	S	Bend	trans	-86.9	-26.4	172.5	-175.3	0	0	0	0	110.8	P1823 Q1825	V1811-P1823 HydrophobicContact CB-CB 4.37Å; V1811-P1823 HydrophobicContact CB-CG 4.42Å; V1811-P1823 PolarHBondContact N-O 2.03Å; V1811-Q1825 HydrophobicContact CG2-CG 4.22Å
1812	S	77.2	Confident	80.1	Confident	52 Å²	52	55.1 Å²	55.1	36%	0.364	31%	0.311	S	S	.	.			trans	-147.6	152.2	-177.4	-178.4	0	0	0	0	110.8	C1806 S1810 Q1814	C1806-S1812 PolarHBondContact SG-O 2.94Å; C1806-S1812 VanDerWaalsContact SG-O 3.41Å; S1810-S1812 PolarHBondContact OG-O 2.76Å; S1812-Q1814 VanDerWaalsContact C-N 3.27Å; S1812-Q1814 PolarHBondContact OG-N 2.84Å; S1812-Q1814 VanDerWaalsContact OG-N 3.11Å
1813	G	78.9	Confident	80.2	Confident	34 Å²	34	52.3 Å²	52.3	35%	0.351	30%	0.303	S	S	.	.	S	Bend	trans	-75.2	-14.6	168.5	0	0	0	0	0	114	N1791 C1804	N1791-G1813 PolarHBondContact OD1-O 2.77Å; C1804-G1813 WeakPolarHBondContact CB-O 3.19Å
1814	Q	81.9	Confident	80.4	Confident	51 Å²	51	51.2 Å²	51.2	24%	0.238	30%	0.3	C	S	.	.			trans	-90	135.9	169.9	-179.9	62.7	51.7	0	0	109.5	N1791 A1792 S1812 P1823	N1791-Q1814 PolarHBondContact OD1-N 3.23Å; A1792-Q1814 PolarHBondContact O-NE2 2.72Å; S1812-Q1814 VanDerWaalsContact C-N 3.27Å; S1812-Q1814 PolarHBondContact OG-N 2.84Å; S1812-Q1814 VanDerWaalsContact OG-N 3.11Å; Q1814-P1823 WeakPolarHBondContact O-CD 3.43Å; Q1814-P1823 WeakPolarHBondContact O-CG 3.24Å
1815	C	82.2	Confident	80.4	Confident	7 Å²	7	54.4 Å²	54.4	5%	0.047	32%	0.315	C	S	.	.			trans	-112	171.8	179.6	64.3	0	0	0	0	111.3	W1793 C1804 L1817 G1820 C1822	W1793-C1815 VanDerWaalsContact CB-SG 3.57Å; W1793-C1815 VanDerWaalsContact CG-SG 3.52Å; C1804-C1815 WeakPolarHBondContact CA-SG 3.18Å; C1804-C1815 HydrophobicContact CB-CB 3.61Å; C1804-C1815 WeakPolarHBondContact CB-SG 2.96Å; C1804-C1815 WeakPolarHBondContact SG-CB 3.43Å; C1804-C1815 PolarHBondContact SG-N 2.91Å; C1804-C1815 CovalentContact SG-SG 2.04Å; C1804-C1815 PolarHBondContact SG-SG 3.03Å; C1815-L1817 PolarHBondContact O-N 3.3Å; C1815-G1820 WeakPolarHBondContact CB-O 3.49Å; C1815-C1822 HydrophobicContact CB-CB 4.26Å
1816	D	79.9	Confident	80.3	Confident	75 Å²	75	53.2 Å²	53.2	40%	0.401	32%	0.316	S	S	.	.			trans	-55.1	129	177.9	-173	-81.5	0	0	0	112	W1793 Q1818 M1819 G1820 Q1821	W1793-D1816 WeakPolarHBondContact CB-O 3.43Å; D1816-Q1818 VanDerWaalsContact C-N 3.28Å; D1816-Q1818 PolarHBondContact O-N 3.27Å; D1816-Q1818 WeakPolarHBondContact OD1-CA 3.23Å; D1816-Q1818 PolarHBondContact OD1-N 3.46Å; D1816-M1819 HydrophobicContact CB-CB 4.24Å; D1816-M1819 PolarHBondContact OD1-N 3.4Å; D1816-G1820 VanDerWaalsContact O-CA 3.29Å; D1816-G1820 WeakPolarHBondContact O-CA 3.1Å; D1816-G1820 PolarHBondContact O-N 3.06Å; D1816-Q1821 HydrophobicContact CB-CB 4.37Å; D1816-Q1821 PolarHBondContact N-O 2.81Å
1817	L	75.9	Confident	80.3	Confident	92 Å²	92	52.4 Å²	52.4	48%	0.482	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-21.8	-172.2	-69.7	172.3	0	0	0	114	G1794 C1815	G1794-L1817 PolarHBondContact N-O 3.46Å; C1815-L1817 PolarHBondContact O-N 3.3Å
1818	Q	72	Confident	80.4	Confident	122 Å²	122	51.4 Å²	51.4	57%	0.57	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	-52.8	173.1	-72.3	-170	-4.1	0	0	111.6	Y1797 D1816	Y1797-Q1818 WeakPolarHBondContact CE2-O 2.83Å; Y1797-Q1818 PolarHBondContact OH-O 3.19Å; D1816-Q1818 VanDerWaalsContact C-N 3.28Å; D1816-Q1818 PolarHBondContact O-N 3.27Å; D1816-Q1818 WeakPolarHBondContact OD1-CA 3.23Å; D1816-Q1818 PolarHBondContact OD1-N 3.46Å
1819	M	75.1	Confident	80.2	Confident	130 Å²	130	50 Å²	50	64%	0.64	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-17.1	-169	-55.7	-167	77.4	0	0	114.2	W1793 D1816 Q1821 L1831	W1793-M1819 VanDerWaalsContact CZ3-C 3.45Å; W1793-M1819 WeakPolarHBondContact CZ3-O 3.22Å; D1816-M1819 HydrophobicContact CB-CB 4.24Å; D1816-M1819 PolarHBondContact OD1-N 3.4Å; M1819-Q1821 HydrophobicContact CB-CB 4.42Å; M1819-Q1821 PolarHBondContact O-N 3.36Å; M1819-L1831 VanDerWaalsContact O-CD1 3.29Å; M1819-L1831 WeakPolarHBondContact O-CD1 3.47Å
1820	G	77.7	Confident	79.9	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	29%	0.292	C	S	.	.			trans	73.8	1.6	-177.8	0	0	0	0	0	115.4	W1793 C1815 D1816 C1822	W1793-G1820 VanDerWaalsContact CE2-CA 3.41Å; W1793-G1820 VanDerWaalsContact CG-CA 3.45Å; C1815-G1820 WeakPolarHBondContact CB-O 3.49Å; D1816-G1820 VanDerWaalsContact O-CA 3.29Å; D1816-G1820 WeakPolarHBondContact O-CA 3.1Å; D1816-G1820 PolarHBondContact O-N 3.06Å; G1820-C1822 PolarHBondContact O-N 2.99Å
1821	Q	80.6	Confident	79.7	Confident	74 Å²	74	51.8 Å²	51.8	35%	0.346	30%	0.299	S	S	.	.			trans	-68.9	111.2	-179.4	-176.8	52.7	63	0	0	109.2	D1816 M1819 C1824 G1830	D1816-Q1821 HydrophobicContact CB-CB 4.37Å; D1816-Q1821 PolarHBondContact N-O 2.81Å; M1819-Q1821 HydrophobicContact CB-CB 4.42Å; M1819-Q1821 PolarHBondContact O-N 3.36Å; Q1821-C1824 PolarHBondContact NE2-SG 3.26Å; Q1821-G1830 PolarHBondContact NE2-O 2.9Å; Q1821-G1830 PolarHBondContact OE1-O 3.31Å
1822	C	84.6	Confident	79.9	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.007	29%	0.286	C	S	.	.			trans	-57.7	141.1	169.4	-69.7	0	0	0	0	109.7	C1804 C1806 C1815 G1820 C1824 L1831 C1833	C1804-C1822 PolarHBondContact O-SG 3.4Å; C1806-C1822 WeakPolarHBondContact CA-SG 3.14Å; C1806-C1822 HydrophobicContact CB-CB 3.79Å; C1806-C1822 WeakPolarHBondContact CB-SG 2.88Å; C1806-C1822 WeakPolarHBondContact SG-CB 3.17Å; C1806-C1822 CovalentContact SG-SG 2.03Å; C1806-C1822 PolarHBondContact SG-SG 3.47Å; C1815-C1822 HydrophobicContact CB-CB 4.26Å; G1820-C1822 PolarHBondContact O-N 2.99Å; C1822-C1824 PolarHBondContact O-N 2.74Å; C1822-C1824 PolarHBondContact O-SG 2.93Å; C1822-L1831 PolarHBondContact N-O 3.41Å; C1822-C1833 VanDerWaalsContact C-SG 3.56Å; C1822-C1833 HydrophobicContact CB-CB 4.42Å; C1822-C1833 WeakPolarHBondContact CB-SG 3.3Å; C1822-C1833 PolarHBondContact O-SG 3.22Å
1823	P	84.3	Confident	80.3	Confident	53 Å²	53	48.1 Å²	48.1	34%	0.344	27%	0.268	S	S	.	.			trans	-70.6	112.8	173.6	28.7	-32.9	0	0	0	108	S1810 V1811 Q1814	S1810-P1823 CarbonylContact C-O 3.38Å; S1810-P1823 WeakPolarHBondContact CA-O 3.11Å; V1811-P1823 HydrophobicContact CB-CB 4.37Å; V1811-P1823 HydrophobicContact CB-CG 4.42Å; V1811-P1823 PolarHBondContact N-O 2.03Å; Q1814-P1823 WeakPolarHBondContact O-CD 3.43Å; Q1814-P1823 WeakPolarHBondContact O-CG 3.24Å
1824	C	84.1	Confident	80.6	Confident	36 Å²	36	49.8 Å²	49.8	24%	0.243	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-88.6	141.9	-172.3	-59.1	0	0	0	0	112.4	Q1821 C1822 A1828 C1833	Q1821-C1824 PolarHBondContact NE2-SG 3.26Å; C1822-C1824 PolarHBondContact O-N 2.74Å; C1822-C1824 PolarHBondContact O-SG 2.93Å; C1824-A1828 HydrophobicContact CB-CB 3.87Å; C1824-A1828 WeakPolarHBondContact CB-O 3.22Å; C1824-C1833 WeakPolarHBondContact CA-SG 3.16Å; C1824-C1833 HydrophobicContact CB-CB 3.88Å; C1824-C1833 WeakPolarHBondContact CB-SG 3.08Å; C1824-C1833 PolarHBondContact N-SG 2.96Å; C1824-C1833 VanDerWaalsContact N-SG 3.41Å; C1824-C1833 VanDerWaalsContact SG-CA 3.51Å; C1824-C1833 WeakPolarHBondContact SG-CB 3.29Å; C1824-C1833 CovalentContact SG-SG 2.04Å; C1824-C1833 PolarHBondContact SG-SG 3.5Å
1825	Q	82.2	Confident	80.7	Confident	67 Å²	67	53.4 Å²	53.4	31%	0.313	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-56.5	154.8	163.3	-69.3	-71	-3.6	0	0	109.1	A1809 V1811 G1827 A1828	A1809-Q1825 VanDerWaalsContact O-CB 3.28Å; A1809-Q1825 WeakPolarHBondContact O-CB 3.43Å; A1809-Q1825 WeakPolarHBondContact O-CG 3.15Å; A1809-Q1825 PolarHBondContact O-N 3.37Å; V1811-Q1825 HydrophobicContact CG2-CG 4.22Å; Q1825-G1827 PolarHBondContact O-N 2.52Å; Q1825-A1828 PolarHBondContact O-N 3.15Å
1826	S	82.3	Confident	80.7	Confident	87 Å²	87	53.2 Å²	53.2	61%	0.608	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.9	119.2	-173.8	-161.1	0	0	0	0	111.3	G1847 C1848	S1826-G1847 WeakPolarHBondContact O-CA 3.44Å; S1826-C1848 PolarHBondContact O-N 3.12Å; S1826-C1848 VanDerWaalsContact O-O 3.09Å
1827	G	82.1	Confident	80.7	Confident	10 Å²	10	50.5 Å²	50.5	10%	0.103	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.1	-5.5	-179.5	0	0	0	0	0	118	Q1825 C1836 A1837 Y1840 C1848	Q1825-G1827 PolarHBondContact O-N 2.52Å; G1827-C1836 CarbonylContact O-C 3.57Å; G1827-C1836 WeakPolarHBondContact O-CA 3.07Å; G1827-A1837 WeakPolarHBondContact O-CB 3.35Å; G1827-A1837 PolarHBondContact O-N 3.12Å; G1827-Y1840 VanDerWaalsContact CA-CE1 3.5Å; G1827-Y1840 WeakPolarHBondContact O-CB 3.48Å; G1827-C1848 VanDerWaalsContact O-CB 3.28Å; G1827-C1848 WeakPolarHBondContact O-CB 3.05Å
1828	A	84	Confident	80.6	Confident	9 Å²	9	53.2 Å²	53.2	7%	0.074	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	153.9	170.9	0	0	0	0	0	111.9	A1809 C1824 Q1825 C1833 R1835	A1809-A1828 HydrophobicContact CB-CB 3.5Å; A1809-A1828 VanDerWaalsContact CB-CB 3.5Å; C1824-A1828 HydrophobicContact CB-CB 3.87Å; C1824-A1828 WeakPolarHBondContact CB-O 3.22Å; Q1825-A1828 PolarHBondContact O-N 3.15Å; A1828-C1833 HydrophobicContact CB-CB 4.28Å; A1828-R1835 CarbonylContact C-O 3.58Å; A1828-R1835 WeakPolarHBondContact CA-O 3.45Å
1829	S	77.4	Confident	80.7	Confident	31 Å²	31	47.6 Å²	47.6	22%	0.217	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	-167.4	175	90.8	0	0	0	0	112.3	C1833 D1834 R1835 C1836 A1837	S1829-C1833 CarbonylContact O-C 3.21Å; S1829-C1833 VanDerWaalsContact O-CA 3.24Å; S1829-C1833 WeakPolarHBondContact O-CA 3.17Å; S1829-D1834 PolarHBondContact O-N 3.43Å; S1829-D1834 VanDerWaalsContact O-N 3.12Å; S1829-R1835 PolarHBondContact N-O 3.5Å; S1829-R1835 CarbonylContact O-C 3.47Å; S1829-R1835 VanDerWaalsContact O-CG 3.28Å; S1829-R1835 WeakPolarHBondContact O-CG 3.38Å; S1829-R1835 PolarHBondContact O-N 3.02Å; S1829-C1836 PolarHBondContact OG-O 2.67Å; S1829-A1837 VanDerWaalsContact CB-CA 3.44Å; S1829-A1837 VanDerWaalsContact OG-CA 3.27Å; S1829-A1837 WeakPolarHBondContact OG-CA 3.11Å; S1829-A1837 PolarHBondContact OG-N 2.82Å
1830	G	74.8	Confident	81.2	Confident	4 Å²	4	44.6 Å²	44.6	4%	0.041	23%	0.234	C	C	.	.	S	Bend	trans	82	155.1	-161.6	0	0	0	0	0	109.3	Q1821 F1832 C1833 D1834 R1835	Q1821-G1830 PolarHBondContact NE2-O 2.9Å; Q1821-G1830 PolarHBondContact OE1-O 3.31Å; G1830-F1832 PolarHBondContact O-N 3.27Å; G1830-C1833 PolarHBondContact O-N 2.78Å; G1830-D1834 WeakPolarHBondContact CA-OD1 3.33Å; G1830-R1835 VanDerWaalsContact CA-CZ 3.4Å
1831	L	76	Confident	81.4	Confident	59 Å²	59	48.5 Å²	48.5	31%	0.309	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-34.1	-175.1	-168.5	68	0	0	0	111.7	W1793 M1819 C1822	W1793-L1831 HydrophobicContact CH2-CD2 4.24Å; W1793-L1831 HydrophobicContact CZ2-CD2 3.89Å; M1819-L1831 VanDerWaalsContact O-CD1 3.29Å; M1819-L1831 WeakPolarHBondContact O-CD1 3.47Å; C1822-L1831 PolarHBondContact N-O 3.41Å
1832	F	84.6	Confident	81.5	Confident	69 Å²	69	48.4 Å²	48.4	30%	0.303	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	8.7	-177	-50.9	-49	0	0	0	113.6	C1804 N1805 A1807 G1830 D1834	C1804-F1832 WeakPolarHBondContact O-CD1 3.46Å; N1805-F1832 HydrophobicContact CB-CD1 4.11Å; N1805-F1832 HydrophobicContact CB-CE1 4.2Å; A1807-F1832 WeakPolarHBondContact CB-O 3.14Å; A1807-F1832 PolarHBondContact N-O 2.99Å; G1830-F1832 PolarHBondContact O-N 3.27Å; F1832-D1834 HydrophobicContact CB-CB 4.18Å; F1832-D1834 PolarHBondContact N-OD1 2.87Å; F1832-D1834 PolarHBondContact O-N 2.88Å
1833	C	86.2	Confident	81.4	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.266	C	S	.	.	S	Bend	trans	53.2	39.2	-164.7	-50.9	0	0	0	0	111.7	C1822 C1824 A1828 S1829 G1830 Y1843	C1822-C1833 VanDerWaalsContact C-SG 3.56Å; C1822-C1833 HydrophobicContact CB-CB 4.42Å; C1822-C1833 WeakPolarHBondContact CB-SG 3.3Å; C1822-C1833 PolarHBondContact O-SG 3.22Å; C1824-C1833 WeakPolarHBondContact CA-SG 3.16Å; C1824-C1833 HydrophobicContact CB-CB 3.88Å; C1824-C1833 WeakPolarHBondContact CB-SG 3.08Å; C1824-C1833 PolarHBondContact N-SG 2.96Å; C1824-C1833 VanDerWaalsContact N-SG 3.41Å; C1824-C1833 VanDerWaalsContact SG-CA 3.51Å; C1824-C1833 WeakPolarHBondContact SG-CB 3.29Å; C1824-C1833 CovalentContact SG-SG 2.04Å; C1824-C1833 PolarHBondContact SG-SG 3.5Å; A1828-C1833 HydrophobicContact CB-CB 4.28Å; S1829-C1833 CarbonylContact O-C 3.21Å; S1829-C1833 VanDerWaalsContact O-CA 3.24Å; S1829-C1833 WeakPolarHBondContact O-CA 3.17Å; G1830-C1833 PolarHBondContact O-N 2.78Å; C1833-Y1843 WeakPolarHBondContact O-CE2 3.45Å; C1833-Y1843 VanDerWaalsContact O-CZ 3.28Å; C1833-Y1843 PolarHBondContact O-OH 2.04Å
1834	D	84	Confident	81.2	Confident	69 Å²	69	51.4 Å²	51.4	37%	0.369	26%	0.262	S	S	.	.			trans	-86.4	-12.9	-173.8	53.4	-68.9	0	0	0	114.2	A1807 S1829 G1830 F1832	A1807-D1834 HydrophobicContact CB-CB 4.35Å; S1829-D1834 PolarHBondContact O-N 3.43Å; S1829-D1834 VanDerWaalsContact O-N 3.12Å; G1830-D1834 WeakPolarHBondContact CA-OD1 3.33Å; F1832-D1834 HydrophobicContact CB-CB 4.18Å; F1832-D1834 PolarHBondContact N-OD1 2.87Å; F1832-D1834 PolarHBondContact O-N 2.88Å
1835	R	84.5	Confident	81	Confident	127 Å²	127	55 Å²	55	48%	0.479	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	-177.2	-179.3	56.5	177.8	175.5	-91.5	12.6	110.4	A1828 S1829 G1830	A1828-R1835 CarbonylContact C-O 3.58Å; A1828-R1835 WeakPolarHBondContact CA-O 3.45Å; S1829-R1835 PolarHBondContact N-O 3.5Å; S1829-R1835 CarbonylContact O-C 3.47Å; S1829-R1835 VanDerWaalsContact O-CG 3.28Å; S1829-R1835 WeakPolarHBondContact O-CG 3.38Å; S1829-R1835 PolarHBondContact O-N 3.02Å; G1830-R1835 VanDerWaalsContact CA-CZ 3.4Å
1836	C	82.9	Confident	81	Confident	2 Å²	2	56 Å²	56	1%	0.014	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	159	168.7	-57.3	0	0	0	0	111.7	G1827 S1829 Y1840 W1841 C1848 T1865	G1827-C1836 CarbonylContact O-C 3.57Å; G1827-C1836 WeakPolarHBondContact O-CA 3.07Å; S1829-C1836 PolarHBondContact OG-O 2.67Å; C1836-Y1840 VanDerWaalsContact CB-C 3.49Å; C1836-Y1840 WeakPolarHBondContact CB-O 2.94Å; C1836-W1841 VanDerWaalsContact SG-CA 3.55Å; C1836-C1848 WeakPolarHBondContact CA-SG 3.1Å; C1836-C1848 HydrophobicContact CB-CB 3.66Å; C1836-C1848 WeakPolarHBondContact CB-SG 3.35Å; C1836-C1848 WeakPolarHBondContact SG-CB 3.45Å; C1836-C1848 CovalentContact SG-SG 2.04Å; C1836-C1848 PolarHBondContact SG-SG 2.63Å; C1836-T1865 HydrophobicContact CB-CG2 4.03Å
1837	A	78.7	Confident	80.9	Confident	19 Å²	19	52 Å²	52	16%	0.157	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-66.2	154	167.4	0	0	0	0	0	110.7	G1827 S1829 G1839 Y1840	G1827-A1837 WeakPolarHBondContact O-CB 3.35Å; G1827-A1837 PolarHBondContact O-N 3.12Å; S1829-A1837 VanDerWaalsContact CB-CA 3.44Å; S1829-A1837 VanDerWaalsContact OG-CA 3.27Å; S1829-A1837 WeakPolarHBondContact OG-CA 3.11Å; S1829-A1837 PolarHBondContact OG-N 2.82Å; A1837-G1839 PolarHBondContact O-N 3.47Å; A1837-G1839 VanDerWaalsContact O-N 3.13Å; A1837-Y1840 HydrophobicContact CB-CD2 3.61Å; A1837-Y1840 HydrophobicContact CB-CE2 4.3Å; A1837-Y1840 HydrophobicContact CB-CG 4.32Å; A1837-Y1840 PolarHBondContact O-N 2.88Å
1838	E	74.8	Confident	81	Confident	149 Å²	149	52 Å²	52	70%	0.696	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	120.3	164.8	-71.4	-176.8	174	0	0	108.2	I1862	E1838-I1862 HydrophobicContact CB-CD1 4.2Å; E1838-I1862 HydrophobicContact CB-CG1 4.12Å; E1838-I1862 HydrophobicContact CB-CG2 3.91Å; E1838-I1862 HydrophobicContact CG-CG2 4.15Å
1839	G	74.5	Confident	80.9	Confident	4 Å²	4	56.6 Å²	56.6	4%	0.041	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.2	17.4	-169.6	0	0	0	0	0	115.6	A1837 K1850 C1851 T1861	A1837-G1839 PolarHBondContact O-N 3.47Å; A1837-G1839 VanDerWaalsContact O-N 3.13Å; G1839-K1850 WeakPolarHBondContact O-CG 3.44Å; G1839-C1851 VanDerWaalsContact C-CB 3.44Å; G1839-C1851 WeakPolarHBondContact CA-SG 3.43Å; G1839-C1851 WeakPolarHBondContact O-CB 3.49Å; G1839-C1851 PolarHBondContact O-N 3.49Å; G1839-T1861 WeakPolarHBondContact CA-O 3.28Å
1840	Y	83.8	Confident	80.8	Confident	66 Å²	66	61.6 Å²	61.6	26%	0.259	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	157.5	165.7	-63.3	-104.6	0	0	0	112.2	G1827 C1836 A1837 Q1849 K1850 C1851	G1827-Y1840 VanDerWaalsContact CA-CE1 3.5Å; G1827-Y1840 WeakPolarHBondContact O-CB 3.48Å; C1836-Y1840 VanDerWaalsContact CB-C 3.49Å; C1836-Y1840 WeakPolarHBondContact CB-O 2.94Å; A1837-Y1840 HydrophobicContact CB-CD2 3.61Å; A1837-Y1840 HydrophobicContact CB-CE2 4.3Å; A1837-Y1840 HydrophobicContact CB-CG 4.32Å; A1837-Y1840 PolarHBondContact O-N 2.88Å; Y1840-Q1849 CarbonylContact C-O 3.6Å; Y1840-Q1849 WeakPolarHBondContact CA-O 3.29Å; Y1840-Q1849 WeakPolarHBondContact CB-O 3.39Å; Y1840-K1850 HydrophobicContact CD1-CB 3.84Å; Y1840-K1850 HydrophobicContact CD1-CG 4.08Å; Y1840-K1850 HydrophobicContact CE1-CB 3.71Å; Y1840-K1850 HydrophobicContact CE1-CG 3.76Å; Y1840-K1850 HydrophobicContact CE2-CG 4.4Å; Y1840-C1851 VanDerWaalsContact C-SG 3.56Å; Y1840-C1851 VanDerWaalsContact CA-SG 3.53Å; Y1840-C1851 PolarHBondContact N-SG 2.9Å
1841	W	83.8	Confident	80.9	Confident	83 Å²	83	61.7 Å²	61.7	31%	0.314	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	177.5	-178.4	72.8	-69.2	0	0	0	111.4	C1836 C1848 Q1849 T1865	C1836-W1841 VanDerWaalsContact SG-CA 3.55Å; W1841-C1848 CarbonylContact O-C 3.54Å; W1841-C1848 WeakPolarHBondContact O-CA 3.22Å; W1841-C1848 VanDerWaalsContact O-CB 3.24Å; W1841-C1848 WeakPolarHBondContact O-CB 3.33Å; W1841-Q1849 VanDerWaalsContact CD1-O 3.25Å; W1841-Q1849 PolarHBondContact N-O 3.29Å; W1841-Q1849 PolarHBondContact O-N 3.45Å; W1841-T1865 WeakPolarHBondContact CA-O 3.46Å
1842	N	81.7	Confident	80.9	Confident	71 Å²	71	64 Å²	64	38%	0.38	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	61.9	72.1	178	-165.3	9.5	0	0	0	113.9	Q1849	N1842-Q1849 HydrophobicContact CB-CB 4.43Å; N1842-Q1849 HydrophobicContact CB-CG 4.4Å; N1842-Q1849 VanDerWaalsContact ND2-CD 3.34Å; N1842-Q1849 PolarHBondContact ND2-OE1 3.04Å
1843	Y	82.1	Confident	80.5	Confident	80 Å²	80	61.4 Å²	61.4	31%	0.314	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	128.7	-175.6	-174.5	-91.4	0	0	0	114.2	A1807 A1808 A1809 C1833	A1807-Y1843 VanDerWaalsContact CB-OH 3.31Å; A1807-Y1843 WeakPolarHBondContact CB-OH 3.25Å; A1808-Y1843 HydrophobicContact CB-CE1 4.31Å; A1808-Y1843 PolarHBondContact N-OH 3.26Å; A1809-Y1843 HydrophobicContact CB-CD2 4.14Å; A1809-Y1843 HydrophobicContact CB-CE1 4.3Å; A1809-Y1843 HydrophobicContact CB-CE2 3.37Å; A1809-Y1843 VanDerWaalsContact CB-CZ 3.46Å; A1809-Y1843 WeakPolarHBondContact CB-OH 3.4Å; A1809-Y1843 PolarHBondContact N-OH 2.9Å; A1809-Y1843 VanDerWaalsContact N-OH 3.09Å; C1833-Y1843 WeakPolarHBondContact O-CE2 3.45Å; C1833-Y1843 VanDerWaalsContact O-CZ 3.28Å; C1833-Y1843 PolarHBondContact O-OH 2.04Å
1844	S	80.5	Confident	79.8	Confident	38 Å²	38	65.7 Å²	65.7	27%	0.266	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	167.2	-176.7	74.7	0	0	0	0	113.2	A1809 S1846 G1847	A1809-S1844 WeakPolarHBondContact CB-O 2.95Å; S1844-S1846 PolarHBondContact O-N 3.26Å; S1844-S1846 VanDerWaalsContact O-N 3.07Å; S1844-S1846 PolarHBondContact OG-N 2.75Å; S1844-S1846 PolarHBondContact OG-OG 2.57Å; S1844-G1847 PolarHBondContact N-O 2.87Å; S1844-G1847 PolarHBondContact O-N 2.98Å; S1844-G1847 PolarHBondContact OG-N 2.95Å; S1844-G1847 PolarHBondContact OG-O 2.84Å
1845	V	80.3	Confident	79.1	Confident	110 Å²	110	65.9 Å²	65.9	67%	0.667	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-18.6	169.3	-69.8	0	0	0	0	113.9	A1808	A1808-V1845 HydrophobicContact CB-CG1 4.08Å; A1808-V1845 WeakPolarHBondContact O-CA 3.23Å
1846	S	81.7	Confident	78.3	Confident	90 Å²	90	64.1 Å²	64.1	63%	0.629	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	11.6	177	34.9	0	0	0	0	113.5	S1844	S1844-S1846 PolarHBondContact O-N 3.26Å; S1844-S1846 VanDerWaalsContact O-N 3.07Å; S1844-S1846 PolarHBondContact OG-N 2.75Å; S1844-S1846 PolarHBondContact OG-OG 2.57Å
1847	G	80.5	Confident	77.8	Confident	1 Å²	1	64.7 Å²	64.7	1%	0.01	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	93.9	-149.7	-173.6	0	0	0	0	0	112.6	S1826 S1844	S1826-G1847 WeakPolarHBondContact O-CA 3.44Å; S1844-G1847 PolarHBondContact N-O 2.87Å; S1844-G1847 PolarHBondContact O-N 2.98Å; S1844-G1847 PolarHBondContact OG-N 2.95Å; S1844-G1847 PolarHBondContact OG-O 2.84Å
1848	C	83.7	Confident	77.5	Confident	12 Å²	12	63.9 Å²	63.9	8%	0.081	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	153.3	177.3	-65.3	0	0	0	0	111	S1826 G1827 C1836 W1841	S1826-C1848 PolarHBondContact O-N 3.12Å; S1826-C1848 VanDerWaalsContact O-O 3.09Å; G1827-C1848 VanDerWaalsContact O-CB 3.28Å; G1827-C1848 WeakPolarHBondContact O-CB 3.05Å; C1836-C1848 WeakPolarHBondContact CA-SG 3.1Å; C1836-C1848 HydrophobicContact CB-CB 3.66Å; C1836-C1848 WeakPolarHBondContact CB-SG 3.35Å; C1836-C1848 WeakPolarHBondContact SG-CB 3.45Å; C1836-C1848 CovalentContact SG-SG 2.04Å; C1836-C1848 PolarHBondContact SG-SG 2.63Å; W1841-C1848 CarbonylContact O-C 3.54Å; W1841-C1848 WeakPolarHBondContact O-CA 3.22Å; W1841-C1848 VanDerWaalsContact O-CB 3.24Å; W1841-C1848 WeakPolarHBondContact O-CB 3.33Å
1849	Q	81.3	Confident	77.2	Confident	105 Å²	105	62.8 Å²	62.8	49%	0.491	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	140.2	175.2	-63.5	177.8	-19.8	0	0	109.4	Y1840 W1841 N1842 C1851	Y1840-Q1849 CarbonylContact C-O 3.6Å; Y1840-Q1849 WeakPolarHBondContact CA-O 3.29Å; Y1840-Q1849 WeakPolarHBondContact CB-O 3.39Å; W1841-Q1849 VanDerWaalsContact CD1-O 3.25Å; W1841-Q1849 PolarHBondContact N-O 3.29Å; W1841-Q1849 PolarHBondContact O-N 3.45Å; N1842-Q1849 HydrophobicContact CB-CB 4.43Å; N1842-Q1849 HydrophobicContact CB-CG 4.4Å; N1842-Q1849 VanDerWaalsContact ND2-CD 3.34Å; N1842-Q1849 PolarHBondContact ND2-OE1 3.04Å; Q1849-C1851 PolarHBondContact O-N 3.2Å
1850	K	77.3	Confident	76.8	Confident	136 Å²	136	63.8 Å²	63.8	59%	0.591	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.1	138	-177.7	-160.7	-171.8	172.7	-167.3	0	110.8	G1839 Y1840	G1839-K1850 WeakPolarHBondContact O-CG 3.44Å; Y1840-K1850 HydrophobicContact CD1-CB 3.84Å; Y1840-K1850 HydrophobicContact CD1-CG 4.08Å; Y1840-K1850 HydrophobicContact CE1-CB 3.71Å; Y1840-K1850 HydrophobicContact CE1-CG 3.76Å; Y1840-K1850 HydrophobicContact CE2-CG 4.4Å
1851	C	75.7	Confident	76.1	Confident	5 Å²	5	64.3 Å²	64.3	3%	0.034	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-63.6	134.8	165	-63.2	0	0	0	0	108.6	G1839 Y1840 Q1849 C1853 C1863	G1839-C1851 VanDerWaalsContact C-CB 3.44Å; G1839-C1851 WeakPolarHBondContact CA-SG 3.43Å; G1839-C1851 WeakPolarHBondContact O-CB 3.49Å; G1839-C1851 PolarHBondContact O-N 3.49Å; Y1840-C1851 VanDerWaalsContact C-SG 3.56Å; Y1840-C1851 VanDerWaalsContact CA-SG 3.53Å; Y1840-C1851 PolarHBondContact N-SG 2.9Å; Q1849-C1851 PolarHBondContact O-N 3.2Å; C1851-C1853 VanDerWaalsContact C-N 3.33Å; C1851-C1853 PolarHBondContact O-N 2.86Å; C1851-C1863 HydrophobicContact CB-CB 3.64Å; C1851-C1863 WeakPolarHBondContact CB-SG 3.37Å; C1851-C1863 VanDerWaalsContact SG-CA 3.56Å; C1851-C1863 WeakPolarHBondContact SG-CB 3.41Å; C1851-C1863 PolarHBondContact SG-N 3.23Å; C1851-C1863 CovalentContact SG-SG 2.01Å; C1851-C1863 PolarHBondContact SG-SG 2.82Å
1852	D	75.8	Confident	75.6	Confident	107 Å²	107	63.1 Å²	63.1	57%	0.572	35%	0.347	S	S	*	.			trans	-101.4	37.6	-173.5	-167.5	46	0	0	0	110.5	R1880	D1852-R1880 HydrophobicContact CB-CG 4.12Å; D1852-R1880 VanDerWaalsContact O-CB 3.28Å; D1852-R1880 WeakPolarHBondContact O-CB 3.44Å; D1852-R1880 WeakPolarHBondContact O-CD 3.5Å; D1852-R1880 WeakPolarHBondContact O-CG 3.24Å; D1852-R1880 WeakPolarHBondContact OD2-CD 3.28Å; D1852-R1880 IonicContact OD2-CZ 2.91Å; D1852-R1880 IonicContact OD2-NE 3.08Å; D1852-R1880 IonicContact OD2-NH1 3.53Å; D1852-R1880 PolarHBondContact OD2-NH1 3.08Å
1853	C	75.7	Confident	75.4	Confident	16 Å²	16	60 Å²	60	11%	0.108	33%	0.331	C	S	.	.			trans	-69.9	139.3	-171.8	-53.4	0	0	0	0	113	C1851 S1855 A1858 I1862 C1870	C1851-C1853 VanDerWaalsContact C-N 3.33Å; C1851-C1853 PolarHBondContact O-N 2.86Å; C1853-S1855 PolarHBondContact O-N 3.09Å; C1853-A1858 HydrophobicContact CB-CB 3.88Å; C1853-I1862 PolarHBondContact SG-O 3.07Å; C1853-I1862 VanDerWaalsContact SG-O 3.4Å; C1853-C1870 WeakPolarHBondContact CA-SG 3.22Å; C1853-C1870 HydrophobicContact CB-CB 3.85Å; C1853-C1870 WeakPolarHBondContact CB-SG 3.46Å; C1853-C1870 WeakPolarHBondContact SG-CB 3.46Å; C1853-C1870 CovalentContact SG-SG 2.03Å; C1853-C1870 PolarHBondContact SG-SG 3.32Å
1854	E	71.7	Confident	75.1	Confident	89 Å²	89	59.9 Å²	59.9	42%	0.416	34%	0.336	S	S	.	.			trans	-71.4	116.9	175.8	-173.5	55.6	-87.6	0	0	110.8	D1856 L1857 A1858 R1880	E1854-D1856 PolarHBondContact O-N 2.89Å; E1854-L1857 HydrophobicContact CB-CB 4.42Å; E1854-L1857 HydrophobicContact CG-CB 4.17Å; E1854-L1857 HydrophobicContact CG-CD1 4.14Å; E1854-L1857 HydrophobicContact CG-CG 4.18Å; E1854-L1857 PolarHBondContact O-N 3.27Å; E1854-A1858 VanDerWaalsContact O-CB 3.27Å; E1854-A1858 WeakPolarHBondContact O-CB 3.42Å; E1854-A1858 PolarHBondContact O-N 3.38Å; E1854-R1880 WeakPolarHBondContact CB-O 3.3Å; E1854-R1880 PolarHBondContact N-O 3.14Å
1855	S	69.9	Low	74.7	Confident	74 Å²	74	60.6 Å²	60.6	52%	0.517	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-21.4	-166.6	57.7	0	0	0	0	114.5	C1853	C1853-S1855 PolarHBondContact O-N 3.09Å
1856	D	68.8	Low	74.3	Confident	89 Å²	89	59.2 Å²	59.2	48%	0.476	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-10.4	-176	-72.7	24	0	0	0	112.4	E1854 M1873	E1854-D1856 PolarHBondContact O-N 2.89Å; D1856-M1873 WeakPolarHBondContact O-CE 3.49Å
1857	L	71.9	Confident	74.2	Confident	15 Å²	15	59 Å²	59	8%	0.079	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-134.3	-19.6	-170.4	-59.5	-179.9	0	0	0	114.6	E1854 M1873 A1876 C1881 V1890	E1854-L1857 HydrophobicContact CB-CB 4.42Å; E1854-L1857 HydrophobicContact CG-CB 4.17Å; E1854-L1857 HydrophobicContact CG-CD1 4.14Å; E1854-L1857 HydrophobicContact CG-CG 4.18Å; E1854-L1857 PolarHBondContact O-N 3.27Å; L1857-M1873 WeakPolarHBondContact O-CG 3.49Å; L1857-M1873 PolarHBondContact O-N 3.19Å; L1857-A1876 HydrophobicContact CB-CB 4.38Å; L1857-A1876 WeakPolarHBondContact O-CB 3.4Å; L1857-C1881 WeakPolarHBondContact CB-O 3.32Å; L1857-V1890 HydrophobicContact CD1-CG2 4.23Å; L1857-V1890 HydrophobicContact CD2-CB 4.4Å; L1857-V1890 HydrophobicContact CD2-CG1 3.9Å; L1857-V1890 HydrophobicContact CD2-CG2 3.67Å
1858	A	71.4	Confident	73.9	Confident	1 Å²	1	59.4 Å²	59.4	1%	0.008	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	148.2	162.9	0	0	0	0	0	110.3	C1853 E1854 G1860 C1870 Q1871 M1873 C1881	C1853-A1858 HydrophobicContact CB-CB 3.88Å; E1854-A1858 VanDerWaalsContact O-CB 3.27Å; E1854-A1858 WeakPolarHBondContact O-CB 3.42Å; E1854-A1858 PolarHBondContact O-N 3.38Å; A1858-G1860 WeakPolarHBondContact CB-O 3.4Å; A1858-G1860 PolarHBondContact O-N 3.07Å; A1858-C1870 HydrophobicContact CB-CB 4.43Å; A1858-Q1871 CarbonylContact C-O 3.5Å; A1858-Q1871 WeakPolarHBondContact CA-O 3.34Å; A1858-Q1871 WeakPolarHBondContact CB-O 3.16Å; A1858-M1873 WeakPolarHBondContact O-CE 3.41Å; A1858-C1881 HydrophobicContact CB-CB 3.89Å
1859	M	69.3	Low	73.7	Confident	126 Å²	126	63.2 Å²	63.2	62%	0.621	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.9	-9.7	174.5	-69.7	-169.7	172.8	0	0	113.3	Q1871 C1872 M1873	M1859-Q1871 PolarHBondContact N-O 2.85Å; M1859-C1872 WeakPolarHBondContact CE-O 3.48Å; M1859-M1873 HydrophobicContact CG-CG 4.19Å
1860	G	66.1	Low	73.6	Confident	26 Å²	26	58.5 Å²	58.5	27%	0.268	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.8	-176.2	168	0	0	0	0	0	108.4	A1858 I1862	A1858-G1860 WeakPolarHBondContact CB-O 3.4Å; A1858-G1860 PolarHBondContact O-N 3.07Å; G1860-I1862 PolarHBondContact O-N 3.37Å
1861	T	69.6	Low	73.6	Confident	77 Å²	77	58.2 Å²	58.2	47%	0.472	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	29.7	174.4	54.2	0	0	0	0	113.2	G1839	G1839-T1861 WeakPolarHBondContact CA-O 3.28Å
1862	I	72.1	Confident	73.7	Confident	58 Å²	58	59.4 Å²	59.4	30%	0.297	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	128.7	-163.2	-53.9	176.8	0	0	0	110.1	E1838 C1853 G1860 C1870 Q1871	E1838-I1862 HydrophobicContact CB-CD1 4.2Å; E1838-I1862 HydrophobicContact CB-CG1 4.12Å; E1838-I1862 HydrophobicContact CB-CG2 3.91Å; E1838-I1862 HydrophobicContact CG-CG2 4.15Å; C1853-I1862 PolarHBondContact SG-O 3.07Å; C1853-I1862 VanDerWaalsContact SG-O 3.4Å; G1860-I1862 PolarHBondContact O-N 3.37Å; I1862-C1870 WeakPolarHBondContact O-CA 3.47Å; I1862-Q1871 PolarHBondContact O-N 2.03Å
1863	C	78.3	Confident	73.5	Confident	6 Å²	6	57 Å²	57	4%	0.041	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	159.2	172.4	81.4	0	0	0	0	113.1	C1851 T1865 G1868 Q1869 C1870	C1851-C1863 HydrophobicContact CB-CB 3.64Å; C1851-C1863 WeakPolarHBondContact CB-SG 3.37Å; C1851-C1863 VanDerWaalsContact SG-CA 3.56Å; C1851-C1863 WeakPolarHBondContact SG-CB 3.41Å; C1851-C1863 PolarHBondContact SG-N 3.23Å; C1851-C1863 CovalentContact SG-SG 2.01Å; C1851-C1863 PolarHBondContact SG-SG 2.82Å; C1863-T1865 PolarHBondContact O-N 3.26Å; C1863-G1868 WeakPolarHBondContact CB-O 3.38Å; C1863-G1868 VanDerWaalsContact SG-C 3.5Å; C1863-G1868 VanDerWaalsContact SG-CA 3.52Å; C1863-G1868 PolarHBondContact SG-O 2.77Å; C1863-Q1869 CarbonylContact C-O 3.57Å; C1863-Q1869 WeakPolarHBondContact CA-O 3.07Å; C1863-C1870 HydrophobicContact CB-CB 4.21Å; C1863-C1870 VanDerWaalsContact CB-SG 3.54Å
1864	D	74.9	Confident	73.2	Confident	77 Å²	77	62 Å²	62	41%	0.412	35%	0.35	S	S	.	.			trans	-53.4	117	171.3	176.9	-84.8	0	0	0	109.8	A1866 T1867 G1868 Q1869	D1864-A1866 PolarHBondContact O-N 2.81Å; D1864-A1866 VanDerWaalsContact O-N 3.09Å; D1864-A1866 PolarHBondContact OD1-N 2.75Å; D1864-A1866 VanDerWaalsContact OD1-N 3.17Å; D1864-T1867 WeakPolarHBondContact CB-OG1 3.47Å; D1864-T1867 PolarHBondContact O-N 3.24Å; D1864-T1867 WeakPolarHBondContact OD1-CB 3.11Å; D1864-T1867 WeakPolarHBondContact OD1-CG2 3.46Å; D1864-T1867 PolarHBondContact OD1-N 3Å; D1864-T1867 PolarHBondContact OD1-OG1 2.99Å; D1864-G1868 PolarHBondContact O-N 2.8Å; D1864-Q1869 HydrophobicContact CB-CB 4.19Å; D1864-Q1869 WeakPolarHBondContact CB-O 3.15Å; D1864-Q1869 PolarHBondContact N-O 3.21Å
1865	T	72.8	Confident	73.3	Confident	52 Å²	52	57.8 Å²	57.8	32%	0.319	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-12	-167.9	53.8	0	0	0	0	113.8	C1836 W1841 C1863	C1836-T1865 HydrophobicContact CB-CG2 4.03Å; W1841-T1865 WeakPolarHBondContact CA-O 3.46Å; C1863-T1865 PolarHBondContact O-N 3.26Å
1866	A	72.7	Confident	73.6	Confident	82 Å²	82	54.8 Å²	54.8	68%	0.678	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	-36.8	177.4	0	0	0	0	0	113.1	D1864	D1864-A1866 PolarHBondContact O-N 2.81Å; D1864-A1866 VanDerWaalsContact O-N 3.09Å; D1864-A1866 PolarHBondContact OD1-N 2.75Å; D1864-A1866 VanDerWaalsContact OD1-N 3.17Å
1867	T	78.3	Confident	74.1	Confident	86 Å²	86	53.6 Å²	53.6	53%	0.528	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.9	-19.6	-170.5	61.3	0	0	0	0	114.8	D1864 Q1869	D1864-T1867 WeakPolarHBondContact CB-OG1 3.47Å; D1864-T1867 PolarHBondContact O-N 3.24Å; D1864-T1867 WeakPolarHBondContact OD1-CB 3.11Å; D1864-T1867 WeakPolarHBondContact OD1-CG2 3.46Å; D1864-T1867 PolarHBondContact OD1-N 3Å; D1864-T1867 PolarHBondContact OD1-OG1 2.99Å; T1867-Q1869 PolarHBondContact OG1-N 2.78Å
1868	G	74.8	Confident	74.1	Confident	9 Å²	9	53.6 Å²	53.6	9%	0.093	31%	0.309	C	S	.	.			trans	88.1	3.3	-174.2	0	0	0	0	0	115	C1863 D1864	C1863-G1868 WeakPolarHBondContact CB-O 3.38Å; C1863-G1868 VanDerWaalsContact SG-C 3.5Å; C1863-G1868 VanDerWaalsContact SG-CA 3.52Å; C1863-G1868 PolarHBondContact SG-O 2.77Å; D1864-G1868 PolarHBondContact O-N 2.8Å
1869	Q	78.7	Confident	74.2	Confident	91 Å²	91	57.1 Å²	57.1	43%	0.425	33%	0.331	S	S	.	.			trans	-83.2	112.5	-171.8	-171.8	96.9	34.6	0	0	113	C1863 D1864 T1867 G1878	C1863-Q1869 CarbonylContact C-O 3.57Å; C1863-Q1869 WeakPolarHBondContact CA-O 3.07Å; D1864-Q1869 HydrophobicContact CB-CB 4.19Å; D1864-Q1869 WeakPolarHBondContact CB-O 3.15Å; D1864-Q1869 PolarHBondContact N-O 3.21Å; T1867-Q1869 PolarHBondContact OG1-N 2.78Å; Q1869-G1878 PolarHBondContact NE2-O 3.11Å
1870	C	79.4	Confident	74.4	Confident	7 Å²	7	56.1 Å²	56.1	5%	0.047	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	150.3	179.7	-60.4	0	0	0	0	113.3	C1853 A1858 I1862 C1863 V1879 R1880 C1881	C1853-C1870 WeakPolarHBondContact CA-SG 3.22Å; C1853-C1870 HydrophobicContact CB-CB 3.85Å; C1853-C1870 WeakPolarHBondContact CB-SG 3.46Å; C1853-C1870 WeakPolarHBondContact SG-CB 3.46Å; C1853-C1870 CovalentContact SG-SG 2.03Å; C1853-C1870 PolarHBondContact SG-SG 3.32Å; A1858-C1870 HydrophobicContact CB-CB 4.43Å; I1862-C1870 WeakPolarHBondContact O-CA 3.47Å; C1863-C1870 HydrophobicContact CB-CB 4.21Å; C1863-C1870 VanDerWaalsContact CB-SG 3.54Å; C1870-V1879 WeakPolarHBondContact CB-O 3.05Å; C1870-V1879 PolarHBondContact N-O 2.78Å; C1870-V1879 PolarHBondContact SG-O 3.41Å; C1870-V1879 VanDerWaalsContact SG-O 3.38Å; C1870-R1880 VanDerWaalsContact SG-CA 3.58Å; C1870-C1881 HydrophobicContact CB-CB 4.45Å; C1870-C1881 WeakPolarHBondContact CB-SG 3.34Å; C1870-C1881 PolarHBondContact O-SG 3.17Å
1871	Q	78.6	Confident	74.8	Confident	130 Å²	130	54.9 Å²	54.9	61%	0.607	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.6	124.8	169.5	-79.9	-170.8	-19.6	0	0	110.4	A1858 M1859 I1862 C1881	A1858-Q1871 CarbonylContact C-O 3.5Å; A1858-Q1871 WeakPolarHBondContact CA-O 3.34Å; A1858-Q1871 WeakPolarHBondContact CB-O 3.16Å; M1859-Q1871 PolarHBondContact N-O 2.85Å; I1862-Q1871 PolarHBondContact O-N 2.03Å; Q1871-C1881 PolarHBondContact O-SG 3.06Å
1872	C	76.1	Confident	74.9	Confident	29 Å²	29	54.3 Å²	54.3	20%	0.196	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	143.7	-170.3	-46.9	0	0	0	0	111.4	M1859 A1876 C1881	M1859-C1872 WeakPolarHBondContact CE-O 3.48Å; C1872-A1876 VanDerWaalsContact CB-C 3.46Å; C1872-A1876 HydrophobicContact CB-CB 3.84Å; C1872-A1876 WeakPolarHBondContact CB-O 3.03Å; C1872-C1881 WeakPolarHBondContact CA-SG 3.44Å; C1872-C1881 HydrophobicContact CB-CB 3.59Å; C1872-C1881 WeakPolarHBondContact CB-SG 3.26Å; C1872-C1881 PolarHBondContact N-SG 2.8Å; C1872-C1881 WeakPolarHBondContact SG-CA 3.39Å; C1872-C1881 WeakPolarHBondContact SG-CB 3.32Å; C1872-C1881 CovalentContact SG-SG 2.04Å; C1872-C1881 PolarHBondContact SG-SG 2.91Å
1873	M	72.3	Confident	74.9	Confident	56 Å²	56	55.5 Å²	55.5	28%	0.276	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-57.3	163.8	174.1	-65.6	-167.5	-163.3	0	0	111.1	D1856 L1857 A1858 M1859 G1875 A1876	D1856-M1873 WeakPolarHBondContact O-CE 3.49Å; L1857-M1873 WeakPolarHBondContact O-CG 3.49Å; L1857-M1873 PolarHBondContact O-N 3.19Å; A1858-M1873 WeakPolarHBondContact O-CE 3.41Å; M1859-M1873 HydrophobicContact CG-CG 4.19Å; M1873-G1875 PolarHBondContact O-N 3.31Å; M1873-A1876 HydrophobicContact CB-CB 4.33Å; M1873-A1876 WeakPolarHBondContact O-CB 3.39Å; M1873-A1876 PolarHBondContact O-N 2.82Å
1874	E	70.3	Confident	74.6	Confident	122 Å²	122	56.9 Å²	56.9	57%	0.57	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	136.7	169.1	-170.2	176.8	170.8	0	0	109.5	A1876 Y1888	E1874-A1876 VanDerWaalsContact C-N 3.3Å; E1874-A1876 PolarHBondContact O-N 2.78Å; E1874-Y1888 HydrophobicContact CG-CE1 4.48Å
1875	G	72.6	Confident	74.3	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.01	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.5	9.1	-171.7	0	0	0	0	0	114.8	M1873 C1884 L1885 C1896	M1873-G1875 PolarHBondContact O-N 3.31Å; G1875-C1884 CarbonylContact O-C 3.29Å; G1875-C1884 WeakPolarHBondContact O-CA 3.28Å; G1875-C1884 VanDerWaalsContact O-CB 3.24Å; G1875-C1884 WeakPolarHBondContact O-CB 3.49Å; G1875-L1885 PolarHBondContact O-N 2.92Å; G1875-C1896 VanDerWaalsContact C-CB 3.5Å; G1875-C1896 WeakPolarHBondContact O-CB 3.45Å; G1875-C1896 PolarHBondContact O-SG 2.74Å
1876	A	76.2	Confident	73.8	Confident	10 Å²	10	60.2 Å²	60.2	8%	0.083	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	159.5	179.1	0	0	0	0	0	114.8	L1857 C1872 M1873 E1874 N1883	L1857-A1876 HydrophobicContact CB-CB 4.38Å; L1857-A1876 WeakPolarHBondContact O-CB 3.4Å; C1872-A1876 VanDerWaalsContact CB-C 3.46Å; C1872-A1876 HydrophobicContact CB-CB 3.84Å; C1872-A1876 WeakPolarHBondContact CB-O 3.03Å; M1873-A1876 HydrophobicContact CB-CB 4.33Å; M1873-A1876 WeakPolarHBondContact O-CB 3.39Å; M1873-A1876 PolarHBondContact O-N 2.82Å; E1874-A1876 VanDerWaalsContact C-N 3.3Å; E1874-A1876 PolarHBondContact O-N 2.78Å; A1876-N1883 CarbonylContact C-O 3.57Å; A1876-N1883 VanDerWaalsContact CA-O 3.25Å; A1876-N1883 WeakPolarHBondContact CA-O 3.32Å
1877	T	80.5	Confident	73.4	Confident	64 Å²	64	58.9 Å²	58.9	39%	0.393	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	157.1	-177.1	-170.8	0	0	0	0	113.2	C1881 E1882 N1883 L1885	T1877-C1881 CarbonylContact O-C 3.5Å; T1877-E1882 PolarHBondContact O-N 2.99Å; T1877-N1883 HydrophobicContact CG2-CB 4.01Å; T1877-N1883 PolarHBondContact N-O 3.29Å; T1877-N1883 WeakPolarHBondContact O-CB 3.35Å; T1877-N1883 PolarHBondContact O-N 2.89Å; T1877-N1883 VanDerWaalsContact O-N 3.08Å; T1877-N1883 PolarHBondContact O-ND2 3.31Å; T1877-L1885 HydrophobicContact CG2-CD2 4.11Å
1878	G	71.2	Confident	72.9	Confident	15 Å²	15	58.4 Å²	58.4	16%	0.155	32%	0.321	C	S	.	.	S	Bend	trans	140.8	176.2	177.5	0	0	0	0	0	112.9	Q1869 R1880 E1882	Q1869-G1878 PolarHBondContact NE2-O 3.11Å; G1878-R1880 VanDerWaalsContact C-N 3.34Å; G1878-E1882 WeakPolarHBondContact CA-OE2 3.15Å
1879	V	72.5	Confident	72.1	Confident	76 Å²	76	61.8 Å²	61.8	46%	0.461	34%	0.336	S	S	.	.	S	Bend	trans	-79	-26.3	171	-168	0	0	0	0	110.1	C1870 E1882	C1870-V1879 WeakPolarHBondContact CB-O 3.05Å; C1870-V1879 PolarHBondContact N-O 2.78Å; C1870-V1879 PolarHBondContact SG-O 3.41Å; C1870-V1879 VanDerWaalsContact SG-O 3.38Å; V1879-E1882 PolarHBondContact N-OE2 3.13Å
1880	R	73.7	Confident	71.2	Confident	105 Å²	105	60.9 Å²	60.9	40%	0.396	34%	0.336	S	S	.	.	S	Bend	trans	-113	7.9	171.3	-63.5	170.3	-63.6	170.4	7.5	112.8	D1852 E1854 C1870 G1878 E1882	D1852-R1880 HydrophobicContact CB-CG 4.12Å; D1852-R1880 VanDerWaalsContact O-CB 3.28Å; D1852-R1880 WeakPolarHBondContact O-CB 3.44Å; D1852-R1880 WeakPolarHBondContact O-CD 3.5Å; D1852-R1880 WeakPolarHBondContact O-CG 3.24Å; D1852-R1880 WeakPolarHBondContact OD2-CD 3.28Å; D1852-R1880 IonicContact OD2-CZ 2.91Å; D1852-R1880 IonicContact OD2-NE 3.08Å; D1852-R1880 IonicContact OD2-NH1 3.53Å; D1852-R1880 PolarHBondContact OD2-NH1 3.08Å; E1854-R1880 WeakPolarHBondContact CB-O 3.3Å; E1854-R1880 PolarHBondContact N-O 3.14Å; C1870-R1880 VanDerWaalsContact SG-CA 3.58Å; G1878-R1880 VanDerWaalsContact C-N 3.34Å; R1880-E1882 VanDerWaalsContact C-N 3.27Å; R1880-E1882 WeakPolarHBondContact CA-OE2 3.36Å; R1880-E1882 IonicContact CZ-OE1 3.44Å; R1880-E1882 PolarHBondContact N-OE2 3.19Å; R1880-E1882 IonicContact NE-OE1 2.84Å; R1880-E1882 PolarHBondContact NE-OE1 3.48Å; R1880-E1882 IonicContact NH2-OE1 3.83Å; R1880-E1882 PolarHBondContact NH2-OE1 3.03Å
1881	C	74.6	Confident	70.3	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	35%	0.35	C	S	.	.			trans	62	30.9	-171.4	-56.3	0	0	0	0	114.2	L1857 A1858 C1870 Q1871 C1872 T1877 N1883	L1857-C1881 WeakPolarHBondContact CB-O 3.32Å; A1858-C1881 HydrophobicContact CB-CB 3.89Å; C1870-C1881 HydrophobicContact CB-CB 4.45Å; C1870-C1881 WeakPolarHBondContact CB-SG 3.34Å; C1870-C1881 PolarHBondContact O-SG 3.17Å; Q1871-C1881 PolarHBondContact O-SG 3.06Å; C1872-C1881 WeakPolarHBondContact CA-SG 3.44Å; C1872-C1881 HydrophobicContact CB-CB 3.59Å; C1872-C1881 WeakPolarHBondContact CB-SG 3.26Å; C1872-C1881 PolarHBondContact N-SG 2.8Å; C1872-C1881 WeakPolarHBondContact SG-CA 3.39Å; C1872-C1881 WeakPolarHBondContact SG-CB 3.32Å; C1872-C1881 CovalentContact SG-SG 2.04Å; C1872-C1881 PolarHBondContact SG-SG 2.91Å; T1877-C1881 CarbonylContact O-C 3.5Å; C1881-N1883 PolarHBondContact O-N 2.8Å; C1881-N1883 VanDerWaalsContact O-N 3.11Å
1882	E	71.6	Confident	69	Low	65 Å²	65	60.6 Å²	60.6	30%	0.304	34%	0.341	S	S	.	.			trans	-76.5	9.3	-172.2	60.9	-92.4	-103	0	0	115.4	T1877 G1878 V1879 R1880	T1877-E1882 PolarHBondContact O-N 2.99Å; G1878-E1882 WeakPolarHBondContact CA-OE2 3.15Å; V1879-E1882 PolarHBondContact N-OE2 3.13Å; R1880-E1882 VanDerWaalsContact C-N 3.27Å; R1880-E1882 WeakPolarHBondContact CA-OE2 3.36Å; R1880-E1882 IonicContact CZ-OE1 3.44Å; R1880-E1882 PolarHBondContact N-OE2 3.19Å; R1880-E1882 IonicContact NE-OE1 2.84Å; R1880-E1882 PolarHBondContact NE-OE1 3.48Å; R1880-E1882 IonicContact NH2-OE1 3.83Å; R1880-E1882 PolarHBondContact NH2-OE1 3.03Å
1883	N	72.5	Confident	67.9	Low	82 Å²	82	68.3 Å²	68.3	44%	0.439	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	155.7	-175.2	-37.1	-96.3	0	0	0	112.2	A1876 T1877 C1881	A1876-N1883 CarbonylContact C-O 3.57Å; A1876-N1883 VanDerWaalsContact CA-O 3.25Å; A1876-N1883 WeakPolarHBondContact CA-O 3.32Å; T1877-N1883 HydrophobicContact CG2-CB 4.01Å; T1877-N1883 PolarHBondContact N-O 3.29Å; T1877-N1883 WeakPolarHBondContact O-CB 3.35Å; T1877-N1883 PolarHBondContact O-N 2.89Å; T1877-N1883 VanDerWaalsContact O-N 3.08Å; T1877-N1883 PolarHBondContact O-ND2 3.31Å; C1881-N1883 PolarHBondContact O-N 2.8Å; C1881-N1883 VanDerWaalsContact O-N 3.11Å
1884	C	71.7	Confident	67.6	Low	35 Å²	35	71.6 Å²	71.6	24%	0.236	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	157.5	162.5	-66.6	0	0	0	0	112.5	G1875 Y1888 V1890 C1896	G1875-C1884 CarbonylContact O-C 3.29Å; G1875-C1884 WeakPolarHBondContact O-CA 3.28Å; G1875-C1884 VanDerWaalsContact O-CB 3.24Å; G1875-C1884 WeakPolarHBondContact O-CB 3.49Å; C1884-Y1888 WeakPolarHBondContact CB-O 3.28Å; C1884-V1890 WeakPolarHBondContact SG-CG2 3.3Å; C1884-C1896 HydrophobicContact CB-CB 4.06Å; C1884-C1896 WeakPolarHBondContact CB-SG 3.31Å; C1884-C1896 WeakPolarHBondContact SG-CB 3.38Å; C1884-C1896 CovalentContact SG-SG 2.06Å; C1884-C1896 PolarHBondContact SG-SG 2.95Å
1885	L	69.2	Low	67.4	Low	72 Å²	72	66.2 Å²	66.2	38%	0.377	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-68.2	151.6	161.7	-66.5	177.9	0	0	0	110.3	G1875 T1877 G1887 Y1888	G1875-L1885 PolarHBondContact O-N 2.92Å; T1877-L1885 HydrophobicContact CG2-CD2 4.11Å; L1885-G1887 PolarHBondContact O-N 3.24Å; L1885-Y1888 HydrophobicContact CB-CD2 4.32Å; L1885-Y1888 PolarHBondContact O-N 2.95Å
1886	P	62.6	Low	67.4	Low	127 Å²	127	66.5 Å²	66.5	83%	0.825	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	130.9	178.6	-25.5	34.9	0	0	0	112.9
1887	G	64.1	Low	67.1	Low	54 Å²	54	70.3 Å²	70.3	56%	0.557	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.8	-13	-179.8	0	0	0	0	0	115.3	L1885	L1885-G1887 PolarHBondContact O-N 3.24Å
1888	Y	67.8	Low	66.4	Low	76 Å²	76	71.2 Å²	71.2	30%	0.298	39%	0.389	S	S	.	.			trans	-103.2	148.6	175.3	-64	-116	0	0	0	110.9	E1874 C1884 L1885 C1896 Q1897 V1898	E1874-Y1888 HydrophobicContact CG-CE1 4.48Å; C1884-Y1888 WeakPolarHBondContact CB-O 3.28Å; L1885-Y1888 HydrophobicContact CB-CD2 4.32Å; L1885-Y1888 PolarHBondContact O-N 2.95Å; Y1888-C1896 HydrophobicContact CD1-CB 4.47Å; Y1888-Q1897 CarbonylContact C-O 3.52Å; Y1888-Q1897 WeakPolarHBondContact CA-O 3.22Å; Y1888-V1898 HydrophobicContact CD1-CG2 3.9Å; Y1888-V1898 HydrophobicContact CD2-CG2 4.47Å; Y1888-V1898 HydrophobicContact CE1-CG2 3.93Å; Y1888-V1898 HydrophobicContact CE2-CG2 4.46Å; Y1888-V1898 HydrophobicContact CG-CG2 4.19Å
1889	M	57	Low	65.6	Low	81 Å²	81	71.8 Å²	71.8	40%	0.399	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	140	-179.7	-47.9	-164.3	-44.6	0	0	111.2	I1891 C1896 Q1897 C1899	M1889-I1891 PolarHBondContact O-N 2.93Å; M1889-C1896 CarbonylContact O-C 3.23Å; M1889-C1896 WeakPolarHBondContact O-CA 3.38Å; M1889-Q1897 PolarHBondContact N-O 2.95Å; M1889-Q1897 PolarHBondContact O-N 2.9Å; M1889-C1899 VanDerWaalsContact CE-SG 3.53Å
1890	V	61	Low	64.8	Low	72 Å²	72	72.5 Å²	72.5	44%	0.436	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	114.2	178	-171.6	0	0	0	0	110.8	L1857 C1884	L1857-V1890 HydrophobicContact CD1-CG2 4.23Å; L1857-V1890 HydrophobicContact CD2-CB 4.4Å; L1857-V1890 HydrophobicContact CD2-CG1 3.9Å; L1857-V1890 HydrophobicContact CD2-CG2 3.67Å; C1884-V1890 WeakPolarHBondContact SG-CG2 3.3Å
1891	I	59.3	Low	64.1	Low	63 Å²	63	75.9 Å²	75.9	32%	0.323	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	120	166.9	-61.1	-175.8	0	0	0	107.9	M1889 H1893 H1894 G1895 Q1897	M1889-I1891 PolarHBondContact O-N 2.93Å; I1891-H1893 PolarHBondContact O-N 2.75Å; I1891-H1894 HydrophobicContact CB-CB 3.95Å; I1891-H1894 HydrophobicContact CG2-CB 3.77Å; I1891-H1894 CarbonylContact O-C 3.38Å; I1891-H1894 WeakPolarHBondContact O-CA 3.17Å; I1891-H1894 PolarHBondContact O-N 3.41Å; I1891-G1895 PolarHBondContact N-O 2.73Å; I1891-G1895 PolarHBondContact O-N 3.05Å; I1891-G1895 VanDerWaalsContact O-N 3.15Å; I1891-Q1897 HydrophobicContact CB-CG 4.42Å; I1891-Q1897 HydrophobicContact CD1-CB 3.59Å; I1891-Q1897 HydrophobicContact CD1-CG 4.04Å; I1891-Q1897 HydrophobicContact CG1-CB 3.98Å; I1891-Q1897 HydrophobicContact CG1-CG 4.34Å
1892	P	51.8	Low	63	Low	67 Å²	67	81.2 Å²	81.2	44%	0.435	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53	135.4	178.9	-29	36.1	0	0	0	112.8	H1894	P1892-H1894 PolarHBondContact O-N 3.23Å; P1892-H1894 PolarHBondContact O-ND1 3.38Å
1893	H	54.3	Low	62.2	Low	191 Å²	191	78.8 Å²	78.8	88%	0.884	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.4	3	-170.4	-52.6	-56.5	0	0	0	116.9	I1891	I1891-H1893 PolarHBondContact O-N 2.75Å
1894	H	64.5	Low	61.5	Low	125 Å²	125	79 Å²	79	58%	0.579	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.3	-0.1	-175.3	-59.7	74.5	0	0	0	114.6	I1891 P1892 Q1897	I1891-H1894 HydrophobicContact CB-CB 3.95Å; I1891-H1894 HydrophobicContact CG2-CB 3.77Å; I1891-H1894 CarbonylContact O-C 3.38Å; I1891-H1894 WeakPolarHBondContact O-CA 3.17Å; I1891-H1894 PolarHBondContact O-N 3.41Å; P1892-H1894 PolarHBondContact O-N 3.23Å; P1892-H1894 PolarHBondContact O-ND1 3.38Å; H1894-Q1897 HydrophobicContact CB-CG 4.4Å; H1894-Q1897 WeakPolarHBondContact O-CG 3.33Å; H1894-Q1897 PolarHBondContact O-NE2 3.41Å
1895	G	67.6	Low	61	Low	10 Å²	10	79 Å²	79	10%	0.103	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	75.3	-163.5	178.7	0	0	0	0	0	113.9	I1891	I1891-G1895 PolarHBondContact N-O 2.73Å; I1891-G1895 PolarHBondContact O-N 3.05Å; I1891-G1895 VanDerWaalsContact O-N 3.15Å
1896	C	72	Confident	60.3	Low	6 Å²	6	79.8 Å²	79.8	4%	0.041	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	125.6	173.2	-68.2	0	0	0	0	109.9	G1875 C1884 Y1888 M1889	G1875-C1896 VanDerWaalsContact C-CB 3.5Å; G1875-C1896 WeakPolarHBondContact O-CB 3.45Å; G1875-C1896 PolarHBondContact O-SG 2.74Å; C1884-C1896 HydrophobicContact CB-CB 4.06Å; C1884-C1896 WeakPolarHBondContact CB-SG 3.31Å; C1884-C1896 WeakPolarHBondContact SG-CB 3.38Å; C1884-C1896 CovalentContact SG-SG 2.06Å; C1884-C1896 PolarHBondContact SG-SG 2.95Å; Y1888-C1896 HydrophobicContact CD1-CB 4.47Å; M1889-C1896 CarbonylContact O-C 3.23Å; M1889-C1896 WeakPolarHBondContact O-CA 3.38Å
1897	Q	68.7	Low	59.9	Low	90 Å²	90	75.6 Å²	75.6	42%	0.421	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	162.5	-169.5	-71	-72.9	-18.9	0	0	112.6	Y1888 M1889 I1891 H1894	Y1888-Q1897 CarbonylContact C-O 3.52Å; Y1888-Q1897 WeakPolarHBondContact CA-O 3.22Å; M1889-Q1897 PolarHBondContact N-O 2.95Å; M1889-Q1897 PolarHBondContact O-N 2.9Å; I1891-Q1897 HydrophobicContact CB-CG 4.42Å; I1891-Q1897 HydrophobicContact CD1-CB 3.59Å; I1891-Q1897 HydrophobicContact CD1-CG 4.04Å; I1891-Q1897 HydrophobicContact CG1-CB 3.98Å; I1891-Q1897 HydrophobicContact CG1-CG 4.34Å; H1894-Q1897 HydrophobicContact CB-CG 4.4Å; H1894-Q1897 WeakPolarHBondContact O-CG 3.33Å; H1894-Q1897 PolarHBondContact O-NE2 3.41Å
1898	V	66.1	Low	59.8	Low	84 Å²	84	79.6 Å²	79.6	51%	0.509	43%	0.425	S	S	.	.			trans	-103	164.2	-179.5	-174.8	0	0	0	0	110.8	Y1888	Y1888-V1898 HydrophobicContact CD1-CG2 3.9Å; Y1888-V1898 HydrophobicContact CD2-CG2 4.47Å; Y1888-V1898 HydrophobicContact CE1-CG2 3.93Å; Y1888-V1898 HydrophobicContact CE2-CG2 4.46Å; Y1888-V1898 HydrophobicContact CG-CG2 4.19Å
1899	C	54.3	Low	59.4	Low	27 Å²	27	80.9 Å²	80.9	18%	0.182	44%	0.437	C	S	.	.			trans	-130	168.1	-175	-63.1	0	0	0	0	114.3	M1889 V1903	M1889-C1899 VanDerWaalsContact CE-SG 3.53Å; C1899-V1903 HydrophobicContact CB-CB 3.73Å; C1899-V1903 HydrophobicContact CB-CG1 3.44Å; C1899-V1903 VanDerWaalsContact CB-CG1 3.44Å; C1899-V1903 HydrophobicContact CB-CG2 4.45Å
1900	D	57.2	Low	59.3	Low	91 Å²	91	82.1 Å²	82.1	49%	0.487	44%	0.443	S	S	.	.			trans	-70.2	169.5	-175.5	72.2	65.8	0	0	0	115	C1902 V1903 L1904	D1900-C1902 VanDerWaalsContact C-N 3.34Å; D1900-C1902 PolarHBondContact O-N 2.69Å; D1900-C1902 WeakPolarHBondContact OD1-CA 3.39Å; D1900-C1902 WeakPolarHBondContact OD1-CB 3.32Å; D1900-C1902 PolarHBondContact OD1-N 2.79Å; D1900-V1903 CarbonylContact O-C 2.81Å; D1900-V1903 WeakPolarHBondContact O-CA 3.36Å; D1900-V1903 PolarHBondContact O-N 3.26Å; D1900-V1903 PolarHBondContact OD1-N 2.76Å; D1900-V1903 WeakPolarHBondContact OD2-CG2 3.39Å; D1900-L1904 WeakPolarHBondContact O-CG 3.12Å; D1900-L1904 PolarHBondContact O-N 2.05Å
1901	E	59.1	Low	59.3	Low	175 Å²	175	83 Å²	83	82%	0.818	44%	0.443	S	S	*	.	H	α-helix	trans	-61.4	-32.6	-174.6	-162.8	175.7	-138.4	0	0	114.5	L1904 G1905	E1901-L1904 PolarHBondContact O-N 2.97Å; E1901-G1905 PolarHBondContact O-N 2.88Å; E1901-G1905 VanDerWaalsContact O-N 3.15Å
1902	C	50.6	Low	59.5	Low	112 Å²	112	85.6 Å²	85.6	76%	0.757	45%	0.453	S	S	*	.	H	α-helix	trans	-73.5	-35.1	173.5	-83	0	0	0	0	111.5	D1900 L1906	D1900-C1902 VanDerWaalsContact C-N 3.34Å; D1900-C1902 PolarHBondContact O-N 2.69Å; D1900-C1902 WeakPolarHBondContact OD1-CA 3.39Å; D1900-C1902 WeakPolarHBondContact OD1-CB 3.32Å; D1900-C1902 PolarHBondContact OD1-N 2.79Å; C1902-L1906 PolarHBondContact O-N 2.95Å
1903	V	54.6	Low	59.6	Low	15 Å²	15	85.7 Å²	85.7	9%	0.091	45%	0.453	C	S	.	.	H	α-helix	trans	-72.4	-34.4	172.5	-179.7	0	0	0	0	111.1	C1899 D1900 L1906 V1907	C1899-V1903 HydrophobicContact CB-CB 3.73Å; C1899-V1903 HydrophobicContact CB-CG1 3.44Å; C1899-V1903 VanDerWaalsContact CB-CG1 3.44Å; C1899-V1903 HydrophobicContact CB-CG2 4.45Å; D1900-V1903 CarbonylContact O-C 2.81Å; D1900-V1903 WeakPolarHBondContact O-CA 3.36Å; D1900-V1903 PolarHBondContact O-N 3.26Å; D1900-V1903 PolarHBondContact OD1-N 2.76Å; D1900-V1903 WeakPolarHBondContact OD2-CG2 3.39Å; V1903-L1906 CarbonylContact O-C 3.4Å; V1903-L1906 WeakPolarHBondContact O-CB 3.44Å; V1903-L1906 PolarHBondContact O-N 2.78Å; V1903-V1907 HydrophobicContact CG1-CG2 4.19Å; V1903-V1907 WeakPolarHBondContact O-CB 3.35Å; V1903-V1907 VanDerWaalsContact O-CG2 3.27Å; V1903-V1907 WeakPolarHBondContact O-CG2 3.41Å; V1903-V1907 PolarHBondContact O-N 3.46Å
1904	L	58.6	Low	59.6	Low	86 Å²	86	77.4 Å²	77.4	45%	0.45	42%	0.417	S	S	.	.	H	α-helix	trans	-62.4	-44.8	175.4	-75.6	167.8	0	0	0	111.5	D1900 E1901 L1906 V1907 E1908	D1900-L1904 WeakPolarHBondContact O-CG 3.12Å; D1900-L1904 PolarHBondContact O-N 2.05Å; E1901-L1904 PolarHBondContact O-N 2.97Å; L1904-L1906 VanDerWaalsContact C-N 3.31Å; L1904-L1906 PolarHBondContact O-N 3.26Å; L1904-V1907 CarbonylContact O-C 3.47Å; L1904-V1907 WeakPolarHBondContact O-CB 3.12Å; L1904-V1907 PolarHBondContact O-N 3.22Å; L1904-V1907 VanDerWaalsContact O-N 3.14Å; L1904-E1908 PolarHBondContact O-N 2.87Å
1905	G	60.4	Low	59.5	Low	36 Å²	36	78.5 Å²	78.5	37%	0.371	42%	0.416	S	S	.	.	H	α-helix	trans	-61.3	-37.9	172.3	0	0	0	0	0	113.1	E1901 V1907 E1908 D1909	E1901-G1905 PolarHBondContact O-N 2.88Å; E1901-G1905 VanDerWaalsContact O-N 3.15Å; G1905-V1907 VanDerWaalsContact C-N 3.35Å; G1905-E1908 PolarHBondContact O-N 2.8Å; G1905-D1909 PolarHBondContact O-N 2.98Å
1906	L	53.7	Low	59.2	Low	87 Å²	87	86.2 Å²	86.2	46%	0.455	44%	0.442	S	S	.	.	H	α-helix	trans	-68.3	-34.5	174.2	-164.9	71.4	0	0	0	112.1	C1902 V1903 L1904 M1910 A1958	C1902-L1906 PolarHBondContact O-N 2.95Å; V1903-L1906 CarbonylContact O-C 3.4Å; V1903-L1906 WeakPolarHBondContact O-CB 3.44Å; V1903-L1906 PolarHBondContact O-N 2.78Å; L1904-L1906 VanDerWaalsContact C-N 3.31Å; L1904-L1906 PolarHBondContact O-N 3.26Å; L1906-M1910 WeakPolarHBondContact O-CB 3.12Å; L1906-M1910 WeakPolarHBondContact O-CG 3.43Å; L1906-M1910 PolarHBondContact O-N 3.16Å; L1906-A1958 HydrophobicContact CD2-CB 4.47Å
1907	V	56.2	Low	58.4	Low	39 Å²	39	89.4 Å²	89.4	24%	0.236	46%	0.455	C	S	.	.	H	α-helix	trans	-69.1	-36	174.5	164.6	0	0	0	0	111	V1903 L1904 G1905 M1910 Q1911	V1903-V1907 HydrophobicContact CG1-CG2 4.19Å; V1903-V1907 WeakPolarHBondContact O-CB 3.35Å; V1903-V1907 VanDerWaalsContact O-CG2 3.27Å; V1903-V1907 WeakPolarHBondContact O-CG2 3.41Å; V1903-V1907 PolarHBondContact O-N 3.46Å; L1904-V1907 CarbonylContact O-C 3.47Å; L1904-V1907 WeakPolarHBondContact O-CB 3.12Å; L1904-V1907 PolarHBondContact O-N 3.22Å; L1904-V1907 VanDerWaalsContact O-N 3.14Å; G1905-V1907 VanDerWaalsContact C-N 3.35Å; V1907-M1910 PolarHBondContact O-N 2.97Å; V1907-Q1911 HydrophobicContact CG1-CG 4.21Å; V1907-Q1911 VanDerWaalsContact O-CB 3.32Å; V1907-Q1911 WeakPolarHBondContact O-CB 3.37Å; V1907-Q1911 VanDerWaalsContact O-CG 3.24Å; V1907-Q1911 WeakPolarHBondContact O-CG 3.37Å; V1907-Q1911 PolarHBondContact O-N 3.42Å
1908	E	61	Low	57.9	Low	138 Å²	138	88.3 Å²	88.3	65%	0.645	45%	0.452	S	S	*	.	H	α-helix	trans	-63.1	-48.3	171.9	-72.4	-158.4	118.8	0	0	112	L1904 G1905 M1910 Q1911 Q1912	L1904-E1908 PolarHBondContact O-N 2.87Å; G1905-E1908 PolarHBondContact O-N 2.8Å; E1908-M1910 VanDerWaalsContact C-N 3.3Å; E1908-M1910 PolarHBondContact O-N 2.83Å; E1908-Q1911 PolarHBondContact O-N 3.05Å; E1908-Q1912 VanDerWaalsContact O-CB 3.29Å; E1908-Q1912 WeakPolarHBondContact O-CB 3.07Å; E1908-Q1912 PolarHBondContact O-N 3.03Å
1909	D	59.5	Low	57.5	Low	103 Å²	103	91.6 Å²	91.6	55%	0.551	46%	0.462	S	S	*	.	H	α-helix	trans	-59.6	-40.2	175.5	-92.7	-12.6	0	0	0	111.8	G1905 T1913	G1905-D1909 PolarHBondContact O-N 2.98Å; D1909-T1913 WeakPolarHBondContact O-CB 3.44Å; D1909-T1913 PolarHBondContact O-N 3.03Å; D1909-T1913 PolarHBondContact O-OG1 2.04Å
1910	M	55.3	Low	57.2	Low	108 Å²	108	94.1 Å²	94.1	53%	0.532	47%	0.472	S	S	.	.	H	α-helix	trans	-70.9	-40.1	176.2	-74	-165.8	68.4	0	0	112.6	L1906 V1907 E1908 Q1912 T1913 A1914	L1906-M1910 WeakPolarHBondContact O-CB 3.12Å; L1906-M1910 WeakPolarHBondContact O-CG 3.43Å; L1906-M1910 PolarHBondContact O-N 3.16Å; V1907-M1910 PolarHBondContact O-N 2.97Å; E1908-M1910 VanDerWaalsContact C-N 3.3Å; E1908-M1910 PolarHBondContact O-N 2.83Å; M1910-Q1912 VanDerWaalsContact C-N 3.32Å; M1910-Q1912 PolarHBondContact O-N 3.48Å; M1910-T1913 CarbonylContact O-C 3.54Å; M1910-T1913 PolarHBondContact O-N 3.5Å; M1910-A1914 VanDerWaalsContact O-CB 3.3Å; M1910-A1914 WeakPolarHBondContact O-CB 3.09Å; M1910-A1914 PolarHBondContact O-N 3.29Å
1911	Q	61	Low	56.4	Low	91 Å²	91	90 Å²	90	43%	0.425	45%	0.45	S	S	.	.	H	α-helix	trans	-68.3	-29.2	173.8	-74.6	179.3	16.2	0	0	112.9	V1907 E1908 T1913 R1915	V1907-Q1911 HydrophobicContact CG1-CG 4.21Å; V1907-Q1911 VanDerWaalsContact O-CB 3.32Å; V1907-Q1911 WeakPolarHBondContact O-CB 3.37Å; V1907-Q1911 VanDerWaalsContact O-CG 3.24Å; V1907-Q1911 WeakPolarHBondContact O-CG 3.37Å; V1907-Q1911 PolarHBondContact O-N 3.42Å; E1908-Q1911 PolarHBondContact O-N 3.05Å; Q1911-T1913 VanDerWaalsContact C-N 3.33Å; Q1911-R1915 WeakPolarHBondContact O-CG 3.34Å; Q1911-R1915 PolarHBondContact O-N 2.03Å; Q1911-R1915 PolarHBondContact O-NE 3.47Å
1912	Q	63.8	Low	55.9	Low	117 Å²	117	89 Å²	89	55%	0.547	45%	0.45	S	S	.	.	H	α-helix	trans	-74.2	-28.5	173.7	-162.1	-179.1	123.8	0	0	111.4	E1908 M1910	E1908-Q1912 VanDerWaalsContact O-CB 3.29Å; E1908-Q1912 WeakPolarHBondContact O-CB 3.07Å; E1908-Q1912 PolarHBondContact O-N 3.03Å; M1910-Q1912 VanDerWaalsContact C-N 3.32Å; M1910-Q1912 PolarHBondContact O-N 3.48Å
1913	T	53.5	Low	55.5	Low	69 Å²	69	90.2 Å²	90.2	42%	0.423	45%	0.448	S	S	.	.	H	α-helix	trans	-81.8	-39.7	173.2	-56.3	0	0	0	0	111.9	D1909 M1910 Q1911 R1915 R1916 F1917	D1909-T1913 WeakPolarHBondContact O-CB 3.44Å; D1909-T1913 PolarHBondContact O-N 3.03Å; D1909-T1913 PolarHBondContact O-OG1 2.04Å; M1910-T1913 CarbonylContact O-C 3.54Å; M1910-T1913 PolarHBondContact O-N 3.5Å; Q1911-T1913 VanDerWaalsContact C-N 3.33Å; T1913-R1915 VanDerWaalsContact C-N 3.33Å; T1913-R1915 PolarHBondContact O-N 3.34Å; T1913-R1916 WeakPolarHBondContact O-CA 3.35Å; T1913-R1916 WeakPolarHBondContact O-CB 3.32Å; T1913-R1916 PolarHBondContact O-N 2.93Å; T1913-F1917 HydrophobicContact CG2-CD2 4.13Å; T1913-F1917 HydrophobicContact CG2-CE2 3.95Å; T1913-F1917 WeakPolarHBondContact O-CD2 3.13Å; T1913-F1917 PolarHBondContact O-N 3.03Å
1914	A	54.3	Low	55.2	Low	16 Å²	16	92 Å²	92	13%	0.132	46%	0.457	C	S	.	.	H	α-helix	trans	-60.8	-40.8	175.9	0	0	0	0	0	111.2	M1910 R1916 F1917 D1918	M1910-A1914 VanDerWaalsContact O-CB 3.3Å; M1910-A1914 WeakPolarHBondContact O-CB 3.09Å; M1910-A1914 PolarHBondContact O-N 3.29Å; A1914-R1916 PolarHBondContact O-N 2.83Å; A1914-R1916 VanDerWaalsContact O-N 3.13Å; A1914-F1917 CarbonylContact O-C 3.51Å; A1914-F1917 WeakPolarHBondContact O-CA 3.38Å; A1914-F1917 WeakPolarHBondContact O-CB 3.5Å; A1914-F1917 PolarHBondContact O-N 3.06Å; A1914-D1918 PolarHBondContact O-N 2.81Å
1915	R	61.7	Low	54.3	Low	149 Å²	149	94.5 Å²	94.5	56%	0.562	47%	0.467	S	S	*	.	H	α-helix	trans	-55.9	-29.8	171.4	-83.1	174.9	-95.1	-164.6	-10.4	113.9	Q1911 T1913 E1919	Q1911-R1915 WeakPolarHBondContact O-CG 3.34Å; Q1911-R1915 PolarHBondContact O-N 2.03Å; Q1911-R1915 PolarHBondContact O-NE 3.47Å; T1913-R1915 VanDerWaalsContact C-N 3.33Å; T1913-R1915 PolarHBondContact O-N 3.34Å; R1915-E1919 WeakPolarHBondContact O-CB 3.07Å; R1915-E1919 WeakPolarHBondContact O-CG 3.5Å; R1915-E1919 PolarHBondContact O-N 2.78Å
1916	R	62.3	Low	53.3	Low	172 Å²	172	98.6 Å²	98.6	65%	0.649	48%	0.48	S	S	*	.	H	α-helix	trans	-81.2	-11.9	172.3	-66.4	174.9	166.5	167.5	-0.7	114.2	T1913 A1914	T1913-R1916 WeakPolarHBondContact O-CA 3.35Å; T1913-R1916 WeakPolarHBondContact O-CB 3.32Å; T1913-R1916 PolarHBondContact O-N 2.93Å; A1914-R1916 PolarHBondContact O-N 2.83Å; A1914-R1916 VanDerWaalsContact O-N 3.13Å
1917	F	55.2	Low	53.1	Low	73 Å²	73	97.7 Å²	97.7	32%	0.32	48%	0.478	S	S	.	.	H	α-helix	trans	-97.8	-33	172.7	-81.9	-76.5	0	0	0	112.1	T1913 A1914 E1919 M1920 E1921 V1949	T1913-F1917 HydrophobicContact CG2-CD2 4.13Å; T1913-F1917 HydrophobicContact CG2-CE2 3.95Å; T1913-F1917 WeakPolarHBondContact O-CD2 3.13Å; T1913-F1917 PolarHBondContact O-N 3.03Å; A1914-F1917 CarbonylContact O-C 3.51Å; A1914-F1917 WeakPolarHBondContact O-CA 3.38Å; A1914-F1917 WeakPolarHBondContact O-CB 3.5Å; A1914-F1917 PolarHBondContact O-N 3.06Å; F1917-E1919 PolarHBondContact O-N 3.19Å; F1917-M1920 HydrophobicContact CD1-CE 3.72Å; F1917-M1920 HydrophobicContact CE1-CE 3.69Å; F1917-M1920 CarbonylContact O-C 3.36Å; F1917-M1920 VanDerWaalsContact O-C 3.27Å; F1917-M1920 VanDerWaalsContact O-CA 3.32Å; F1917-M1920 WeakPolarHBondContact O-CA 3.48Å; F1917-M1920 PolarHBondContact O-N 3.4Å; F1917-E1921 WeakPolarHBondContact O-CB 3.42Å; F1917-E1921 PolarHBondContact O-N 3.26Å; F1917-V1949 HydrophobicContact CB-CG1 3.96Å
1918	D	56.8	Low	52.7	Low	66 Å²	66	100.2 Å²	100.2	35%	0.353	49%	0.494	S	S	.	.	H	α-helix	trans	-59.3	-39.2	165.6	-65.6	-53.2	0	0	0	110.5	A1914 M1920 E1921	A1914-D1918 PolarHBondContact O-N 2.81Å; D1918-M1920 PolarHBondContact O-N 2.67Å; D1918-E1921 PolarHBondContact O-N 3.25Å
1919	E	58	Low	51.9	Low	153 Å²	153	100.8 Å²	100.8	72%	0.715	50%	0.498	S	S	*	.	H	α-helix	trans	-60.1	-5	167.5	-77.9	174.2	164.8	0	0	114.4	R1915 F1917	R1915-E1919 WeakPolarHBondContact O-CB 3.07Å; R1915-E1919 WeakPolarHBondContact O-CG 3.5Å; R1915-E1919 PolarHBondContact O-N 2.78Å; F1917-E1919 PolarHBondContact O-N 3.19Å
1920	M	48	Very low	50.5	Low	81 Å²	81	100.3 Å²	100.3	40%	0.399	49%	0.493	S	S	.	.	H	α-helix	trans	-133.6	-5.2	-178.1	-155.3	177.8	70.1	0	0	113.8	F1917 D1918	F1917-M1920 HydrophobicContact CD1-CE 3.72Å; F1917-M1920 HydrophobicContact CE1-CE 3.69Å; F1917-M1920 CarbonylContact O-C 3.36Å; F1917-M1920 VanDerWaalsContact O-C 3.27Å; F1917-M1920 VanDerWaalsContact O-CA 3.32Å; F1917-M1920 WeakPolarHBondContact O-CA 3.48Å; F1917-M1920 PolarHBondContact O-N 3.4Å; D1918-M1920 PolarHBondContact O-N 2.67Å
1921	E	41.6	Very low	49.9	Very low	5 Å²	5	98.8 Å²	98.8	2%	0.023	48%	0.484	C	S	.	.	H	α-helix	trans	-94.6	-13.3	176.9	169.5	53.1	35.7	0	0	112.1	F1917 D1918 D1923 L1924 Q1925 N1945 S1946 L1947	F1917-E1921 WeakPolarHBondContact O-CB 3.42Å; F1917-E1921 PolarHBondContact O-N 3.26Å; D1918-E1921 PolarHBondContact O-N 3.25Å; E1921-D1923 PolarHBondContact O-N 2.89Å; E1921-L1924 PolarHBondContact O-N 2.82Å; E1921-L1924 VanDerWaalsContact O-O 3.13Å; E1921-L1924 WeakPolarHBondContact OE1-CB 3.39Å; E1921-Q1925 VanDerWaalsContact OE2-CA 3.26Å; E1921-Q1925 WeakPolarHBondContact OE2-CA 3.01Å; E1921-Q1925 PolarHBondContact OE2-N 3.18Å; E1921-Q1925 VanDerWaalsContact OE2-N 3.15Å; E1921-N1945 VanDerWaalsContact CB-O 3.25Å; E1921-N1945 WeakPolarHBondContact CB-O 3.3Å; E1921-N1945 WeakPolarHBondContact CG-O 3.33Å; E1921-N1945 PolarHBondContact OE1-ND2 2.04Å; E1921-S1946 VanDerWaalsContact CD-CA 3.43Å; E1921-S1946 WeakPolarHBondContact OE1-CB 3.4Å; E1921-S1946 PolarHBondContact OE1-N 3.09Å; E1921-S1946 WeakPolarHBondContact OE2-CB 3.15Å; E1921-L1947 HydrophobicContact CG-CD2 4.47Å; E1921-L1947 HydrophobicContact CG-CG 4.22Å
1922	L	47.5	Very low	48.5	Very low	154 Å²	154	97 Å²	97	81%	0.806	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-9.4	160.4	-75.3	160.2	0	0	0	113.3
1923	D	43.6	Very low	47.6	Very low	136 Å²	136	93.7 Å²	93.7	73%	0.727	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.2	-10.4	173.5	-67.4	-40.4	0	0	0	115.6	E1921	E1921-D1923 PolarHBondContact O-N 2.89Å
1924	L	46.7	Very low	47.2	Very low	54 Å²	54	92.9 Å²	92.9	28%	0.283	47%	0.466	S	S	.	.			trans	-131.1	-170.5	-179.9	-73	103.9	0	0	0	111.8	E1921 Q1941	E1921-L1924 PolarHBondContact O-N 2.82Å; E1921-L1924 VanDerWaalsContact O-O 3.13Å; E1921-L1924 WeakPolarHBondContact OE1-CB 3.39Å; L1924-Q1941 HydrophobicContact CD2-CG 4.47Å
1925	Q	40.7	Very low	46.7	Very low	138 Å²	138	99.9 Å²	99.9	65%	0.645	49%	0.489	S	S	*	.			trans	176.4	2.5	-175.8	-109	141.3	55.7	0	0	117.6	E1921	E1921-Q1925 VanDerWaalsContact OE2-CA 3.26Å; E1921-Q1925 WeakPolarHBondContact OE2-CA 3.01Å; E1921-Q1925 PolarHBondContact OE2-N 3.18Å; E1921-Q1925 VanDerWaalsContact OE2-N 3.15Å
1926	N	39.8	Very low	45.3	Very low	122 Å²	122	92.8 Å²	92.8	65%	0.652	46%	0.462	S	S	*	.				-116.6	7.9	-125.5	-99.1	-78.4	0	0	0	120.8
1927	V	49	Very low	44.2	Very low	68 Å²	68	88 Å²	88	41%	0.412	45%	0.45	S	S	.	.			trans	-153.6	-164.6	-178.9	-148.6	0	0	0	0	114.2	Q1941 S1942 T1950	V1927-Q1941 HydrophobicContact CB-CB 4.47Å; V1927-Q1941 HydrophobicContact CG2-CB 3.47Å; V1927-Q1941 VanDerWaalsContact CG2-CB 3.47Å; V1927-Q1941 HydrophobicContact CG2-CG 4.14Å; V1927-S1942 VanDerWaalsContact CB-CB 3.5Å; V1927-T1950 HydrophobicContact CB-CG2 4.34Å; V1927-T1950 WeakPolarHBondContact O-CG2 3.41Å
1928	T	46.6	Very low	43.3	Very low	92 Å²	92	90 Å²	90	56%	0.564	46%	0.463	S	S	*	.			trans	-151	166	-161.8	57.6	0	0	0	0	115.6	R1936 S1942	T1928-R1936 PolarHBondContact O-NH2 2.96Å; T1928-S1942 WeakPolarHBondContact O-CB 3.49Å; T1928-S1942 PolarHBondContact O-OG 3.36Å
1929	M	44.6	Very low	42.4	Very low	150 Å²	150	92 Å²	92	74%	0.739	47%	0.466	S	S	*	.			trans	78.4	-161.3	168.4	-41.7	-45.4	-64	0	0	117.5	R1936 A1943	M1929-R1936 VanDerWaalsContact O-CZ 3.29Å; M1929-R1936 PolarHBondContact O-NH1 3.19Å; M1929-R1936 VanDerWaalsContact O-NH1 3.08Å; M1929-R1936 PolarHBondContact O-NH2 3.38Å; M1929-A1943 VanDerWaalsContact O-CB 3.24Å; M1929-A1943 WeakPolarHBondContact O-CB 3.28Å
1930	E	30.5	Very low	41.2	Very low	93 Å²	93	86.5 Å²	86.5	44%	0.435	44%	0.441	S	S	.	.	S	Bend	trans	32.9	176.1	173	-14.5	167.6	39.6	0	0	121	R1936 R1939 A1943 Q1953	E1930-R1936 VanDerWaalsContact CB-NH1 3.29Å; E1930-R1936 VanDerWaalsContact CD-CD 3.44Å; E1930-R1936 VanDerWaalsContact CG-CZ 3.43Å; E1930-R1936 PolarHBondContact O-NH1 3.17Å; E1930-R1936 IonicContact OE1-NE 3.71Å; E1930-R1936 VanDerWaalsContact OE2-CD 3.28Å; E1930-R1936 WeakPolarHBondContact OE2-CD 3.19Å; E1930-R1936 IonicContact OE2-CZ 3.33Å; E1930-R1936 IonicContact OE2-NE 2.68Å; E1930-R1936 PolarHBondContact OE2-NE 3.31Å; E1930-R1939 IonicContact OE2-CZ 3.07Å; E1930-R1939 IonicContact OE2-NH1 3.1Å; E1930-R1939 IonicContact OE2-NH2 2.67Å; E1930-R1939 PolarHBondContact OE2-NH2 2.02Å; E1930-A1943 WeakPolarHBondContact O-CB 3.28Å; E1930-Q1953 VanDerWaalsContact OE1-CG 3.3Å; E1930-Q1953 WeakPolarHBondContact OE1-CG 3.2Å; E1930-Q1953 PolarHBondContact OE1-NE2 2.91Å
1931	Q	42.5	Very low	40.6	Very low	76 Å²	76	85.5 Å²	85.5	36%	0.355	44%	0.436	S	S	.	.			trans	-76.3	-178.3	-175.5	-58.8	159.8	-72.9	0	0	114.9	R1936 G1952 Q1953 F1956	Q1931-R1936 PolarHBondContact O-NH1 3.01Å; Q1931-G1952 CarbonylContact O-C 3.54Å; Q1931-G1952 WeakPolarHBondContact O-CA 3.08Å; Q1931-Q1953 VanDerWaalsContact C-N 3.3Å; Q1931-Q1953 PolarHBondContact O-N 2.96Å; Q1931-F1956 HydrophobicContact CG-CD2 4.01Å; Q1931-F1956 HydrophobicContact CG-CE2 4.18Å
1932	V	32.4	Very low	40.4	Very low	54 Å²	54	85.9 Å²	85.9	33%	0.327	44%	0.439	S	S	.	.	S	Bend	trans	-93.7	134.4	176.7	28.5	0	0	0	0	114.1	T1944 G1952 F1954 G1955	V1932-T1944 HydrophobicContact CB-CG2 3.5Å; V1932-T1944 HydrophobicContact CG2-CG2 3.52Å; V1932-G1952 VanDerWaalsContact C-C 3.44Å; V1932-F1954 CarbonylContact O-C 3.48Å; V1932-F1954 PolarHBondContact O-N 3.3Å; V1932-G1955 PolarHBondContact O-N 3.37Å
1933	S	44.8	Very low	40.1	Very low	47 Å²	47	79.9 Å²	79.9	33%	0.329	41%	0.411	S	S	.	.	B	Isolated β-bridge	trans	173	-86.5	170.3	-174.1	0	0	0	0	120.1	G1952 F1954	S1933-G1952 CarbonylContact C-O 3.5Å; S1933-G1952 PolarHBondContact N-O 2.88Å; S1933-F1954 VanDerWaalsContact CB-N 3.27Å; S1933-F1954 WeakPolarHBondContact OG-CD1 3.05Å
1934	S	45.2	Very low	39.8	Very low	52 Å²	52	74.6 Å²	74.6	36%	0.364	38%	0.384	S	S	.	.	S	Bend		-162.3	-83.3	-114.1	-47.5	0	0	0	0	116.6	L1937 G1952	S1934-L1937 CarbonylContact O-C 3.54Å; S1934-L1937 WeakPolarHBondContact O-CA 3.49Å; S1934-L1937 VanDerWaalsContact O-CB 3.22Å; S1934-L1937 WeakPolarHBondContact O-CB 3.32Å; S1934-L1937 WeakPolarHBondContact O-CD2 3.02Å; S1934-L1937 PolarHBondContact O-N 3.18Å; S1934-L1937 WeakPolarHBondContact OG-CB 3.26Å; S1934-G1952 PolarHBondContact N-O 2.86Å
1935	R	42.5	Very low	38.9	Very low	162 Å²	162	72.1 Å²	72.1	61%	0.611	37%	0.371	S	S	*	.	S	Bend	trans	-110.9	51	156.3	-158.4	-177.5	-100	133.1	3.9	113.5	L1937 N1938 R1939 Q1953	R1935-L1937 WeakPolarHBondContact CA-O 3.02Å; R1935-L1937 WeakPolarHBondContact CG-O 3.02Å; R1935-N1938 WeakPolarHBondContact CD-O 3.25Å; R1935-N1938 WeakPolarHBondContact CG-O 3.2Å; R1935-N1938 PolarHBondContact NE-O 2.87Å; R1935-R1939 PolarHBondContact O-NH1 3.34Å; R1935-Q1953 PolarHBondContact O-OE1 2.71Å; R1935-Q1953 VanDerWaalsContact O-OE1 3.05Å
1936	R	32.8	Very low	38.8	Very low	0 Å²	0	66.5 Å²	66.5	0%	0	35%	0.347	C	S	.	.	S	Bend		-125.8	20.4	129.8	-151.2	170.4	159.8	-116.4	-2.8	109	T1928 M1929 E1930 Q1931 R1939 L1940 Q1941 S1942 G1951 G1952 Q1953	T1928-R1936 PolarHBondContact O-NH2 2.96Å; M1929-R1936 VanDerWaalsContact O-CZ 3.29Å; M1929-R1936 PolarHBondContact O-NH1 3.19Å; M1929-R1936 VanDerWaalsContact O-NH1 3.08Å; M1929-R1936 PolarHBondContact O-NH2 3.38Å; E1930-R1936 VanDerWaalsContact CB-NH1 3.29Å; E1930-R1936 VanDerWaalsContact CD-CD 3.44Å; E1930-R1936 VanDerWaalsContact CG-CZ 3.43Å; E1930-R1936 PolarHBondContact O-NH1 3.17Å; E1930-R1936 IonicContact OE1-NE 3.71Å; E1930-R1936 VanDerWaalsContact OE2-CD 3.28Å; E1930-R1936 WeakPolarHBondContact OE2-CD 3.19Å; E1930-R1936 IonicContact OE2-CZ 3.33Å; E1930-R1936 IonicContact OE2-NE 2.68Å; E1930-R1936 PolarHBondContact OE2-NE 3.31Å; Q1931-R1936 PolarHBondContact O-NH1 3.01Å; R1936-R1939 CarbonylContact C-O 3.56Å; R1936-R1939 VanDerWaalsContact CA-O 3.22Å; R1936-R1939 WeakPolarHBondContact CA-O 3.29Å; R1936-L1940 CarbonylContact O-C 3.58Å; R1936-L1940 VanDerWaalsContact O-CA 3.23Å; R1936-L1940 WeakPolarHBondContact O-CA 3.22Å; R1936-Q1941 VanDerWaalsContact CG-O 3.28Å; R1936-Q1941 WeakPolarHBondContact CG-O 3.38Å; R1936-S1942 VanDerWaalsContact CZ-OG 3.27Å; R1936-S1942 VanDerWaalsContact NE-CA 3.32Å; R1936-S1942 PolarHBondContact NE-OG 3.03Å; R1936-S1942 PolarHBondContact NH2-OG 2.75Å; R1936-G1951 VanDerWaalsContact CB-C 3.5Å; R1936-G1951 WeakPolarHBondContact CB-O 3.31Å; R1936-G1951 WeakPolarHBondContact CD-O 3.48Å; R1936-G1951 WeakPolarHBondContact CG-O 3.48Å; R1936-G1951 PolarHBondContact NE-O 2.98Å; R1936-G1951 PolarHBondContact NH1-O 2.75Å; R1936-G1951 VanDerWaalsContact NH1-O 3.14Å; R1936-G1951 CarbonylContact O-C 3.05Å; R1936-G1951 WeakPolarHBondContact O-CA 3.41Å; R1936-G1952 WeakPolarHBondContact CA-O 3.35Å; R1936-G1952 WeakPolarHBondContact CB-O 3.35Å; R1936-G1952 PolarHBondContact N-O 3.22Å; R1936-G1952 PolarHBondContact O-N 3.38Å; R1936-Q1953 HydrophobicContact CB-CB 3.91Å; R1936-Q1953 HydrophobicContact CB-CG 4.1Å
1937	L	39.1	Very low	38.3	Very low	73 Å²	73	67.4 Å²	67.4	38%	0.382	35%	0.351	S	S	.	.	S	Bend	trans	-92.4	135.4	141.2	157.8	151.7	0	0	0	109.3	S1934 R1935 R1939 L1940	S1934-L1937 CarbonylContact O-C 3.54Å; S1934-L1937 WeakPolarHBondContact O-CA 3.49Å; S1934-L1937 VanDerWaalsContact O-CB 3.22Å; S1934-L1937 WeakPolarHBondContact O-CB 3.32Å; S1934-L1937 WeakPolarHBondContact O-CD2 3.02Å; S1934-L1937 PolarHBondContact O-N 3.18Å; S1934-L1937 WeakPolarHBondContact OG-CB 3.26Å; R1935-L1937 WeakPolarHBondContact CA-O 3.02Å; R1935-L1937 WeakPolarHBondContact CG-O 3.02Å; L1937-R1939 VanDerWaalsContact C-C 3.49Å; L1937-R1939 CarbonylContact C-O 3.6Å; L1937-R1939 VanDerWaalsContact CA-O 3.31Å; L1937-R1939 WeakPolarHBondContact CA-O 3.11Å; L1937-R1939 PolarHBondContact N-O 2.8Å; L1937-L1940 HydrophobicContact CB-CD2 3.69Å; L1937-L1940 HydrophobicContact CB-CG 3.88Å; L1937-L1940 HydrophobicContact CD1-CD2 4.25Å; L1937-L1940 HydrophobicContact CD1-CG 4.32Å; L1937-L1940 HydrophobicContact CG-CD2 4.12Å; L1937-L1940 HydrophobicContact CG-CG 3.92Å
1938	N	37.9	Very low	37.4	Very low	113 Å²	113	69.8 Å²	69.8	60%	0.604	36%	0.358	S	S	*	.	S	Bend	trans	45.6	74.4	-173.6	-175.4	-106.7	0	0	0	116	R1935	R1935-N1938 WeakPolarHBondContact CD-O 3.25Å; R1935-N1938 WeakPolarHBondContact CG-O 3.2Å; R1935-N1938 PolarHBondContact NE-O 2.87Å
1939	R	36.3	Very low	37	Very low	108 Å²	108	66.3 Å²	66.3	41%	0.408	34%	0.337	S	S	.	.	S	Bend	cis	-53.1	133.6	-3.3	38.4	71.3	126.8	143.2	-14.6	112.3	E1930 R1935 R1936 L1937 Q1941	E1930-R1939 IonicContact OE2-CZ 3.07Å; E1930-R1939 IonicContact OE2-NH1 3.1Å; E1930-R1939 IonicContact OE2-NH2 2.67Å; E1930-R1939 PolarHBondContact OE2-NH2 2.02Å; R1935-R1939 PolarHBondContact O-NH1 3.34Å; R1936-R1939 CarbonylContact C-O 3.56Å; R1936-R1939 VanDerWaalsContact CA-O 3.22Å; R1936-R1939 WeakPolarHBondContact CA-O 3.29Å; L1937-R1939 VanDerWaalsContact C-C 3.49Å; L1937-R1939 CarbonylContact C-O 3.6Å; L1937-R1939 VanDerWaalsContact CA-O 3.31Å; L1937-R1939 WeakPolarHBondContact CA-O 3.11Å; L1937-R1939 PolarHBondContact N-O 2.8Å; R1939-Q1941 WeakPolarHBondContact CD-O 3.01Å; R1939-Q1941 PolarHBondContact NE-O 2.8Å
1940	L	34.5	Very low	36.7	Very low	38 Å²	38	59.5 Å²	59.5	20%	0.199	30%	0.303	C	S	.	.			trans	-107	14.4	-167.3	-137.3	-164.4	0	0	0	119.3	R1936 L1937 N1945 T1950 G1951	R1936-L1940 CarbonylContact O-C 3.58Å; R1936-L1940 VanDerWaalsContact O-CA 3.23Å; R1936-L1940 WeakPolarHBondContact O-CA 3.22Å; L1937-L1940 HydrophobicContact CB-CD2 3.69Å; L1937-L1940 HydrophobicContact CB-CG 3.88Å; L1937-L1940 HydrophobicContact CD1-CD2 4.25Å; L1937-L1940 HydrophobicContact CD1-CG 4.32Å; L1937-L1940 HydrophobicContact CG-CD2 4.12Å; L1937-L1940 HydrophobicContact CG-CG 3.92Å; L1940-N1945 WeakPolarHBondContact O-CB 3.34Å; L1940-N1945 PolarHBondContact O-OD1 3.31Å; L1940-T1950 CarbonylContact C-O 3.41Å; L1940-G1951 VanDerWaalsContact C-CA 3.42Å; L1940-G1951 WeakPolarHBondContact O-CA 3.49Å
1941	Q	35.1	Very low	36.4	Very low	61 Å²	61	55 Å²	55	29%	0.285	28%	0.283	S	S	.	.			cis	121	37.7	2.4	33	53.3	36	0	0	111.7	L1924 V1927 R1936 R1939 T1950	L1924-Q1941 HydrophobicContact CD2-CG 4.47Å; V1927-Q1941 HydrophobicContact CB-CB 4.47Å; V1927-Q1941 HydrophobicContact CG2-CB 3.47Å; V1927-Q1941 VanDerWaalsContact CG2-CB 3.47Å; V1927-Q1941 HydrophobicContact CG2-CG 4.14Å; R1936-Q1941 VanDerWaalsContact CG-O 3.28Å; R1936-Q1941 WeakPolarHBondContact CG-O 3.38Å; R1939-Q1941 WeakPolarHBondContact CD-O 3.01Å; R1939-Q1941 PolarHBondContact NE-O 2.8Å; Q1941-T1950 PolarHBondContact N-O 3.44Å
1942	S	36	Very low	35.7	Very low	12 Å²	12	51.4 Å²	51.4	8%	0.084	27%	0.266	C	S	.	.	S	Bend	trans	169.3	-98.1	-179.7	117.3	0	0	0	0	116.3	V1927 T1928 R1936 T1950 G1951	V1927-S1942 VanDerWaalsContact CB-CB 3.5Å; T1928-S1942 WeakPolarHBondContact O-CB 3.49Å; T1928-S1942 PolarHBondContact O-OG 3.36Å; R1936-S1942 VanDerWaalsContact CZ-OG 3.27Å; R1936-S1942 VanDerWaalsContact NE-CA 3.32Å; R1936-S1942 PolarHBondContact NE-OG 3.03Å; R1936-S1942 PolarHBondContact NH2-OG 2.75Å; S1942-T1950 CarbonylContact C-O 3.45Å; S1942-T1950 VanDerWaalsContact N-C 3.31Å; S1942-T1950 PolarHBondContact N-O 3.09Å; S1942-T1950 CarbonylContact O-C 3.55Å; S1942-T1950 WeakPolarHBondContact O-CA 3.29Å; S1942-T1950 WeakPolarHBondContact O-CG2 3.21Å; S1942-G1951 CarbonylContact C-O 3.42Å; S1942-G1951 VanDerWaalsContact C-O 3.28Å; S1942-G1951 WeakPolarHBondContact CA-O 3.04Å
1943	A	41.7	Very low	35.8	Very low	28 Å²	28	51.6 Å²	51.6	23%	0.231	26%	0.263	C	S	.	.	S	Bend	trans	-134.2	118	163.4	0	0	0	0	0	112.4	M1929 E1930 V1949 T1950 G1951 G1952	M1929-A1943 VanDerWaalsContact O-CB 3.24Å; M1929-A1943 WeakPolarHBondContact O-CB 3.28Å; E1930-A1943 WeakPolarHBondContact O-CB 3.28Å; A1943-V1949 CarbonylContact C-O 3.56Å; A1943-T1950 VanDerWaalsContact CA-CA 3.48Å; A1943-T1950 VanDerWaalsContact CA-N 3.29Å; A1943-G1951 VanDerWaalsContact C-CA 3.5Å; A1943-G1951 CarbonylContact C-O 3.38Å; A1943-G1951 VanDerWaalsContact C-O 3.3Å; A1943-G1951 WeakPolarHBondContact CA-O 3.46Å; A1943-G1951 VanDerWaalsContact N-C 3.31Å; A1943-G1951 PolarHBondContact N-O 3.21Å; A1943-G1951 CarbonylContact O-C 3.5Å; A1943-G1951 PolarHBondContact O-N 2.88Å; A1943-G1952 WeakPolarHBondContact O-CA 3.34Å; A1943-G1952 PolarHBondContact O-N 3.19Å
1944	T	38.2	Very low	35.5	Very low	25 Å²	25	55.8 Å²	55.8	15%	0.153	28%	0.275	C	S	.	.	S	Bend	trans	100	40.9	-135.5	97.8	0	0	0	0	126.5	V1932 V1949 G1951 G1952	V1932-T1944 HydrophobicContact CB-CG2 3.5Å; V1932-T1944 HydrophobicContact CG2-CG2 3.52Å; T1944-V1949 HydrophobicContact CG2-CG2 4.03Å; T1944-V1949 PolarHBondContact N-O 2.71Å; T1944-G1951 WeakPolarHBondContact O-CA 3.43Å; T1944-G1951 PolarHBondContact O-N 3.28Å; T1944-G1951 WeakPolarHBondContact OG1-CA 3.32Å; T1944-G1952 WeakPolarHBondContact OG1-CA 3.36Å; T1944-G1952 PolarHBondContact OG1-N 3.03Å
1945	N	26.9	Very low	35	Very low	2 Å²	2	55.3 Å²	55.3	1%	0.011	28%	0.279	C	S	.	.	S	Bend	trans	-148.9	-51.3	156.6	-142.3	116.4	0	0	0	114.2	E1921 L1940 V1949 T1950	E1921-N1945 VanDerWaalsContact CB-O 3.25Å; E1921-N1945 WeakPolarHBondContact CB-O 3.3Å; E1921-N1945 WeakPolarHBondContact CG-O 3.33Å; E1921-N1945 PolarHBondContact OE1-ND2 2.04Å; L1940-N1945 WeakPolarHBondContact O-CB 3.34Å; L1940-N1945 PolarHBondContact O-OD1 3.31Å; N1945-V1949 WeakPolarHBondContact O-CA 3.33Å; N1945-V1949 WeakPolarHBondContact O-CG1 3.38Å; N1945-T1950 WeakPolarHBondContact CB-O 3.13Å; N1945-T1950 VanDerWaalsContact CB-OG1 3.27Å; N1945-T1950 WeakPolarHBondContact CB-OG1 3.43Å
1946	S	38.4	Very low	35.1	Very low	21 Å²	21	54.6 Å²	54.6	15%	0.147	28%	0.281	C	S	.	.	S	Bend	trans	-119.3	160.7	169.4	94.8	0	0	0	0	119.3	E1921 V1949 T1950	E1921-S1946 VanDerWaalsContact CD-CA 3.43Å; E1921-S1946 WeakPolarHBondContact OE1-CB 3.4Å; E1921-S1946 PolarHBondContact OE1-N 3.09Å; E1921-S1946 WeakPolarHBondContact OE2-CB 3.15Å; S1946-V1949 VanDerWaalsContact C-C 3.44Å; S1946-V1949 VanDerWaalsContact C-CA 3.45Å; S1946-V1949 CarbonylContact O-C 2.83Å; S1946-V1949 WeakPolarHBondContact O-CA 3.35Å; S1946-V1949 PolarHBondContact O-N 3.11Å; S1946-T1950 PolarHBondContact N-OG1 3.18Å; S1946-T1950 WeakPolarHBondContact O-CA 3.34Å; S1946-T1950 VanDerWaalsContact O-CB 3.23Å; S1946-T1950 WeakPolarHBondContact O-CB 3.45Å; S1946-T1950 PolarHBondContact O-N 3.1Å; S1946-T1950 WeakPolarHBondContact OG-CB 3.16Å; S1946-T1950 PolarHBondContact OG-OG1 2.77Å
1947	L	30.1	Very low	35.4	Very low	140 Å²	140	63 Å²	63	73%	0.733	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn		-107.4	121.7	-65.1	-60.3	99.1	0	0	0	106.6	E1921	E1921-L1947 HydrophobicContact CG-CD2 4.47Å; E1921-L1947 HydrophobicContact CG-CG 4.22Å
1948	E	29.7	Very low	35.6	Very low	118 Å²	118	62.5 Å²	62.5	55%	0.551	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	cis	-43.2	-63.1	-5	45.3	133.8	40.7	0	0	112.1
1949	V	37.4	Very low	35.9	Very low	20 Å²	20	60.7 Å²	60.7	12%	0.121	32%	0.319	C	S	.	.			trans	-152.8	137.4	-173.8	-69.9	0	0	0	0	108.2	F1917 A1943 T1944 N1945 S1946	F1917-V1949 HydrophobicContact CB-CG1 3.96Å; A1943-V1949 CarbonylContact C-O 3.56Å; T1944-V1949 HydrophobicContact CG2-CG2 4.03Å; T1944-V1949 PolarHBondContact N-O 2.71Å; N1945-V1949 WeakPolarHBondContact O-CA 3.33Å; N1945-V1949 WeakPolarHBondContact O-CG1 3.38Å; S1946-V1949 VanDerWaalsContact C-C 3.44Å; S1946-V1949 VanDerWaalsContact C-CA 3.45Å; S1946-V1949 CarbonylContact O-C 2.83Å; S1946-V1949 WeakPolarHBondContact O-CA 3.35Å; S1946-V1949 PolarHBondContact O-N 3.11Å
1950	T	39.9	Very low	35.9	Very low	6 Å²	6	62.3 Å²	62.3	4%	0.037	34%	0.336	C	S	.	.	S	Bend	cis	75.2	19.8	20	128.6	0	0	0	0	128.8	V1927 L1940 Q1941 S1942 A1943 N1945 S1946	V1927-T1950 HydrophobicContact CB-CG2 4.34Å; V1927-T1950 WeakPolarHBondContact O-CG2 3.41Å; L1940-T1950 CarbonylContact C-O 3.41Å; Q1941-T1950 PolarHBondContact N-O 3.44Å; S1942-T1950 CarbonylContact C-O 3.45Å; S1942-T1950 VanDerWaalsContact N-C 3.31Å; S1942-T1950 PolarHBondContact N-O 3.09Å; S1942-T1950 CarbonylContact O-C 3.55Å; S1942-T1950 WeakPolarHBondContact O-CA 3.29Å; S1942-T1950 WeakPolarHBondContact O-CG2 3.21Å; A1943-T1950 VanDerWaalsContact CA-CA 3.48Å; A1943-T1950 VanDerWaalsContact CA-N 3.29Å; N1945-T1950 WeakPolarHBondContact CB-O 3.13Å; N1945-T1950 VanDerWaalsContact CB-OG1 3.27Å; N1945-T1950 WeakPolarHBondContact CB-OG1 3.43Å; S1946-T1950 PolarHBondContact N-OG1 3.18Å; S1946-T1950 WeakPolarHBondContact O-CA 3.34Å; S1946-T1950 VanDerWaalsContact O-CB 3.23Å; S1946-T1950 WeakPolarHBondContact O-CB 3.45Å; S1946-T1950 PolarHBondContact O-N 3.1Å; S1946-T1950 WeakPolarHBondContact OG-CB 3.16Å; S1946-T1950 PolarHBondContact OG-OG1 2.77Å
1951	G	23	Very low	36	Very low	0 Å²	0	71.6 Å²	71.6	0%	0	37%	0.368	C	S	.	.			trans	-144.8	-121.6	-176.4	0	0	0	0	0	116.8	R1936 L1940 S1942 A1943 T1944	R1936-G1951 VanDerWaalsContact CB-C 3.5Å; R1936-G1951 WeakPolarHBondContact CB-O 3.31Å; R1936-G1951 WeakPolarHBondContact CD-O 3.48Å; R1936-G1951 WeakPolarHBondContact CG-O 3.48Å; R1936-G1951 PolarHBondContact NE-O 2.98Å; R1936-G1951 PolarHBondContact NH1-O 2.75Å; R1936-G1951 VanDerWaalsContact NH1-O 3.14Å; R1936-G1951 CarbonylContact O-C 3.05Å; R1936-G1951 WeakPolarHBondContact O-CA 3.41Å; L1940-G1951 VanDerWaalsContact C-CA 3.42Å; L1940-G1951 WeakPolarHBondContact O-CA 3.49Å; S1942-G1951 CarbonylContact C-O 3.42Å; S1942-G1951 VanDerWaalsContact C-O 3.28Å; S1942-G1951 WeakPolarHBondContact CA-O 3.04Å; A1943-G1951 VanDerWaalsContact C-CA 3.5Å; A1943-G1951 CarbonylContact C-O 3.38Å; A1943-G1951 VanDerWaalsContact C-O 3.3Å; A1943-G1951 WeakPolarHBondContact CA-O 3.46Å; A1943-G1951 VanDerWaalsContact N-C 3.31Å; A1943-G1951 PolarHBondContact N-O 3.21Å; A1943-G1951 CarbonylContact O-C 3.5Å; A1943-G1951 PolarHBondContact O-N 2.88Å; T1944-G1951 WeakPolarHBondContact O-CA 3.43Å; T1944-G1951 PolarHBondContact O-N 3.28Å; T1944-G1951 WeakPolarHBondContact OG1-CA 3.32Å
1952	G	28.6	Very low	35.9	Very low	0 Å²	0	72.9 Å²	72.9	0%	0	38%	0.384	C	S	.	.			trans	119.1	-157.5	154.3	0	0	0	0	0	125.5	Q1931 V1932 S1933 S1934 R1936 A1943 T1944	Q1931-G1952 CarbonylContact O-C 3.54Å; Q1931-G1952 WeakPolarHBondContact O-CA 3.08Å; V1932-G1952 VanDerWaalsContact C-C 3.44Å; S1933-G1952 CarbonylContact C-O 3.5Å; S1933-G1952 PolarHBondContact N-O 2.88Å; S1934-G1952 PolarHBondContact N-O 2.86Å; R1936-G1952 WeakPolarHBondContact CA-O 3.35Å; R1936-G1952 WeakPolarHBondContact CB-O 3.35Å; R1936-G1952 PolarHBondContact N-O 3.22Å; R1936-G1952 PolarHBondContact O-N 3.38Å; A1943-G1952 WeakPolarHBondContact O-CA 3.34Å; A1943-G1952 PolarHBondContact O-N 3.19Å; T1944-G1952 WeakPolarHBondContact OG1-CA 3.36Å; T1944-G1952 PolarHBondContact OG1-N 3.03Å
1953	Q	34.5	Very low	35.6	Very low	57 Å²	57	82 Å²	82	27%	0.266	42%	0.422	S	S	.	.	B	Isolated β-bridge	trans	119	0.4	160.1	-110.7	-179.3	19.2	0	0	125.5	E1930 Q1931 R1935 R1936	E1930-Q1953 VanDerWaalsContact OE1-CG 3.3Å; E1930-Q1953 WeakPolarHBondContact OE1-CG 3.2Å; E1930-Q1953 PolarHBondContact OE1-NE2 2.91Å; Q1931-Q1953 VanDerWaalsContact C-N 3.3Å; Q1931-Q1953 PolarHBondContact O-N 2.96Å; R1935-Q1953 PolarHBondContact O-OE1 2.71Å; R1935-Q1953 VanDerWaalsContact O-OE1 3.05Å; R1936-Q1953 HydrophobicContact CB-CB 3.91Å; R1936-Q1953 HydrophobicContact CB-CG 4.1Å
1954	F	38.2	Very low	35.4	Very low	135 Å²	135	89.3 Å²	89.3	59%	0.592	47%	0.467	S	S	*	.			trans	-144.7	-24.4	178.8	-63.5	145.2	0	0	0	119.8	V1932 S1933 F1956	V1932-F1954 CarbonylContact O-C 3.48Å; V1932-F1954 PolarHBondContact O-N 3.3Å; S1933-F1954 VanDerWaalsContact CB-N 3.27Å; S1933-F1954 WeakPolarHBondContact OG-CD1 3.05Å; F1954-F1956 VanDerWaalsContact C-N 3.28Å; F1954-F1956 PolarHBondContact O-N 3.09Å
1955	G	34.3	Very low	35.2	Very low	43 Å²	43	92.5 Å²	92.5	44%	0.443	48%	0.483	S	S	.	.			trans	-66.1	3	-144.2	0	0	0	0	0	121	V1932 K1957	V1932-G1955 PolarHBondContact O-N 3.37Å; G1955-K1957 PolarHBondContact O-N 2.04Å
1956	F	43.6	Very low	35.7	Very low	147 Å²	147	97.3 Å²	97.3	65%	0.645	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	41.6	-177	-97.3	-131.7	0	0	0	115.9	Q1931 F1954	Q1931-F1956 HydrophobicContact CG-CD2 4.01Å; Q1931-F1956 HydrophobicContact CG-CE2 4.18Å; F1954-F1956 VanDerWaalsContact C-N 3.28Å; F1954-F1956 PolarHBondContact O-N 3.09Å
1957	K	40.5	Very low	35.5	Very low	176 Å²	176	101.5 Å²	101.5	77%	0.765	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.3	-3.5	-167.5	-72.4	-171.2	176.4	179.9	0	117.8	G1955	G1955-K1957 PolarHBondContact O-N 2.04Å
1958	A	42.3	Very low	35.8	Very low	63 Å²	63	99.2 Å²	99.2	52%	0.521	52%	0.516	S	S	.	.	S	Bend	trans	-79.5	-64.5	-175.5	0	0	0	0	0	113	L1906 N1960	L1906-A1958 HydrophobicContact CD2-CB 4.47Å; A1958-N1960 PolarHBondContact O-N 3.06Å
1959	C	44.5	Very low	36.2	Very low	75 Å²	75	98.1 Å²	98.1	51%	0.507	51%	0.514	S	S	.	.	S	Bend	trans	-72.2	11.5	-172.5	-55.2	0	0	0	0	115.3
1960	N	37.5	Very low	36.1	Very low	142 Å²	142	103.3 Å²	103.3	76%	0.759	54%	0.54	S	S	*	.			trans	-136.8	70.7	-167	-151	-23.5	0	0	0	112.3	A1958	A1958-N1960 PolarHBondContact O-N 3.06Å
1961	R	35.8	Very low	35.9	Very low	233 Å²	233	110.2 Å²	110.2	88%	0.879	58%	0.576	S	S	*	*			trans	-149.9	102.2	165.7	-147.1	176.9	-164.6	-164.5	1.7	111.2
1962	S	33.5	Very low	36.9	Very low	87 Å²	87	118.7 Å²	118.7	61%	0.608	62%	0.62	S	S	*	*			trans	-70.2	145.3	-177	43.5	0	0	0	0	114
1963	F	29.8	Very low	37.5	Very low	203 Å²	203	128.6 Å²	128.6	89%	0.89	67%	0.672	S	S	*	*			trans	-173.9	94.1	166.9	-99.2	-67	0	0	0	109.1
1964	P	36.1	Very low	37.8	Very low	182 Å²	182	135.1 Å²	135.1	100%	1.182	71%	0.708	S	S	*	*			cis	-65	0	-11.7	-16.4	32.7	0	0	0	113.7

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