A0A096NU05_PAPAN Loading...

WD repeat-containing protein 11

Involved in the Hedgehog (Hh) signaling pathway, is essential for normal ciliogenesis. Regulates the proteolytic processing of GLI3 and cooperates with the transcription factor EMX1 in the induction of downstream Hh pathway gene expression and gonadotropin-releasing hormone production. WDR11 complex facilitates the tethering of Adaptor protein-1 complex (AP-1)-derived vesicles. WDR11 complex acts together with TBC1D23 to facilitate the golgin-mediated capture of vesicles generated using AP-1.

AlphaFold DB , UniProt , Accession A0A096NU05, Species PAPAN (Papio anubis, Olive baboon), Gene WDR11, Length 1,224 aa.

						>A0A096NU05_PAPAN|A0A096NU05|WDR11
MLPYTVNFKVSARTLTGALNAHNKAAVDWGWQGLIAYGCHSLVVVIDSITAQTLQVLEKHKADVVKVKWARENYHHNIGSPYCLRLASADVNGKIIVWDVAAGVAQCEIQEHAKPIQDVQWLWNQDASRDLLLAIHPPNYIVLWNADTGTKLWKKSYADNILSFSFDPFDPSHLTLLTSEGIVFISDFSPSKPPSGPGKKVYISSPHSSPAHNKLATATGAKKALNKVKILITQEKPSAEFITLNDCLQLAYLPSKRNHMLLLYPREILILDLEVNQTVGVIAIERTGVPFLQVIPCFQRDGLFCLHENGCITLRVRRSYNNIFTTSNEEPDPDPVQELTYDLRSQCDAIRVTKTVRPFSMVCCPVNENAAALIVSDGRVMIWELKSTVCNRNMRNSSSGVSPLYSPVSFCGIPVGVLQNKLPDLSLDNMIGQSAIAGEEHPRGSILREVHLKFLLTGLLSGLPAPQFAIRMCPPLTTKNIKMYQPLLAVGTSNGSVLVYHLTSGLLHKELSIHSCEVKGIEWTSLTSFLSFATSTPNNMGLVRNELQLVDLPTGRSIAFRGERGNDESPIEMIKVSHLKQYLAVVFKDKPLELWDVRTCTLLREMSKNFPAITALEWSPSHNLKSLRKKQLATREAMARQTVVSDTELSIVESSVISLLQEAESKSELSQNISAREHFVFTDNDGQVYHLTVEGNSVKDSARIPPDGSMGSITCIAWKGDTLVLGDMDGNLNFWDLKGRVSRGIPTHRSWVRKIRFAPGKGNQKLIAMYNDGAEVWDTKEVQMVSSLRSGRNVTFRILDVDWCTSDKVILASDDGCIRVLEMSMKSACFRMDEQELTEPVWCPYLLVPRASLALKAFLLHQPWNGQYSLDISHVDYPENEEIKNLLQEQLNSLSNEIKKLLLDPEFTLLQRCLLVSRLYGDESELHFWTVAAHYLHSLSQEKSARTTAPKEAAPQDKLSNPLDICYDVLCENAYFQKFQLERVNLQEVKRSTYDHTRKCTDQLLLLGQTDRAVQLLLETSADNQHYYCDSLKACLVTTVTSSGPSQSTIKLVATNMIANGKLAEGVQLLCLIDKAADACRYLQTYGEWNRAAWLAKVRLNPEECADVLKRWVDHLCSPQVNQKSKALLVLLSLGCFFSVAETLHSMRYFDRAALFVEACLKYGAFEVTEDTEKLITAVYADYARSLKNLGFKQGAVLFASKAGAAGKDLLNELESSKEERIEE
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.9	Very low	47.6	Very low	243 Å²	243	113.4 Å²	113.4	100%	1.197	58%	0.577	S	S	*	*				0	102.9	0	-69.4	-172.1	-152.8	0	0	107.1
2	L	23.8	Very low	50.6	Low	161 Å²	161	105.6 Å²	105.6	84%	0.843	54%	0.543	S	S	*	.			trans	-58.3	130.9	168.2	-78.7	147.9	0	0	0	107.5	Y4	L2-Y4 PolarHBondContact O-N 3.36Å; L2-Y4 VanDerWaalsContact O-N 3.07Å
3	P	31	Very low	53.4	Low	105 Å²	105	99.7 Å²	99.7	68%	0.682	51%	0.51	S	S	*	.			trans	-62	116.7	172.9	25.8	-29.6	0	0	0	106.9	T5	P3-T5 PolarHBondContact O-N 3.34Å
4	Y	34.6	Very low	56	Low	215 Å²	215	93.1 Å²	93.1	84%	0.843	48%	0.476	S	S	*	.			trans	-63.2	89	167.3	-87	-89.6	0	0	0	107.7	L2 V6	L2-Y4 PolarHBondContact O-N 3.36Å; L2-Y4 VanDerWaalsContact O-N 3.07Å; Y4-V6 PolarHBondContact O-N 3.13Å; Y4-V6 VanDerWaalsContact O-N 3.08Å
5	T	33	Very low	58.3	Low	103 Å²	103	87.9 Å²	87.9	63%	0.632	45%	0.45	S	S	*	.			trans	-77.3	81.3	165.1	46.7	0	0	0	0	107.4	P3 N7	P3-T5 PolarHBondContact O-N 3.34Å; T5-N7 PolarHBondContact O-N 3.35Å
6	V	41.1	Very low	60.3	Low	65 Å²	65	83.1 Å²	83.1	39%	0.394	43%	0.426	S	S	.	.			trans	-75.1	85	162	-169.5	0	0	0	0	105.9	Y4 F8 I481	Y4-V6 PolarHBondContact O-N 3.13Å; Y4-V6 VanDerWaalsContact O-N 3.08Å; V6-F8 VanDerWaalsContact C-N 3.33Å; V6-F8 HydrophobicContact CB-CE2 4.15Å; V6-F8 HydrophobicContact CG1-CD2 3.87Å; V6-F8 HydrophobicContact CG1-CE1 4.21Å; V6-F8 HydrophobicContact CG1-CE2 3.38Å; V6-F8 HydrophobicContact CG1-CG 4.48Å; V6-F8 HydrophobicContact CG1-CZ 3.58Å; V6-F8 PolarHBondContact O-N 3.06Å; V6-I481 HydrophobicContact CB-CD1 4.11Å; V6-I481 HydrophobicContact CB-CG1 4.16Å; V6-I481 HydrophobicContact CG2-CD1 4.11Å; V6-I481 HydrophobicContact CG2-CG1 4.19Å
7	N	45.3	Very low	61.8	Low	136 Å²	136	78.2 Å²	78.2	73%	0.727	40%	0.401	S	S	*	.			trans	-74.7	87.7	176.3	-80.9	-13.4	0	0	0	108.4	T5 K9	T5-N7 PolarHBondContact O-N 3.35Å; N7-K9 PolarHBondContact O-N 3.17Å
8	F	61.4	Low	63.3	Low	73 Å²	73	74.8 Å²	74.8	32%	0.32	39%	0.386	S	S	.	.			trans	-69.2	83.2	161.1	-63.8	-78.4	0	0	0	107.9	V6 V10 L476 I481 Y484	V6-F8 VanDerWaalsContact C-N 3.33Å; V6-F8 HydrophobicContact CB-CE2 4.15Å; V6-F8 HydrophobicContact CG1-CD2 3.87Å; V6-F8 HydrophobicContact CG1-CE1 4.21Å; V6-F8 HydrophobicContact CG1-CE2 3.38Å; V6-F8 HydrophobicContact CG1-CG 4.48Å; V6-F8 HydrophobicContact CG1-CZ 3.58Å; V6-F8 PolarHBondContact O-N 3.06Å; F8-V10 PolarHBondContact O-N 2.95Å; F8-L476 HydrophobicContact CD2-CD2 4.23Å; F8-I481 HydrophobicContact CE2-CG1 4.47Å; F8-Y484 HydrophobicContact CD2-CD1 4.22Å; F8-Y484 HydrophobicContact CE2-CD1 4.29Å
9	K	66.9	Low	64.7	Low	115 Å²	115	71.7 Å²	71.7	50%	0.5	37%	0.371	S	S	.	.			trans	-78	109.6	-179.1	-168.6	179.5	174.3	-167.2	0	108.3	N7 E836	N7-K9 PolarHBondContact O-N 3.17Å; K9-E836 IonicContact NZ-OE1 3.76Å
10	V	76.3	Confident	66.1	Low	3 Å²	3	70.2 Å²	70.2	2%	0.018	36%	0.363	C	S	.	.			trans	-85.1	-16.1	-173.1	170.9	0	0	0	0	115.5	F8 P486 L502 T805 K808 V820	F8-V10 PolarHBondContact O-N 2.95Å; V10-P486 HydrophobicContact CG2-CB 4.23Å; V10-P486 HydrophobicContact CG2-CG 4.38Å; V10-L502 HydrophobicContact CG1-CB 4.31Å; V10-T805 HydrophobicContact CB-CG2 4.39Å; V10-T805 HydrophobicContact CG2-CG2 4.08Å; V10-K808 HydrophobicContact CB-CD 4.22Å; V10-K808 HydrophobicContact CG1-CD 4.22Å; V10-V820 HydrophobicContact CG1-CG1 4.27Å
11	S	78.9	Confident	67.2	Low	28 Å²	28	69.3 Å²	69.3	20%	0.196	37%	0.367	C	S	.	.			trans	51.9	152.3	-174.1	93.7	0	0	0	0	116.7	R13	S11-R13 PolarHBondContact OG-NE 3.13Å; S11-R13 PolarHBondContact OG-NH2 2.79Å
12	A	83.6	Confident	70.1	Confident	20 Å²	20	62.6 Å²	62.6	17%	0.165	33%	0.332	C	S	.	.			trans	-76.1	143.7	166.1	0	0	0	0	0	108.6	V820	A12-V820 CarbonylContact C-O 3.6Å; A12-V820 WeakPolarHBondContact CA-O 3.4Å; A12-V820 WeakPolarHBondContact CB-O 3.21Å
13	R	87.1	Confident	73.3	Confident	29 Å²	29	55.1 Å²	55.1	11%	0.109	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.4	159.7	177	62.6	-177.1	64.7	-159.4	1.2	112.4	S11 L502 T503 S504 G505 V820	S11-R13 PolarHBondContact OG-NE 3.13Å; S11-R13 PolarHBondContact OG-NH2 2.79Å; R13-L502 WeakPolarHBondContact CD-O 3.19Å; R13-L502 VanDerWaalsContact CZ-O 3.25Å; R13-L502 PolarHBondContact NE-O 2.96Å; R13-L502 PolarHBondContact NH1-O 2.82Å; R13-T503 PolarHBondContact NH1-O 2.78Å; R13-T503 PolarHBondContact NH2-O 2.87Å; R13-S504 PolarHBondContact NH1-O 2.93Å; R13-S504 VanDerWaalsContact NH1-O 3.16Å; R13-G505 VanDerWaalsContact NH1-N 3.1Å; R13-V820 HydrophobicContact CG-CB 4.18Å; R13-V820 HydrophobicContact CG-CG2 4.3Å; R13-V820 PolarHBondContact N-O 3.05Å; R13-V820 PolarHBondContact O-N 3.38Å
14	T	89.9	Confident	76.2	Confident	7 Å²	7	54.7 Å²	54.7	4%	0.043	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	120.7	173.4	-61.4	0	0	0	0	109.5	T16 L42 V56 E58 C817 R819 A828	T14-T16 HydrophobicContact CG2-CG2 4.28Å; T14-L42 HydrophobicContact CG2-CD1 3.92Å; T14-V56 HydrophobicContact CG2-CG1 4.4Å; T14-E58 PolarHBondContact OG1-OE1 3.35Å; T14-C817 HydrophobicContact CG2-CB 4Å; T14-R819 HydrophobicContact CG2-CG 3.84Å; T14-A828 VanDerWaalsContact OG1-CB 3.3Å; T14-A828 WeakPolarHBondContact OG1-CB 3.36Å
15	L	90	Very high	78.8	Confident	15 Å²	15	46.4 Å²	46.4	8%	0.079	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	119.5	168.1	-55.1	178.2	0	0	0	107.9	L463 Y500 L502 C817 I818	L15-L463 HydrophobicContact CB-CD1 3.99Å; L15-Y500 HydrophobicContact CD1-CD1 3.96Å; L15-Y500 HydrophobicContact CD1-CG 3.98Å; L15-L502 HydrophobicContact CD1-CD2 4.09Å; L15-C817 CarbonylContact O-C 3.54Å; L15-C817 VanDerWaalsContact O-CA 3.27Å; L15-C817 WeakPolarHBondContact O-CA 3.37Å; L15-I818 HydrophobicContact CB-CB 4.27Å; L15-I818 HydrophobicContact CD1-CB 4.45Å; L15-I818 PolarHBondContact N-O 2.91Å; L15-I818 PolarHBondContact O-N 2.95Å
16	T	90.3	Very high	81.7	Confident	11 Å²	11	41.6 Å²	41.6	7%	0.067	23%	0.227	C	C	.	.			trans	-93.4	158.3	-176.8	54.8	0	0	0	0	113	T14 Y37 C39 L42 V44 L463	T14-T16 HydrophobicContact CG2-CG2 4.28Å; T16-Y37 PolarHBondContact OG1-OH 3.04Å; T16-C39 HydrophobicContact CG2-CB 4.32Å; T16-L42 HydrophobicContact CG2-CD1 4.15Å; T16-V44 HydrophobicContact CG2-CG2 3.55Å; T16-L463 PolarHBondContact O-N 2.89Å; T16-L463 VanDerWaalsContact O-N 3.11Å
17	G	86.1	Confident	84.3	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-130.6	-152.5	-175.8	0	0	0	0	0	115.1	G378 L463 G816	G17-G378 WeakPolarHBondContact O-CA 3.5Å; G17-L463 CarbonylContact C-O 3.43Å; G17-L463 WeakPolarHBondContact CA-O 3.32Å; G17-G816 WeakPolarHBondContact CA-O 3.37Å
18	A	88.6	Confident	86.7	Confident	17 Å²	17	33.6 Å²	33.6	14%	0.14	18%	0.182	C	C	.	.	S	Bend	trans	-47.1	139.7	177.6	0	0	0	0	0	111.6	H40 S376 L463 A465	A18-H40 PolarHBondContact O-CD2 3.45Å; A18-H40 PolarHBondContact O-NE2 3.4Å; A18-S376 WeakPolarHBondContact CA-O 3.27Å; A18-L463 PolarHBondContact N-O 3.07Å; A18-A465 HydrophobicContact CB-CB 4.41Å
19	L	91.1	Very high	88.3	Confident	16 Å²	16	30.9 Å²	30.9	8%	0.084	17%	0.17	C	C	.	.	P	Polyproline II helix	trans	-93.4	147.3	-172.1	-54.2	-178.6	0	0	0	111	Y37 C39 F359 I374 V375 S376	L19-Y37 HydrophobicContact CD2-CD2 4.28Å; L19-Y37 HydrophobicContact CD2-CE2 3.95Å; L19-C39 HydrophobicContact CD2-CB 3.71Å; L19-F359 HydrophobicContact CB-CD2 4.02Å; L19-F359 HydrophobicContact CB-CE2 3.51Å; L19-F359 HydrophobicContact CB-CZ 4.46Å; L19-F359 HydrophobicContact CD1-CD2 3.89Å; L19-F359 HydrophobicContact CD1-CE2 4.26Å; L19-I374 HydrophobicContact CD1-CG2 3.31Å; L19-V375 WeakPolarHBondContact CD1-O 3.39Å; L19-S376 PolarHBondContact N-O 2.94Å
20	N	91.3	Very high	89.5	Confident	41 Å²	41	25.5 Å²	25.5	22%	0.219	15%	0.147	C	C	.	.	P	Polyproline II helix	trans	-72.8	146.9	170.8	-164.9	-44.1	0	0	0	109.9	H22 N23 D63 F359	N20-H22 PolarHBondContact O-N 3.08Å; N20-H22 VanDerWaalsContact O-N 3.14Å; N20-H22 PolarHBondContact OD1-CD2 3.13Å; N20-H22 PolarHBondContact OD1-N 2.89Å; N20-H22 VanDerWaalsContact OD1-N 3.15Å; N20-N23 VanDerWaalsContact CB-OD1 3.31Å; N20-N23 WeakPolarHBondContact CB-OD1 3.38Å; N20-N23 PolarHBondContact N-OD1 3.37Å; N20-N23 WeakPolarHBondContact O-CB 3.43Å; N20-N23 PolarHBondContact O-N 3.47Å; N20-N23 PolarHBondContact O-OD1 2.95Å; N20-D63 PolarHBondContact ND2-OD1 2.65Å; N20-D63 PolarHBondContact ND2-OD2 3.16Å; N20-F359 VanDerWaalsContact O-CE2 3.26Å; N20-F359 WeakPolarHBondContact O-CE2 3.34Å
21	A	90.1	Very high	90.1	Very high	53 Å²	53	26.6 Å²	26.6	44%	0.438	15%	0.151	S	C	.	.	G	3₁₀ helix	trans	-55.7	-29.6	174.4	0	0	0	0	0	113.1	N23 K24	A21-N23 PolarHBondContact O-N 2.62Å; A21-K24 WeakPolarHBondContact O-CB 3.24Å; A21-K24 PolarHBondContact O-N 3.16Å
22	H	91.5	Very high	90.5	Very high	101 Å²	101	25.9 Å²	25.9	47%	0.468	14%	0.144	S	C	.	.	G	3₁₀ helix	trans	-65.9	-23.5	174.5	-69.6	-59.1	0	0	0	113.8	N20 K24 D63 V91	N20-H22 PolarHBondContact O-N 3.08Å; N20-H22 VanDerWaalsContact O-N 3.14Å; N20-H22 PolarHBondContact OD1-CD2 3.13Å; N20-H22 PolarHBondContact OD1-N 2.89Å; N20-H22 VanDerWaalsContact OD1-N 3.15Å; H22-K24 PolarHBondContact O-N 3.32Å; H22-D63 HydrophobicContact CB-CB 4Å; H22-D63 IonicContact CD2-OD2 2.71Å; H22-V91 HydrophobicContact CB-CG2 4.11Å
23	N	92.1	Very high	90.7	Very high	5 Å²	5	25.9 Å²	25.9	3%	0.027	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-78.1	-0.1	178.7	-54.3	131.2	0	0	0	113.5	N20 A21 A25 A26 G38 H40 V64	N20-N23 VanDerWaalsContact CB-OD1 3.31Å; N20-N23 WeakPolarHBondContact CB-OD1 3.38Å; N20-N23 PolarHBondContact N-OD1 3.37Å; N20-N23 WeakPolarHBondContact O-CB 3.43Å; N20-N23 PolarHBondContact O-N 3.47Å; N20-N23 PolarHBondContact O-OD1 2.95Å; A21-N23 PolarHBondContact O-N 2.62Å; N23-A25 PolarHBondContact O-N 3.4Å; N23-A26 HydrophobicContact CB-CB 4.34Å; N23-A26 WeakPolarHBondContact O-CB 3.48Å; N23-A26 PolarHBondContact O-N 3.34Å; N23-G38 WeakPolarHBondContact CB-O 3.15Å; N23-H40 PolarHBondContact ND2-O 3Å; N23-H40 PolarHBondContact OD1-N 2.87Å; N23-V64 WeakPolarHBondContact CA-O 3.41Å; N23-V64 PolarHBondContact ND2-O 3.17Å
24	K	90.8	Very high	91	Very high	95 Å²	95	24.6 Å²	24.6	41%	0.413	14%	0.142	S	C	.	.	G	3₁₀ helix	trans	-50.5	-39.6	-172.7	-175.7	-176.4	175.8	-170.5	0	113.6	A21 H22 F359 S360	A21-K24 WeakPolarHBondContact O-CB 3.24Å; A21-K24 PolarHBondContact O-N 3.16Å; H22-K24 PolarHBondContact O-N 3.32Å; K24-F359 HydrophobicContact CB-CG 4.41Å; K24-F359 HydrophobicContact CG-CB 4.24Å; K24-F359 HydrophobicContact CG-CG 4.34Å; K24-F359 WeakPolarHBondContact CG-O 3.44Å; K24-S360 VanDerWaalsContact O-CB 3.23Å; K24-S360 WeakPolarHBondContact O-CB 3.41Å
25	A	88.9	Confident	91.3	Very high	42 Å²	42	24.3 Å²	24.3	35%	0.347	14%	0.14	S	C	.	.	G	3₁₀ helix	trans	-102.9	6.3	-179.1	0	0	0	0	0	113.7	N23 V27 V65 K66	N23-A25 PolarHBondContact O-N 3.4Å; A25-V27 VanDerWaalsContact C-N 3.28Å; A25-V27 PolarHBondContact O-N 3.16Å; A25-V27 VanDerWaalsContact O-N 3.09Å; A25-V65 CarbonylContact C-O 3.57Å; A25-K66 HydrophobicContact CB-CD 4.16Å
26	A	94.3	Very high	91.6	Very high	1 Å²	1	23.6 Å²	23.6	1%	0.008	14%	0.136	C	C	.	.			trans	-87.2	63.4	-176.6	0	0	0	0	0	110.5	N23 Y37 G38 V64 V65 V67	N23-A26 HydrophobicContact CB-CB 4.34Å; N23-A26 WeakPolarHBondContact O-CB 3.48Å; N23-A26 PolarHBondContact O-N 3.34Å; A26-Y37 CarbonylContact O-C 3.57Å; A26-Y37 WeakPolarHBondContact O-CA 3.44Å; A26-G38 PolarHBondContact O-N 3.02Å; A26-V64 HydrophobicContact CB-CG1 4.14Å; A26-V65 WeakPolarHBondContact CA-O 3.36Å; A26-V65 WeakPolarHBondContact CB-O 3.34Å; A26-V65 PolarHBondContact N-O 3.1Å; A26-V67 HydrophobicContact CB-CG2 4.18Å
27	V	95.4	Very high	91.9	Very high	8 Å²	8	23.1 Å²	23.1	5%	0.048	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	143.2	175.6	57	0	0	0	0	111.1	A25 I35 A36 S360 V362 I374	A25-V27 VanDerWaalsContact C-N 3.28Å; A25-V27 PolarHBondContact O-N 3.16Å; A25-V27 VanDerWaalsContact O-N 3.09Å; V27-I35 HydrophobicContact CG2-CG2 4.34Å; V27-A36 VanDerWaalsContact CA-O 3.32Å; V27-A36 WeakPolarHBondContact CA-O 3.2Å; V27-S360 VanDerWaalsContact CG1-OG 3.26Å; V27-S360 WeakPolarHBondContact CG1-OG 3.5Å; V27-V362 HydrophobicContact CB-CG1 4.22Å; V27-V362 HydrophobicContact CG1-CG1 3.74Å; V27-V362 HydrophobicContact CG2-CB 4.3Å; V27-V362 HydrophobicContact CG2-CG1 3.56Å; V27-V362 HydrophobicContact CG2-CG2 3.72Å; V27-I374 HydrophobicContact CB-CD1 3.45Å; V27-I374 VanDerWaalsContact CB-CD1 3.45Å; V27-I374 HydrophobicContact CG1-CD1 4.03Å; V27-I374 HydrophobicContact CG2-CD1 3.12Å
28	D	95.9	Very high	92.3	Very high	26 Å²	26	23.2 Å²	23.2	14%	0.139	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	147.9	166.5	-150.8	42	0	0	0	112.2	A36 V67 K68 W69	D28-A36 PolarHBondContact N-O 2.74Å; D28-A36 PolarHBondContact O-N 3.49Å; D28-V67 WeakPolarHBondContact CB-O 3.35Å; D28-K68 HydrophobicContact CB-CD 4.18Å; D28-K68 VanDerWaalsContact CG-CD 3.49Å; D28-K68 WeakPolarHBondContact OD1-CD 3.49Å; D28-K68 IonicContact OD1-NZ 3.34Å; D28-K68 PolarHBondContact OD1-NZ 3.47Å; D28-K68 WeakPolarHBondContact OD2-CA 3.26Å; D28-K68 WeakPolarHBondContact OD2-CD 3.46Å; D28-W69 PolarHBondContact OD2-N 2.99Å
29	W	95.1	Very high	92.4	Very high	15 Å²	15	22.4 Å²	22.4	6%	0.057	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	115.5	169.8	-164.2	-29.5	0	0	0	108.2	I35 V362 C364 A370 A372 I382	W29-I35 HydrophobicContact CB-CG1 4.28Å; W29-I35 HydrophobicContact CD2-CD1 3.96Å; W29-I35 HydrophobicContact CD2-CG1 3.56Å; W29-I35 HydrophobicContact CE3-CD1 3.9Å; W29-I35 HydrophobicContact CE3-CG1 3.93Å; W29-I35 HydrophobicContact CG-CG1 3.73Å; W29-I35 HydrophobicContact CH2-CD1 4.11Å; W29-I35 HydrophobicContact CZ2-CD1 4.2Å; W29-I35 HydrophobicContact CZ2-CG1 4.42Å; W29-I35 HydrophobicContact CZ3-CD1 3.97Å; W29-I35 HydrophobicContact CZ3-CG1 4.48Å; W29-V362 HydrophobicContact CB-CB 4.07Å; W29-V362 HydrophobicContact CB-CG2 4.02Å; W29-V362 HydrophobicContact CE3-CG2 4.1Å; W29-C364 HydrophobicContact CD2-CB 4.19Å; W29-C364 HydrophobicContact CE3-CB 4.43Å; W29-C364 HydrophobicContact CH2-CB 4.08Å; W29-C364 HydrophobicContact CZ2-CB 3.77Å; W29-C364 HydrophobicContact CZ3-CB 4.38Å; W29-A370 HydrophobicContact CH2-CB 3.72Å; W29-A370 HydrophobicContact CZ3-CB 4.32Å; W29-A372 HydrophobicContact CE3-CB 4.14Å; W29-A372 HydrophobicContact CZ3-CB 3.86Å; W29-I382 HydrophobicContact CH2-CG2 4.3Å
30	G	91.6	Very high	92.4	Very high	2 Å²	2	23.4 Å²	23.4	2%	0.021	13%	0.132	C	C	.	.			trans	-81.5	160.2	-177.5	0	0	0	0	0	113.6	Q32 G33 L34	G30-Q32 PolarHBondContact O-N 3.34Å; G30-G33 PolarHBondContact O-N 3.4Å; G30-G33 VanDerWaalsContact O-N 3.14Å; G30-L34 PolarHBondContact N-O 3.2Å
31	W	88.8	Confident	92.5	Very high	27 Å²	27	22 Å²	22	10%	0.102	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-29.3	177.6	-78.8	76.1	0	0	0	112.9	G33 P365 V366 G921 E923 L926	W31-G33 PolarHBondContact O-N 3.33Å; W31-G33 VanDerWaalsContact O-N 3.1Å; W31-P365 HydrophobicContact CD2-CB 4.38Å; W31-P365 HydrophobicContact CD2-CG 4.32Å; W31-P365 HydrophobicContact CG-CG 4.11Å; W31-P365 HydrophobicContact CZ2-CB 4.26Å; W31-V366 HydrophobicContact CB-CG2 4.44Å; W31-V366 HydrophobicContact CD2-CG2 4.24Å; W31-V366 HydrophobicContact CE3-CG2 3.69Å; W31-V366 HydrophobicContact CZ3-CG2 4.25Å; W31-V366 VanDerWaalsContact O-CG2 3.3Å; W31-V366 WeakPolarHBondContact O-CG2 3.13Å; W31-G921 WeakPolarHBondContact CB-O 3.41Å; W31-G921 VanDerWaalsContact O-CA 3.31Å; W31-G921 WeakPolarHBondContact O-CA 3.26Å; W31-E923 HydrophobicContact CD2-CB 4.11Å; W31-E923 HydrophobicContact CE3-CB 3.77Å; W31-E923 HydrophobicContact CE3-CG 4.34Å; W31-E923 HydrophobicContact CH2-CB 3.86Å; W31-E923 HydrophobicContact CH2-CG 3.48Å; W31-E923 VanDerWaalsContact CH2-CG 3.48Å; W31-E923 HydrophobicContact CZ2-CB 4.14Å; W31-E923 VanDerWaalsContact CZ2-CD 3.43Å; W31-E923 HydrophobicContact CZ2-CG 3.71Å; W31-E923 HydrophobicContact CZ3-CB 3.65Å; W31-E923 HydrophobicContact CZ3-CG 3.82Å; W31-L926 HydrophobicContact CZ3-CD2 4.1Å
32	Q	87.9	Confident	92.6	Very high	12 Å²	12	19.6 Å²	19.6	6%	0.056	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-4.1	174.1	71.7	-83.8	19.5	0	0	115.1	G30 L34 L84 Y845	G30-Q32 PolarHBondContact O-N 3.34Å; Q32-L34 HydrophobicContact CG-CB 4.05Å; Q32-L34 HydrophobicContact CG-CD1 4.17Å; Q32-L34 HydrophobicContact CG-CG 3.94Å; Q32-L84 HydrophobicContact CB-CD2 4.09Å; Q32-L84 HydrophobicContact CG-CD2 3.63Å; Q32-Y845 HydrophobicContact CB-CD1 4.35Å; Q32-Y845 HydrophobicContact CB-CD2 3.73Å; Q32-Y845 HydrophobicContact CB-CE1 4.25Å; Q32-Y845 HydrophobicContact CB-CE2 3.64Å; Q32-Y845 HydrophobicContact CB-CG 4.13Å
33	G	89.1	Confident	92.8	Very high	21 Å²	21	14.8 Å²	14.8	22%	0.216	8%	0.082	C	C	.	.	S	Bend	trans	89.5	7.1	178.6	0	0	0	0	0	115.9	G30 W31 S48	G30-G33 PolarHBondContact O-N 3.4Å; G30-G33 VanDerWaalsContact O-N 3.14Å; W31-G33 PolarHBondContact O-N 3.33Å; W31-G33 VanDerWaalsContact O-N 3.1Å; G33-S48 VanDerWaalsContact O-CB 3.31Å; G33-S48 WeakPolarHBondContact O-CB 3.45Å; G33-S48 PolarHBondContact O-OG 3.45Å
34	L	93.3	Very high	92.9	Very high	2 Å²	2	14.6 Å²	14.6	1%	0.01	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	146.8	178.5	-59.3	-179.7	0	0	0	111.8	G30 Q32 V45 L54 W69 L84	G30-L34 PolarHBondContact N-O 3.2Å; Q32-L34 HydrophobicContact CG-CB 4.05Å; Q32-L34 HydrophobicContact CG-CD1 4.17Å; Q32-L34 HydrophobicContact CG-CG 3.94Å; L34-V45 HydrophobicContact CB-CG1 4.29Å; L34-V45 HydrophobicContact CD1-CG1 4.14Å; L34-L54 HydrophobicContact CD1-CD1 4.32Å; L34-L54 HydrophobicContact CD2-CD1 3.52Å; L34-W69 HydrophobicContact CB-CZ2 4.1Å; L34-W69 HydrophobicContact CD1-CH2 4.5Å; L34-L84 HydrophobicContact CD1-CD1 3.9Å; L34-L84 HydrophobicContact CD1-CD2 4.12Å
35	I	95.6	Very high	93	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	133.3	174.7	-60.9	159	0	0	0	108.2	V27 W29 V45 I46 V362 A372 I382	V27-I35 HydrophobicContact CG2-CG2 4.34Å; W29-I35 HydrophobicContact CB-CG1 4.28Å; W29-I35 HydrophobicContact CD2-CD1 3.96Å; W29-I35 HydrophobicContact CD2-CG1 3.56Å; W29-I35 HydrophobicContact CE3-CD1 3.9Å; W29-I35 HydrophobicContact CE3-CG1 3.93Å; W29-I35 HydrophobicContact CG-CG1 3.73Å; W29-I35 HydrophobicContact CH2-CD1 4.11Å; W29-I35 HydrophobicContact CZ2-CD1 4.2Å; W29-I35 HydrophobicContact CZ2-CG1 4.42Å; W29-I35 HydrophobicContact CZ3-CD1 3.97Å; W29-I35 HydrophobicContact CZ3-CG1 4.48Å; I35-V45 WeakPolarHBondContact O-CA 3.44Å; I35-I46 HydrophobicContact CB-CD1 4Å; I35-I46 HydrophobicContact CB-CG1 3.61Å; I35-I46 HydrophobicContact CD1-CD1 4.24Å; I35-I46 HydrophobicContact CD1-CG1 4.44Å; I35-I46 HydrophobicContact CG2-CD1 4.07Å; I35-I46 HydrophobicContact CG2-CG1 4.09Å; I35-I46 PolarHBondContact N-O 3.49Å; I35-I46 PolarHBondContact O-N 3.3Å; I35-V362 HydrophobicContact CG2-CG2 4.43Å; I35-A372 HydrophobicContact CD1-CB 3.62Å; I35-I382 HydrophobicContact CD1-CD1 4.19Å
36	A	96.1	Very high	93.2	Very high	0 Å²	0	8.1 Å²	8.1	0%	0	5%	0.045	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	136	172.9	0	0	0	0	0	110.3	V27 D28 V43 V44 V45 V67 W69 L86	V27-A36 VanDerWaalsContact CA-O 3.32Å; V27-A36 WeakPolarHBondContact CA-O 3.2Å; D28-A36 PolarHBondContact N-O 2.74Å; D28-A36 PolarHBondContact O-N 3.49Å; A36-V43 HydrophobicContact CB-CG1 4.44Å; A36-V44 CarbonylContact C-O 3.56Å; A36-V44 VanDerWaalsContact CA-O 3.27Å; A36-V44 WeakPolarHBondContact CA-O 3.38Å; A36-V45 HydrophobicContact CB-CG2 4.21Å; A36-V67 HydrophobicContact CB-CG1 3.69Å; A36-W69 HydrophobicContact CB-CZ2 3.77Å; A36-L86 HydrophobicContact CB-CD1 4.09Å; A36-L86 HydrophobicContact CB-CD2 3.88Å
37	Y	95.7	Very high	93.1	Very high	2 Å²	2	8.2 Å²	8.2	1%	0.008	5%	0.046	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	154.9	175.3	72.4	-87	0	0	0	113.1	T16 L19 A26 C39 V44 I46 I374 V380	T16-Y37 PolarHBondContact OG1-OH 3.04Å; L19-Y37 HydrophobicContact CD2-CD2 4.28Å; L19-Y37 HydrophobicContact CD2-CE2 3.95Å; A26-Y37 CarbonylContact O-C 3.57Å; A26-Y37 WeakPolarHBondContact O-CA 3.44Å; Y37-C39 HydrophobicContact CE2-CB 4.18Å; Y37-V44 HydrophobicContact CD1-CB 4.13Å; Y37-V44 HydrophobicContact CE1-CB 3.67Å; Y37-V44 HydrophobicContact CE1-CG1 3.72Å; Y37-V44 HydrophobicContact CE1-CG2 4.48Å; Y37-V44 HydrophobicContact CE2-CB 4.09Å; Y37-V44 HydrophobicContact CE2-CG2 4.07Å; Y37-V44 PolarHBondContact N-O 3.48Å; Y37-V44 PolarHBondContact O-N 2.99Å; Y37-I46 HydrophobicContact CE1-CD1 4.48Å; Y37-I46 HydrophobicContact CE1-CG2 3.87Å; Y37-I374 HydrophobicContact CG-CD1 4.34Å; Y37-V380 HydrophobicContact CD1-CG2 4.36Å; Y37-V380 HydrophobicContact CE1-CG2 3.86Å
38	G	94.3	Very high	92.8	Very high	1 Å²	1	8.7 Å²	8.7	1%	0.01	5%	0.049	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	132.8	175.8	0	0	0	0	0	112.3	N23 A26 L42	N23-G38 WeakPolarHBondContact CB-O 3.15Å; A26-G38 PolarHBondContact O-N 3.02Å; G38-L42 CarbonylContact C-O 3.26Å; G38-L42 WeakPolarHBondContact CA-O 3.48Å
39	C	91.8	Very high	92.3	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	105.6	169.6	178.3	0	0	0	0	108.5	T16 L19 Y37 S41 L42 V44	T16-C39 HydrophobicContact CG2-CB 4.32Å; L19-C39 HydrophobicContact CD2-CB 3.71Å; Y37-C39 HydrophobicContact CE2-CB 4.18Å; C39-S41 PolarHBondContact O-N 3.48Å; C39-S41 VanDerWaalsContact O-N 3.15Å; C39-L42 PolarHBondContact N-O 2.69Å; C39-L42 WeakPolarHBondContact O-CA 3.13Å; C39-L42 VanDerWaalsContact O-CB 3.31Å; C39-L42 WeakPolarHBondContact O-CB 3.4Å; C39-L42 PolarHBondContact O-N 2.61Å; C39-V44 HydrophobicContact CB-CG2 4.05Å
40	H	92.1	Very high	91.8	Very high	38 Å²	38	13.8 Å²	13.8	18%	0.176	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.7	-119.5	-168	-70.6	-86.2	0	0	0	110.5	A18 N23 D63 V64 D815	A18-H40 PolarHBondContact O-CD2 3.45Å; A18-H40 PolarHBondContact O-NE2 3.4Å; N23-H40 PolarHBondContact ND2-O 3Å; N23-H40 PolarHBondContact OD1-N 2.87Å; H40-D63 VanDerWaalsContact CA-OD1 3.32Å; H40-D63 WeakPolarHBondContact CA-OD1 3.43Å; H40-D63 IonicContact ND1-OD1 2.84Å; H40-D63 CarbonylContact O-C 3.59Å; H40-D63 VanDerWaalsContact O-CA 3.25Å; H40-D63 WeakPolarHBondContact O-CA 3.5Å; H40-V64 PolarHBondContact O-N 2.97Å; H40-D815 HydrophobicContact CB-CB 4.41Å; H40-D815 PolarHBondContact CD2-O 3.39Å; H40-D815 PolarHBondContact NE2-O 3.14Å
41	S	91.8	Very high	91.5	Very high	10 Å²	10	13.9 Å²	13.9	7%	0.07	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91	4.7	177	62.1	0	0	0	0	114.2	C39 H60 A62	C39-S41 PolarHBondContact O-N 3.48Å; C39-S41 VanDerWaalsContact O-N 3.15Å; S41-H60 WeakPolarHBondContact O-CB 3.5Å; S41-A62 WeakPolarHBondContact CA-O 3.45Å; S41-A62 VanDerWaalsContact CB-O 3.27Å; S41-A62 WeakPolarHBondContact CB-O 3.41Å
42	L	92.9	Very high	91.4	Very high	4 Å²	4	13 Å²	13	2%	0.021	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	151.3	-178	-45.8	175.9	0	0	0	110	T14 T16 G38 C39 V56 E58	T14-L42 HydrophobicContact CG2-CD1 3.92Å; T16-L42 HydrophobicContact CG2-CD1 4.15Å; G38-L42 CarbonylContact C-O 3.26Å; G38-L42 WeakPolarHBondContact CA-O 3.48Å; C39-L42 PolarHBondContact N-O 2.69Å; C39-L42 WeakPolarHBondContact O-CA 3.13Å; C39-L42 VanDerWaalsContact O-CB 3.31Å; C39-L42 WeakPolarHBondContact O-CB 3.4Å; C39-L42 PolarHBondContact O-N 2.61Å; L42-V56 HydrophobicContact CB-CG1 3.97Å; L42-V56 HydrophobicContact CD1-CG1 4.06Å; L42-V56 HydrophobicContact CG-CG1 4.45Å; L42-E58 HydrophobicContact CD2-CB 4.06Å; L42-E58 HydrophobicContact CD2-CG 3.82Å
43	V	95	Very high	91.4	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	121.6	166.7	-176.1	0	0	0	0	108.1	A36 V56 L57 V64 V67 L86	A36-V43 HydrophobicContact CB-CG1 4.44Å; V43-V56 WeakPolarHBondContact O-CA 3.42Å; V43-L57 HydrophobicContact CB-CB 4.18Å; V43-L57 HydrophobicContact CB-CD1 4.37Å; V43-L57 HydrophobicContact CG1-CD1 4.46Å; V43-L57 PolarHBondContact N-O 3.14Å; V43-L57 VanDerWaalsContact N-O 3.13Å; V43-L57 PolarHBondContact O-N 2.74Å; V43-V64 HydrophobicContact CG2-CG1 4.24Å; V43-V64 HydrophobicContact CG2-CG2 4.01Å; V43-V67 HydrophobicContact CG1-CG1 4.22Å; V43-V67 HydrophobicContact CG1-CG2 4.18Å; V43-V67 HydrophobicContact CG2-CG2 4.38Å; V43-L86 HydrophobicContact CG1-CD2 3.7Å
44	V	94.1	Very high	91.4	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	128.7	-177.7	-173.1	0	0	0	0	108.6	T16 A36 Y37 C39 I46 T53 V56	T16-V44 HydrophobicContact CG2-CG2 3.55Å; A36-V44 CarbonylContact C-O 3.56Å; A36-V44 VanDerWaalsContact CA-O 3.27Å; A36-V44 WeakPolarHBondContact CA-O 3.38Å; Y37-V44 HydrophobicContact CD1-CB 4.13Å; Y37-V44 HydrophobicContact CE1-CB 3.67Å; Y37-V44 HydrophobicContact CE1-CG1 3.72Å; Y37-V44 HydrophobicContact CE1-CG2 4.48Å; Y37-V44 HydrophobicContact CE2-CB 4.09Å; Y37-V44 HydrophobicContact CE2-CG2 4.07Å; Y37-V44 PolarHBondContact N-O 3.48Å; Y37-V44 PolarHBondContact O-N 2.99Å; C39-V44 HydrophobicContact CB-CG2 4.05Å; V44-I46 HydrophobicContact CG1-CG2 3.93Å; V44-T53 HydrophobicContact CG1-CG2 3.68Å; V44-V56 HydrophobicContact CG1-CG2 4.44Å
45	V	94.4	Very high	91.2	Very high	1 Å²	1	13.8 Å²	13.8	1%	0.006	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	125.3	174.9	-179.2	0	0	0	0	108.8	L34 I35 A36 L54 Q55 W69 V100	L34-V45 HydrophobicContact CB-CG1 4.29Å; L34-V45 HydrophobicContact CD1-CG1 4.14Å; I35-V45 WeakPolarHBondContact O-CA 3.44Å; A36-V45 HydrophobicContact CB-CG2 4.21Å; V45-L54 PolarHBondContact O-N 3.04Å; V45-Q55 HydrophobicContact CB-CB 4.4Å; V45-Q55 PolarHBondContact N-O 3.07Å; V45-Q55 PolarHBondContact O-N 3.34Å; V45-W69 HydrophobicContact CG1-CH2 4.29Å; V45-W69 HydrophobicContact CG1-CZ2 4.02Å; V45-W69 HydrophobicContact CG2-CH2 4.4Å; V45-W69 HydrophobicContact CG2-CZ2 4.22Å; V45-V100 HydrophobicContact CB-CG1 4.41Å; V45-V100 HydrophobicContact CG1-CG1 4.32Å; V45-V100 HydrophobicContact CG2-CG1 3.88Å
46	I	92.6	Very high	91	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	148.6	-178.2	69.9	176.2	0	0	0	110.2	I35 Y37 V44 Q52 V380 L460	I35-I46 HydrophobicContact CB-CD1 4Å; I35-I46 HydrophobicContact CB-CG1 3.61Å; I35-I46 HydrophobicContact CD1-CD1 4.24Å; I35-I46 HydrophobicContact CD1-CG1 4.44Å; I35-I46 HydrophobicContact CG2-CD1 4.07Å; I35-I46 HydrophobicContact CG2-CG1 4.09Å; I35-I46 PolarHBondContact N-O 3.49Å; I35-I46 PolarHBondContact O-N 3.3Å; Y37-I46 HydrophobicContact CE1-CD1 4.48Å; Y37-I46 HydrophobicContact CE1-CG2 3.87Å; V44-I46 HydrophobicContact CG1-CG2 3.93Å; I46-Q52 WeakPolarHBondContact CA-O 3.49Å; I46-V380 HydrophobicContact CD1-CB 4.2Å; I46-V380 HydrophobicContact CD1-CG1 3.68Å; I46-V380 HydrophobicContact CD1-CG2 4.36Å; I46-L460 HydrophobicContact CG2-CD2 3.82Å
47	D	91.3	Very high	90.8	Very high	3 Å²	3	14.2 Å²	14.2	2%	0.016	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	140.1	167.2	-179.7	35.6	0	0	0	110.4	I49 T50 A51 Q52 L54 V841	D47-I49 PolarHBondContact OD1-N 3.31Å; D47-I49 PolarHBondContact OD2-N 2.9Å; D47-T50 PolarHBondContact OD2-N 2.93Å; D47-T50 PolarHBondContact OD2-OG1 3.08Å; D47-T50 VanDerWaalsContact OD2-OG1 3.07Å; D47-A51 VanDerWaalsContact O-CA 3.29Å; D47-A51 WeakPolarHBondContact O-CA 3.31Å; D47-A51 PolarHBondContact O-N 3.08Å; D47-Q52 PolarHBondContact N-O 2.87Å; D47-L54 HydrophobicContact CB-CD1 4.17Å; D47-L54 HydrophobicContact CB-CD2 4.3Å; D47-L54 HydrophobicContact CB-CG 4.29Å; D47-V841 HydrophobicContact CB-CG1 4.07Å; D47-V841 HydrophobicContact CB-CG2 4.2Å; D47-V841 VanDerWaalsContact CG-CG1 3.49Å
48	S	88.6	Confident	90.5	Very high	18 Å²	18	16 Å²	16	13%	0.126	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-21.4	179.8	62.2	0	0	0	0	113.7	G33 I382	G33-S48 VanDerWaalsContact O-CB 3.31Å; G33-S48 WeakPolarHBondContact O-CB 3.45Å; G33-S48 PolarHBondContact O-OG 3.45Å; S48-I382 WeakPolarHBondContact O-CD1 3.49Å
49	I	85.8	Confident	90.2	Very high	112 Å²	112	20.1 Å²	20.1	57%	0.574	11%	0.106	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-53.4	-176.3	-58.3	175	0	0	0	110.6	D47	D47-I49 PolarHBondContact OD1-N 3.31Å; D47-I49 PolarHBondContact OD2-N 2.9Å
50	T	84.3	Confident	90.2	Very high	36 Å²	36	20.5 Å²	20.5	22%	0.221	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-9.2	-177.9	67.7	0	0	0	0	113.5	D47 Q52 E839	D47-T50 PolarHBondContact OD2-N 2.93Å; D47-T50 PolarHBondContact OD2-OG1 3.08Å; D47-T50 VanDerWaalsContact OD2-OG1 3.07Å; T50-Q52 PolarHBondContact O-N 2.86Å; T50-Q52 VanDerWaalsContact O-N 3.11Å; T50-Q52 WeakPolarHBondContact OG1-CG 3.42Å; T50-Q52 PolarHBondContact OG1-N 3.1Å; T50-Q52 PolarHBondContact OG1-NE2 3.15Å; T50-Q52 VanDerWaalsContact OG1-NE2 3.14Å; T50-E839 HydrophobicContact CG2-CB 4.13Å; T50-E839 WeakPolarHBondContact CG2-OE2 3.45Å
51	A	86.8	Confident	90	Very high	5 Å²	5	26.1 Å²	26.1	4%	0.041	13%	0.131	C	C	.	.			trans	55.4	21.1	-173.5	0	0	0	0	0	114.2	D47 I382	D47-A51 VanDerWaalsContact O-CA 3.29Å; D47-A51 WeakPolarHBondContact O-CA 3.31Å; D47-A51 PolarHBondContact O-N 3.08Å; A51-I382 HydrophobicContact CB-CD1 4.12Å
52	Q	86.6	Confident	90	Very high	7 Å²	7	26.3 Å²	26.3	3%	0.033	13%	0.134	C	C	.	.			trans	-86.2	147	177.2	81.7	-169	-40.1	0	0	111.7	I46 D47 T50 L54 T838 E839	I46-Q52 WeakPolarHBondContact CA-O 3.49Å; D47-Q52 PolarHBondContact N-O 2.87Å; T50-Q52 PolarHBondContact O-N 2.86Å; T50-Q52 VanDerWaalsContact O-N 3.11Å; T50-Q52 WeakPolarHBondContact OG1-CG 3.42Å; T50-Q52 PolarHBondContact OG1-N 3.1Å; T50-Q52 PolarHBondContact OG1-NE2 3.15Å; T50-Q52 VanDerWaalsContact OG1-NE2 3.14Å; Q52-L54 HydrophobicContact CG-CD2 3.83Å; Q52-L54 PolarHBondContact O-N 3.16Å; Q52-T838 PolarHBondContact OE1-OG1 3.09Å; Q52-E839 PolarHBondContact NE2-O 3.11Å
53	T	88.4	Confident	90	Very high	46 Å²	46	27.9 Å²	27.9	28%	0.282	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	119.1	172.6	-53.2	0	0	0	0	110	V44 V56	V44-T53 HydrophobicContact CG1-CG2 3.68Å; T53-V56 HydrophobicContact CG2-CG2 3.94Å
54	L	88.5	Confident	90	Very high	5 Å²	5	27.9 Å²	27.9	3%	0.026	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	-49.2	178	-58.3	-177.3	0	0	0	110.8	L34 V45 D47 Q52 M832 Q835 L837 V841	L34-L54 HydrophobicContact CD1-CD1 4.32Å; L34-L54 HydrophobicContact CD2-CD1 3.52Å; V45-L54 PolarHBondContact O-N 3.04Å; D47-L54 HydrophobicContact CB-CD1 4.17Å; D47-L54 HydrophobicContact CB-CD2 4.3Å; D47-L54 HydrophobicContact CB-CG 4.29Å; Q52-L54 HydrophobicContact CG-CD2 3.83Å; Q52-L54 PolarHBondContact O-N 3.16Å; L54-M832 HydrophobicContact CB-CE 3.83Å; L54-M832 WeakPolarHBondContact O-CE 3.42Å; L54-Q835 PolarHBondContact O-OE1 3.14Å; L54-L837 HydrophobicContact CD2-CD1 4.44Å; L54-L837 HydrophobicContact CD2-CD2 3.97Å; L54-V841 HydrophobicContact CD2-CG2 3.93Å
55	Q	89.2	Confident	90	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.009	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	149.9	-174.9	-153.8	-178	34.4	0	0	112.2	V45 L57 V100 F830 M832	V45-Q55 HydrophobicContact CB-CB 4.4Å; V45-Q55 PolarHBondContact N-O 3.07Å; V45-Q55 PolarHBondContact O-N 3.34Å; Q55-L57 HydrophobicContact CG-CD2 4.31Å; Q55-V100 PolarHBondContact NE2-O 3.5Å; Q55-V100 PolarHBondContact OE1-O 2.89Å; Q55-F830 PolarHBondContact NE2-O 2.45Å; Q55-M832 HydrophobicContact CB-SD 3.85Å; Q55-M832 HydrophobicContact CG-SD 3.96Å
56	V	91.6	Very high	90	Very high	9 Å²	9	30.5 Å²	30.5	6%	0.055	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	118	170.2	-175.2	0	0	0	0	108.2	T14 L42 V43 V44 T53 E58 C829	T14-V56 HydrophobicContact CG2-CG1 4.4Å; L42-V56 HydrophobicContact CB-CG1 3.97Å; L42-V56 HydrophobicContact CD1-CG1 4.06Å; L42-V56 HydrophobicContact CG-CG1 4.45Å; V43-V56 WeakPolarHBondContact O-CA 3.42Å; V44-V56 HydrophobicContact CG1-CG2 4.44Å; T53-V56 HydrophobicContact CG2-CG2 3.94Å; V56-E58 HydrophobicContact CG1-CG 4.21Å; V56-C829 PolarHBondContact O-SG 3.1Å
57	L	92.2	Very high	90.2	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	117.5	-178.4	-58.8	170.4	0	0	0	109.5	V43 Q55 L86 W98 V100	V43-L57 HydrophobicContact CB-CB 4.18Å; V43-L57 HydrophobicContact CB-CD1 4.37Å; V43-L57 HydrophobicContact CG1-CD1 4.46Å; V43-L57 PolarHBondContact N-O 3.14Å; V43-L57 VanDerWaalsContact N-O 3.13Å; V43-L57 PolarHBondContact O-N 2.74Å; Q55-L57 HydrophobicContact CG-CD2 4.31Å; L57-L86 HydrophobicContact CD1-CD2 4.23Å; L57-W98 HydrophobicContact CB-CD2 4.31Å; L57-W98 HydrophobicContact CB-CE3 4.14Å; L57-W98 HydrophobicContact CB-CH2 3.8Å; L57-W98 HydrophobicContact CB-CZ2 4.08Å; L57-W98 HydrophobicContact CB-CZ3 3.89Å; L57-W98 HydrophobicContact CD1-CB 4.09Å; L57-W98 HydrophobicContact CD1-CD2 3.81Å; L57-W98 HydrophobicContact CD1-CE3 4.1Å; L57-W98 HydrophobicContact CD1-CG 3.82Å; L57-W98 HydrophobicContact CD2-CD2 4.48Å; L57-W98 HydrophobicContact CD2-CE3 3.92Å; L57-W98 HydrophobicContact CD2-CZ3 4.14Å; L57-W98 HydrophobicContact CG-CD2 4.44Å; L57-W98 HydrophobicContact CG-CE3 4.29Å; L57-W98 HydrophobicContact CG-CZ3 4.46Å; L57-V100 HydrophobicContact CD1-CG2 4.21Å
58	E	88.1	Confident	90.4	Very high	38 Å²	38	33.2 Å²	33.2	18%	0.178	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	97.1	-173.7	-41.1	-165.2	136.4	0	0	109.8	T14 L42 V56 R819 A828 C829	T14-E58 PolarHBondContact OG1-OE1 3.35Å; L42-E58 HydrophobicContact CD2-CB 4.06Å; L42-E58 HydrophobicContact CD2-CG 3.82Å; V56-E58 HydrophobicContact CG1-CG 4.21Å; E58-R819 IonicContact OE1-NE 3.65Å; E58-R819 PolarHBondContact OE1-NE 2.82Å; E58-A828 PolarHBondContact OE2-N 2.72Å; E58-A828 VanDerWaalsContact OE2-N 3.11Å; E58-C829 PolarHBondContact N-SG 2.85Å
59	K	89.1	Confident	90.6	Very high	88 Å²	88	32.8 Å²	32.8	38%	0.383	16%	0.162	S	C	.	.			trans	-154.2	-24.2	173.7	-158	177.7	-164.7	-155.7	0	114.5	I96 W98 A105 E108	K59-I96 HydrophobicContact CB-CD1 4.06Å; K59-I96 HydrophobicContact CD-CD1 4.3Å; K59-I96 HydrophobicContact CG-CD1 4.23Å; K59-W98 HydrophobicContact CB-CH2 3.26Å; K59-W98 HydrophobicContact CB-CZ2 3.99Å; K59-W98 HydrophobicContact CB-CZ3 4.04Å; K59-W98 HydrophobicContact CD-CH2 4.29Å; K59-W98 HydrophobicContact CD-CZ3 4.43Å; K59-W98 HydrophobicContact CG-CH2 4.4Å; K59-A105 HydrophobicContact CD-CB 3.54Å; K59-A105 VanDerWaalsContact NZ-CB 3.32Å; K59-E108 WeakPolarHBondContact CD-OE1 3.35Å; K59-E108 WeakPolarHBondContact CE-OE1 3.4Å; K59-E108 IonicContact NZ-OE1 3.51Å; K59-E108 PolarHBondContact NZ-OE1 3.45Å
60	H	90.6	Very high	90.8	Very high	9 Å²	9	27.7 Å²	27.7	4%	0.042	14%	0.137	C	C	.	.			trans	-64.8	146.7	172.8	-75.2	-78.8	0	0	0	110.8	S41 V64 S88 D90 K94	S41-H60 WeakPolarHBondContact O-CB 3.5Å; H60-V64 HydrophobicContact CB-CG2 4.36Å; H60-S88 PolarHBondContact CD2-OG 3.47Å; H60-S88 PolarHBondContact NE2-OG 2.89Å; H60-D90 IonicContact CE1-OD2 3.64Å; H60-D90 IonicContact CG-OD2 2.83Å; H60-D90 WeakPolarHBondContact ND1-CB 3.32Å; H60-D90 IonicContact ND1-OD2 2.65Å; H60-D90 PolarHBondContact ND1-OD2 3.14Å; H60-K94 PolarHBondContact CE1-O 3.06Å
61	K	88.9	Confident	90.7	Very high	155 Å²	155	29.9 Å²	29.9	67%	0.674	14%	0.142	S	C	*	.	S	Bend	trans	-104.3	-8	176.9	-64.4	-176.4	178.8	-178.2	0	112.5	T795	K61-T795 HydrophobicContact CB-CG2 4.12Å; K61-T795 WeakPolarHBondContact O-CG2 3.47Å
62	A	91.1	Very high	90.2	Very high	15 Å²	15	29.9 Å²	29.9	12%	0.124	14%	0.141	C	C	.	.	S	Bend	trans	-130.3	168.8	177.9	0	0	0	0	0	109.4	S41 D90 V91 N92	S41-A62 WeakPolarHBondContact CA-O 3.45Å; S41-A62 VanDerWaalsContact CB-O 3.27Å; S41-A62 WeakPolarHBondContact CB-O 3.41Å; A62-D90 HydrophobicContact CB-CB 4.19Å; A62-V91 HydrophobicContact CB-CB 4.4Å; A62-N92 HydrophobicContact CB-CB 4.25Å
63	D	92.9	Very high	89.7	Confident	36 Å²	36	30.6 Å²	30.6	19%	0.193	15%	0.145	C	C	.	.			trans	-61.9	138.3	-179.4	-59.3	-57.7	0	0	0	111.4	N20 H22 H40 D90 V91	N20-D63 PolarHBondContact ND2-OD1 2.65Å; N20-D63 PolarHBondContact ND2-OD2 3.16Å; H22-D63 HydrophobicContact CB-CB 4Å; H22-D63 IonicContact CD2-OD2 2.71Å; H40-D63 VanDerWaalsContact CA-OD1 3.32Å; H40-D63 WeakPolarHBondContact CA-OD1 3.43Å; H40-D63 IonicContact ND1-OD1 2.84Å; H40-D63 CarbonylContact O-C 3.59Å; H40-D63 VanDerWaalsContact O-CA 3.25Å; H40-D63 WeakPolarHBondContact O-CA 3.5Å; D63-D90 CarbonylContact O-C 3.58Å; D63-D90 VanDerWaalsContact O-CA 3.26Å; D63-D90 WeakPolarHBondContact O-CA 3.41Å; D63-D90 WeakPolarHBondContact O-CB 3.43Å; D63-V91 HydrophobicContact CB-CG2 4.14Å; D63-V91 WeakPolarHBondContact O-CG2 3.34Å; D63-V91 PolarHBondContact O-N 3.17Å
64	V	94.9	Very high	89.3	Confident	0 Å²	0	29 Å²	29	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	127.8	178.6	-178.1	0	0	0	0	109.7	N23 A26 H40 V43 H60 V67 A89	N23-V64 WeakPolarHBondContact CA-O 3.41Å; N23-V64 PolarHBondContact ND2-O 3.17Å; A26-V64 HydrophobicContact CB-CG1 4.14Å; H40-V64 PolarHBondContact O-N 2.97Å; V43-V64 HydrophobicContact CG2-CG1 4.24Å; V43-V64 HydrophobicContact CG2-CG2 4.01Å; H60-V64 HydrophobicContact CB-CG2 4.36Å; V64-V67 HydrophobicContact CG1-CG2 3.68Å; V64-A89 CarbonylContact C-O 3.58Å; V64-A89 WeakPolarHBondContact CA-O 3.41Å; V64-A89 WeakPolarHBondContact CG1-O 3.43Å
65	V	94.7	Very high	89	Confident	21 Å²	21	29.3 Å²	29.3	13%	0.127	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	-35.4	-176.6	-176.6	0	0	0	0	112	A25 A26 A89 V91	A25-V65 CarbonylContact C-O 3.57Å; A26-V65 WeakPolarHBondContact CA-O 3.36Å; A26-V65 WeakPolarHBondContact CB-O 3.34Å; A26-V65 PolarHBondContact N-O 3.1Å; V65-A89 PolarHBondContact N-O 3.28Å; V65-V91 HydrophobicContact CG2-CB 4.31Å; V65-V91 HydrophobicContact CG2-CG2 3.43Å; V65-V91 VanDerWaalsContact CG2-CG2 3.43Å
66	K	94.8	Very high	88.8	Confident	36 Å²	36	29.3 Å²	29.3	16%	0.157	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	144.7	-179	-71.4	-72.3	-179.9	145.7	0	110.8	A25 S88 A89 Q117 D118	A25-K66 HydrophobicContact CB-CD 4.16Å; K66-S88 CarbonylContact O-C 3.6Å; K66-S88 WeakPolarHBondContact O-CA 3.27Å; K66-A89 HydrophobicContact CB-CB 4.27Å; K66-A89 PolarHBondContact N-O 3.41Å; K66-A89 PolarHBondContact O-N 3.31Å; K66-Q117 WeakPolarHBondContact CE-O 3.47Å; K66-D118 WeakPolarHBondContact CE-OD1 3.27Å; K66-D118 IonicContact NZ-OD1 3.17Å; K66-D118 PolarHBondContact NZ-OD1 3.39Å
67	V	95.8	Very high	88.4	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.006	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	135.1	173.8	177.3	0	0	0	0	106.6	A26 D28 A36 V43 V64 L86 A87	A26-V67 HydrophobicContact CB-CG2 4.18Å; D28-V67 WeakPolarHBondContact CB-O 3.35Å; A36-V67 HydrophobicContact CB-CG1 3.69Å; V43-V67 HydrophobicContact CG1-CG1 4.22Å; V43-V67 HydrophobicContact CG1-CG2 4.18Å; V43-V67 HydrophobicContact CG2-CG2 4.38Å; V64-V67 HydrophobicContact CG1-CG2 3.68Å; V67-L86 HydrophobicContact CG1-CD1 3.45Å; V67-L86 VanDerWaalsContact CG1-CD1 3.45Å; V67-L86 HydrophobicContact CG1-CD2 3.96Å; V67-L86 HydrophobicContact CG1-CG 4.01Å; V67-A87 CarbonylContact C-O 3.3Å; V67-A87 WeakPolarHBondContact CA-O 3.42Å
68	K	94.9	Very high	87.9	Confident	58 Å²	58	36.2 Å²	36.2	25%	0.252	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	128.3	177.9	-73.6	-60.2	177.3	-175.2	0	112.8	D28 L86 A87 V119 W121	D28-K68 HydrophobicContact CB-CD 4.18Å; D28-K68 VanDerWaalsContact CG-CD 3.49Å; D28-K68 WeakPolarHBondContact OD1-CD 3.49Å; D28-K68 IonicContact OD1-NZ 3.34Å; D28-K68 PolarHBondContact OD1-NZ 3.47Å; D28-K68 WeakPolarHBondContact OD2-CA 3.26Å; D28-K68 WeakPolarHBondContact OD2-CD 3.46Å; K68-L86 VanDerWaalsContact C-CD1 3.47Å; K68-L86 WeakPolarHBondContact O-CD1 3.24Å; K68-A87 PolarHBondContact N-O 3.4Å; K68-A87 PolarHBondContact O-N 3.37Å; K68-V119 WeakPolarHBondContact CG-O 3.14Å; K68-W121 PolarHBondContact O-NE1 3.27Å
69	W	93.7	Very high	87.5	Confident	9 Å²	9	37.8 Å²	37.8	3%	0.034	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	141	173.7	-73.2	109.6	0	0	0	111.4	D28 L34 A36 V45 L84 R85 L86 V100 W121	D28-W69 PolarHBondContact OD2-N 2.99Å; L34-W69 HydrophobicContact CB-CZ2 4.1Å; L34-W69 HydrophobicContact CD1-CH2 4.5Å; A36-W69 HydrophobicContact CB-CZ2 3.77Å; V45-W69 HydrophobicContact CG1-CH2 4.29Å; V45-W69 HydrophobicContact CG1-CZ2 4.02Å; V45-W69 HydrophobicContact CG2-CH2 4.4Å; V45-W69 HydrophobicContact CG2-CZ2 4.22Å; W69-L84 HydrophobicContact CZ3-CB 4.19Å; W69-L84 HydrophobicContact CZ3-CD2 4.48Å; W69-R85 VanDerWaalsContact CE3-O 3.26Å; W69-L86 HydrophobicContact CB-CD1 4.44Å; W69-L86 HydrophobicContact CD2-CB 4.35Å; W69-L86 HydrophobicContact CD2-CD1 3.43Å; W69-L86 VanDerWaalsContact CD2-CD1 3.43Å; W69-L86 HydrophobicContact CD2-CG 4.4Å; W69-L86 HydrophobicContact CE3-CB 3.81Å; W69-L86 HydrophobicContact CE3-CD1 3.79Å; W69-L86 HydrophobicContact CE3-CG 4.35Å; W69-L86 HydrophobicContact CG-CD1 3.75Å; W69-L86 HydrophobicContact CH2-CB 4.37Å; W69-L86 HydrophobicContact CZ2-CD1 4.31Å; W69-L86 HydrophobicContact CZ2-CD2 4.46Å; W69-L86 HydrophobicContact CZ3-CB 3.82Å; W69-L86 HydrophobicContact CZ3-CD1 4.37Å; W69-V100 HydrophobicContact CH2-CB 4.2Å; W69-V100 HydrophobicContact CH2-CG1 4.13Å; W69-V100 HydrophobicContact CH2-CG2 3.68Å; W69-V100 HydrophobicContact CZ3-CB 4.39Å; W69-V100 HydrophobicContact CZ3-CG2 3.71Å; W69-W121 VanDerWaalsContact C-CD1 3.43Å; W69-W121 PolarHBondContact O-NE1 2.8Å
70	A	89.7	Confident	87.2	Confident	6 Å²	6	34.4 Å²	34.4	5%	0.05	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-62.8	152.2	167.8	0	0	0	0	0	109.9	R85 W121	A70-R85 HydrophobicContact CB-CB 3.81Å; A70-R85 PolarHBondContact N-O 3.32Å; A70-W121 HydrophobicContact CB-CD2 4.2Å; A70-W121 HydrophobicContact CB-CZ2 4.3Å
71	R	82.6	Confident	86.9	Confident	82 Å²	82	36 Å²	36	31%	0.309	20%	0.196	S	C	.	.	P	Polyproline II helix	trans	-98.6	140.1	176.6	-67	-162.4	-178.3	-169.5	-0.1	110.2	N73 E923	R71-N73 VanDerWaalsContact C-N 3.33Å; R71-N73 PolarHBondContact O-N 3.15Å; R71-N73 PolarHBondContact O-OD1 2.68Å; R71-E923 WeakPolarHBondContact CD-OE2 3.49Å; R71-E923 IonicContact NH1-OE1 3.66Å; R71-E923 PolarHBondContact NH1-OE1 3.13Å; R71-E923 IonicContact NH1-OE2 3.91Å
72	E	76.7	Confident	86.7	Confident	4 Å²	4	29 Å²	29	2%	0.019	17%	0.165	C	C	.	.			trans	-96.6	66.4	-179.5	-55.3	-65.2	-173.8	0	0	109.8	Y74 H76 Y845 E923	E72-Y74 WeakPolarHBondContact OE2-CE1 3.47Å; E72-Y74 VanDerWaalsContact OE2-CZ 3.26Å; E72-Y74 PolarHBondContact OE2-OH 3.33Å; E72-H76 IonicContact OE2-CE1 3.08Å; E72-H76 PolarHBondContact OE2-CE1 2.76Å; E72-H76 IonicContact OE2-NE2 3.03Å; E72-Y845 HydrophobicContact CG-CE1 3.85Å; E72-E923 PolarHBondContact O-N 3.32Å
73	N	75.9	Confident	86.3	Confident	22 Å²	22	29.2 Å²	29.2	12%	0.118	17%	0.165	C	C	.	.			trans	-97.7	7.5	-173.7	68.7	-34.7	0	0	0	113.2	R71 W123 Q125 S924	R71-N73 VanDerWaalsContact C-N 3.33Å; R71-N73 PolarHBondContact O-N 3.15Å; R71-N73 PolarHBondContact O-OD1 2.68Å; N73-W123 WeakPolarHBondContact ND2-CA 3.47Å; N73-W123 PolarHBondContact ND2-O 3.29Å; N73-Q125 PolarHBondContact ND2-O 3.36Å; N73-Q125 VanDerWaalsContact ND2-O 3.15Å; N73-S924 WeakPolarHBondContact O-CB 3.37Å
74	Y	79.1	Confident	86.1	Confident	14 Å²	14	27.6 Å²	27.6	6%	0.055	16%	0.157	C	C	.	.	S	Bend	trans	-117.2	174.1	178.6	56.6	-85	0	0	0	110.9	E72 H76 S924	E72-Y74 WeakPolarHBondContact OE2-CE1 3.47Å; E72-Y74 VanDerWaalsContact OE2-CZ 3.26Å; E72-Y74 PolarHBondContact OE2-OH 3.33Å; Y74-H76 AromaticContact CE2-CE1 3.41Å; Y74-H76 VanDerWaalsContact CE2-CE1 3.41Å; Y74-H76 WeakPolarHBondContact CE2-CE1 3.33Å; Y74-H76 AromaticContact CE2-ND1 3.59Å; Y74-H76 AromaticContact CZ-CE1 3.54Å; Y74-H76 PolarHBondContact OH-CE1 3.27Å; Y74-S924 PolarHBondContact O-OG 3.11Å
75	H	82.6	Confident	85.9	Confident	10 Å²	10	30 Å²	30	5%	0.046	17%	0.166	C	C	.	.			trans	-87.2	132.7	177.2	174.2	66	0	0	0	111	S80 E925 Y1149 D1151	H75-S80 PolarHBondContact O-OG 3.42Å; H75-E925 IonicContact ND1-OE1 3.64Å; H75-Y1149 HydrophobicContact CB-CD1 3.67Å; H75-Y1149 HydrophobicContact CB-CD2 4.18Å; H75-Y1149 HydrophobicContact CB-CE1 3.32Å; H75-Y1149 HydrophobicContact CB-CE2 3.85Å; H75-Y1149 HydrophobicContact CB-CG 4.1Å; H75-Y1149 VanDerWaalsContact CB-CZ 3.4Å; H75-Y1149 AromaticContact CD2-CD1 3.13Å; H75-Y1149 WeakPolarHBondContact CD2-CD1 3.29Å; H75-Y1149 AromaticContact CD2-CE1 3.53Å; H75-Y1149 AromaticContact CD2-CG 3.83Å; H75-Y1149 AromaticContact CG-CD1 3.41Å; H75-Y1149 VanDerWaalsContact CG-CD1 3.41Å; H75-Y1149 AromaticContact CG-CE1 3.62Å; H75-Y1149 AromaticContact CG-CG 3.78Å; H75-Y1149 AromaticContact NE2-CD1 3.9Å; H75-D1151 IonicContact CE1-OD1 2.8Å; H75-D1151 PolarHBondContact CE1-OD1 3.04Å; H75-D1151 IonicContact CE1-OD2 3.9Å; H75-D1151 IonicContact ND1-OD1 3.12Å; H75-D1151 IonicContact NE2-OD1 3.51Å
76	H	84.7	Confident	85.9	Confident	2 Å²	2	29 Å²	29	1%	0.009	16%	0.16	C	C	.	.			trans	-92	127.7	-179.4	-64	-77.8	0	0	0	111.9	E72 Y74 S80 Y82 L853	E72-H76 IonicContact OE2-CE1 3.08Å; E72-H76 PolarHBondContact OE2-CE1 2.76Å; E72-H76 IonicContact OE2-NE2 3.03Å; Y74-H76 AromaticContact CE2-CE1 3.41Å; Y74-H76 VanDerWaalsContact CE2-CE1 3.41Å; Y74-H76 WeakPolarHBondContact CE2-CE1 3.33Å; Y74-H76 AromaticContact CE2-ND1 3.59Å; Y74-H76 AromaticContact CZ-CE1 3.54Å; Y74-H76 PolarHBondContact OH-CE1 3.27Å; H76-S80 VanDerWaalsContact CA-O 3.29Å; H76-S80 WeakPolarHBondContact CA-O 3.48Å; H76-S80 PolarHBondContact ND1-O 3.12Å; H76-Y82 HydrophobicContact CB-CD1 4.33Å; H76-Y82 HydrophobicContact CB-CD2 4.17Å; H76-Y82 HydrophobicContact CB-CE1 3.93Å; H76-Y82 HydrophobicContact CB-CE2 3.73Å; H76-Y82 HydrophobicContact CB-CG 4.45Å; H76-Y82 AromaticContact CD2-CD1 3.62Å; H76-Y82 AromaticContact CD2-CE1 3.01Å; H76-Y82 WeakPolarHBondContact CD2-CE1 3.46Å; H76-Y82 AromaticContact CD2-CZ 3.46Å; H76-Y82 VanDerWaalsContact CD2-CZ 3.46Å; H76-Y82 AromaticContact CE1-CD1 3.67Å; H76-Y82 AromaticContact CE1-CE1 3.87Å; H76-Y82 AromaticContact CG-CD1 3.61Å; H76-Y82 AromaticContact CG-CE1 3.32Å; H76-Y82 AromaticContact CG-CZ 3.54Å; H76-Y82 AromaticContact ND1-CD1 3.66Å; H76-Y82 AromaticContact ND1-CE1 3.86Å; H76-Y82 AromaticContact NE2-CD1 3.67Å; H76-Y82 AromaticContact NE2-CE1 3.41Å; H76-Y82 WeakPolarHBondContact NE2-CE1 3.34Å; H76-L853 HydrophobicContact CB-CD2 4.36Å
77	N	83.6	Confident	86	Confident	62 Å²	62	27.3 Å²	27.3	33%	0.332	15%	0.153	S	C	.	.			trans	-143	-172.8	172.6	65	40	0	0	0	109.6	G79 S80 P81	N77-G79 PolarHBondContact O-N 2.96Å; N77-G79 VanDerWaalsContact OD1-CA 3.31Å; N77-G79 WeakPolarHBondContact OD1-CA 3.45Å; N77-G79 PolarHBondContact OD1-N 3.43Å; N77-S80 PolarHBondContact N-O 2.89Å; N77-S80 PolarHBondContact N-OG 3.15Å; N77-S80 CarbonylContact O-C 3.6Å; N77-S80 PolarHBondContact O-N 2.95Å; N77-S80 PolarHBondContact OD1-N 3.41Å; N77-S80 PolarHBondContact OD1-OG 3.43Å; N77-P81 WeakPolarHBondContact O-CA 3.45Å
78	I	80.8	Confident	86	Confident	92 Å²	92	27.3 Å²	27.3	47%	0.472	15%	0.153	S	C	.	.	S	Bend	trans	-61.1	-30.1	-179.1	-64	167.1	0	0	0	112.3	L853 L1190	I78-L853 HydrophobicContact CG1-CD1 4.07Å; I78-L1190 HydrophobicContact CD1-CD2 4.31Å; I78-L1190 HydrophobicContact CG1-CD2 4.44Å
79	G	79.9	Confident	86	Confident	71 Å²	71	24.6 Å²	24.6	73%	0.732	14%	0.141	S	C	*	.	S	Bend	trans	-82.7	-28.5	176.6	0	0	0	0	0	114.3	N77 P81	N77-G79 PolarHBondContact O-N 2.96Å; N77-G79 VanDerWaalsContact OD1-CA 3.31Å; N77-G79 WeakPolarHBondContact OD1-CA 3.45Å; N77-G79 PolarHBondContact OD1-N 3.43Å; G79-P81 WeakPolarHBondContact O-CD 3.33Å
80	S	82.9	Confident	86	Confident	18 Å²	18	24.3 Å²	24.3	13%	0.126	14%	0.14	C	C	.	.	S	Bend	trans	-122.2	70.8	175.8	50.8	0	0	0	0	110.6	H75 H76 N77	H75-S80 PolarHBondContact O-OG 3.42Å; H76-S80 VanDerWaalsContact CA-O 3.29Å; H76-S80 WeakPolarHBondContact CA-O 3.48Å; H76-S80 PolarHBondContact ND1-O 3.12Å; N77-S80 PolarHBondContact N-O 2.89Å; N77-S80 PolarHBondContact N-OG 3.15Å; N77-S80 CarbonylContact O-C 3.6Å; N77-S80 PolarHBondContact O-N 2.95Å; N77-S80 PolarHBondContact OD1-N 3.41Å; N77-S80 PolarHBondContact OD1-OG 3.43Å
81	P	84	Confident	86.1	Confident	43 Å²	43	25.6 Å²	25.6	28%	0.279	15%	0.148	S	C	.	.			trans	-72.3	161.4	-173.1	32.5	-38.3	0	0	0	112.7	N77 G79 C83 P849	N77-P81 WeakPolarHBondContact O-CA 3.45Å; G79-P81 WeakPolarHBondContact O-CD 3.33Å; P81-C83 PolarHBondContact O-N 3.46Å; P81-P849 HydrophobicContact CB-CB 3.47Å; P81-P849 VanDerWaalsContact CB-CB 3.47Å; P81-P849 HydrophobicContact CB-CG 3.65Å; P81-P849 HydrophobicContact CG-CB 4.45Å; P81-P849 HydrophobicContact CG-CG 4.25Å
82	Y	85.5	Confident	86.6	Confident	7 Å²	7	25.4 Å²	25.4	3%	0.027	15%	0.153	C	C	.	.			trans	-58.7	126.1	167.1	-68.7	-70.8	0	0	0	110.3	H76 Y845 S852 L853 K856 Y920 D922	H76-Y82 HydrophobicContact CB-CD1 4.33Å; H76-Y82 HydrophobicContact CB-CD2 4.17Å; H76-Y82 HydrophobicContact CB-CE1 3.93Å; H76-Y82 HydrophobicContact CB-CE2 3.73Å; H76-Y82 HydrophobicContact CB-CG 4.45Å; H76-Y82 AromaticContact CD2-CD1 3.62Å; H76-Y82 AromaticContact CD2-CE1 3.01Å; H76-Y82 WeakPolarHBondContact CD2-CE1 3.46Å; H76-Y82 AromaticContact CD2-CZ 3.46Å; H76-Y82 VanDerWaalsContact CD2-CZ 3.46Å; H76-Y82 AromaticContact CE1-CD1 3.67Å; H76-Y82 AromaticContact CE1-CE1 3.87Å; H76-Y82 AromaticContact CG-CD1 3.61Å; H76-Y82 AromaticContact CG-CE1 3.32Å; H76-Y82 AromaticContact CG-CZ 3.54Å; H76-Y82 AromaticContact ND1-CD1 3.66Å; H76-Y82 AromaticContact ND1-CE1 3.86Å; H76-Y82 AromaticContact NE2-CD1 3.67Å; H76-Y82 AromaticContact NE2-CE1 3.41Å; H76-Y82 WeakPolarHBondContact NE2-CE1 3.34Å; Y82-Y845 HydrophobicContact CD1-CD1 4.09Å; Y82-Y845 AromaticContact CD1-CE1 3.49Å; Y82-Y845 HydrophobicContact CD1-CE1 3.49Å; Y82-Y845 VanDerWaalsContact CD1-CE1 3.49Å; Y82-Y845 HydrophobicContact CD1-CE2 4.34Å; Y82-Y845 AromaticContact CD1-CZ 3.61Å; Y82-Y845 HydrophobicContact CE1-CE1 4.36Å; Y82-Y845 HydrophobicContact CG-CD1 4.39Å; Y82-Y845 HydrophobicContact CG-CE1 4.23Å; Y82-S852 WeakPolarHBondContact CD2-OG 3.49Å; Y82-L853 HydrophobicContact CD2-CD2 4.32Å; Y82-L853 HydrophobicContact CE2-CD2 3.89Å; Y82-K856 HydrophobicContact CE2-CD 4.48Å; Y82-K856 WeakPolarHBondContact OH-CD 3.21Å; Y82-K856 PolarHBondContact OH-NZ 3.23Å; Y82-Y920 HydrophobicContact CD2-CE1 4.34Å; Y82-Y920 AromaticContact CE1-CD1 3.93Å; Y82-Y920 HydrophobicContact CE1-CD1 3.93Å; Y82-Y920 AromaticContact CE2-CD1 3.87Å; Y82-Y920 HydrophobicContact CE2-CD1 3.87Å; Y82-Y920 AromaticContact CE2-CE1 3.82Å; Y82-Y920 HydrophobicContact CE2-CE1 3.82Å; Y82-Y920 AromaticContact CZ-CD1 3.55Å; Y82-D922 VanDerWaalsContact CE1-OD1 3.25Å; Y82-D922 WeakPolarHBondContact CE1-OD1 3.09Å; Y82-D922 PolarHBondContact OH-OD1 2.94Å; Y82-D922 PolarHBondContact OH-OD2 3.25Å
83	C	83.4	Confident	87.2	Confident	19 Å²	19	25.2 Å²	25.2	13%	0.128	15%	0.152	C	C	.	.			trans	-143.2	130.3	-177.3	-178.8	0	0	0	0	110.2	P81 R85	P81-C83 PolarHBondContact O-N 3.46Å; C83-R85 HydrophobicContact CB-CG 4.23Å; C83-R85 PolarHBondContact O-N 3.46Å; C83-R85 VanDerWaalsContact SG-CG 3.55Å
84	L	88.5	Confident	88.1	Confident	3 Å²	3	25.7 Å²	25.7	2%	0.016	15%	0.153	C	C	.	.			trans	-78.6	88.7	177.1	-67.3	179.9	0	0	0	111.1	Q32 L34 W69 V100 A101 Y845 L846	Q32-L84 HydrophobicContact CB-CD2 4.09Å; Q32-L84 HydrophobicContact CG-CD2 3.63Å; L34-L84 HydrophobicContact CD1-CD1 3.9Å; L34-L84 HydrophobicContact CD1-CD2 4.12Å; W69-L84 HydrophobicContact CZ3-CB 4.19Å; W69-L84 HydrophobicContact CZ3-CD2 4.48Å; L84-V100 HydrophobicContact CB-CB 3.8Å; L84-V100 HydrophobicContact CB-CG2 4.44Å; L84-V100 HydrophobicContact CD1-CB 4.48Å; L84-V100 WeakPolarHBondContact O-CG2 3.43Å; L84-V100 PolarHBondContact O-N 3.29Å; L84-A101 HydrophobicContact CD1-CB 4.42Å; L84-Y845 VanDerWaalsContact CD2-CB 3.41Å; L84-Y845 HydrophobicContact CD2-CD1 3.94Å; L84-Y845 HydrophobicContact CD2-CG 3.78Å; L84-Y845 HydrophobicContact CG-CG 4.43Å; L84-L846 HydrophobicContact CD1-CD2 3.61Å; L84-L846 HydrophobicContact CD1-CG 4.36Å
85	R	90.6	Very high	88.8	Confident	49 Å²	49	25 Å²	25	19%	0.185	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	126.1	-179.7	-64.3	-176.1	-177	-160.8	-6	112.9	W69 A70 C83 W98 D130 D147	W69-R85 VanDerWaalsContact CE3-O 3.26Å; A70-R85 HydrophobicContact CB-CB 3.81Å; A70-R85 PolarHBondContact N-O 3.32Å; C83-R85 HydrophobicContact CB-CG 4.23Å; C83-R85 PolarHBondContact O-N 3.46Å; C83-R85 VanDerWaalsContact SG-CG 3.55Å; R85-W98 WeakPolarHBondContact CA-O 3.39Å; R85-D130 WeakPolarHBondContact CD-OD2 3.35Å; R85-D130 IonicContact CZ-OD2 3.74Å; R85-D130 IonicContact NE-OD2 3.97Å; R85-D130 IonicContact NH1-OD1 2.76Å; R85-D130 IonicContact NH1-OD2 3.19Å; R85-D130 PolarHBondContact NH1-OD2 3.37Å; R85-D147 IonicContact CZ-OD1 3.99Å; R85-D147 IonicContact NH1-OD1 2.99Å; R85-D147 PolarHBondContact NH1-OD1 2.98Å; R85-D147 IonicContact NH2-OD1 2.79Å
86	L	94.7	Very high	89.4	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	135.8	-178.4	-176.9	68.3	0	0	0	110.8	A36 V43 L57 V67 K68 W69 V97 W98 V100	A36-L86 HydrophobicContact CB-CD1 4.09Å; A36-L86 HydrophobicContact CB-CD2 3.88Å; V43-L86 HydrophobicContact CG1-CD2 3.7Å; L57-L86 HydrophobicContact CD1-CD2 4.23Å; V67-L86 HydrophobicContact CG1-CD1 3.45Å; V67-L86 VanDerWaalsContact CG1-CD1 3.45Å; V67-L86 HydrophobicContact CG1-CD2 3.96Å; V67-L86 HydrophobicContact CG1-CG 4.01Å; K68-L86 VanDerWaalsContact C-CD1 3.47Å; K68-L86 WeakPolarHBondContact O-CD1 3.24Å; W69-L86 HydrophobicContact CB-CD1 4.44Å; W69-L86 HydrophobicContact CD2-CB 4.35Å; W69-L86 HydrophobicContact CD2-CD1 3.43Å; W69-L86 VanDerWaalsContact CD2-CD1 3.43Å; W69-L86 HydrophobicContact CD2-CG 4.4Å; W69-L86 HydrophobicContact CE3-CB 3.81Å; W69-L86 HydrophobicContact CE3-CD1 3.79Å; W69-L86 HydrophobicContact CE3-CG 4.35Å; W69-L86 HydrophobicContact CG-CD1 3.75Å; W69-L86 HydrophobicContact CH2-CB 4.37Å; W69-L86 HydrophobicContact CZ2-CD1 4.31Å; W69-L86 HydrophobicContact CZ2-CD2 4.46Å; W69-L86 HydrophobicContact CZ3-CB 3.82Å; W69-L86 HydrophobicContact CZ3-CD1 4.37Å; L86-V97 CarbonylContact O-C 3.59Å; L86-V97 WeakPolarHBondContact O-CA 3.47Å; L86-W98 HydrophobicContact CB-CB 4.36Å; L86-W98 PolarHBondContact N-O 3.14Å; L86-W98 VanDerWaalsContact N-O 3.17Å; L86-W98 PolarHBondContact O-N 2.91Å; L86-V100 HydrophobicContact CB-CG2 3.72Å; L86-V100 HydrophobicContact CD2-CG2 4.27Å
87	A	95.5	Very high	89.9	Confident	2 Å²	2	24.4 Å²	24.4	2%	0.017	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	133.9	167.9	0	0	0	0	0	110.2	V67 K68 I96 W121 L132	V67-A87 CarbonylContact C-O 3.3Å; V67-A87 WeakPolarHBondContact CA-O 3.42Å; K68-A87 PolarHBondContact N-O 3.4Å; K68-A87 PolarHBondContact O-N 3.37Å; A87-I96 WeakPolarHBondContact CA-O 3.34Å; A87-W121 HydrophobicContact CB-CZ2 3.57Å; A87-L132 HydrophobicContact CB-CD1 4.1Å; A87-L132 HydrophobicContact CB-CD2 4.06Å
88	S	96.5	Very high	90.4	Very high	1 Å²	1	21.6 Å²	21.6	1%	0.007	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	144.6	170.5	62.8	0	0	0	0	111.5	H60 K66 I95 I96 W98	H60-S88 PolarHBondContact CD2-OG 3.47Å; H60-S88 PolarHBondContact NE2-OG 2.89Å; K66-S88 CarbonylContact O-C 3.6Å; K66-S88 WeakPolarHBondContact O-CA 3.27Å; S88-I95 CarbonylContact O-C 3.56Å; S88-I95 VanDerWaalsContact O-CA 3.26Å; S88-I95 WeakPolarHBondContact O-CA 3.49Å; S88-I96 PolarHBondContact N-O 3.43Å; S88-I96 PolarHBondContact O-N 3.5Å; S88-W98 PolarHBondContact OG-NE1 3.24Å
89	A	95.3	Very high	90.9	Very high	1 Å²	1	19 Å²	19	1%	0.008	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	141.7	-176.8	0	0	0	0	0	111.1	V64 V65 K66 K94 I95 I116 V119	V64-A89 CarbonylContact C-O 3.58Å; V64-A89 WeakPolarHBondContact CA-O 3.41Å; V64-A89 WeakPolarHBondContact CG1-O 3.43Å; V65-A89 PolarHBondContact N-O 3.28Å; K66-A89 HydrophobicContact CB-CB 4.27Å; K66-A89 PolarHBondContact N-O 3.41Å; K66-A89 PolarHBondContact O-N 3.31Å; A89-K94 WeakPolarHBondContact CA-O 3.41Å; A89-I95 HydrophobicContact CB-CG1 4.14Å; A89-I116 HydrophobicContact CB-CB 4.04Å; A89-I116 HydrophobicContact CB-CD1 3.64Å; A89-I116 HydrophobicContact CB-CG1 4.48Å; A89-I116 HydrophobicContact CB-CG2 4.17Å; A89-V119 HydrophobicContact CB-CG2 4.31Å
90	D	93.8	Very high	91.5	Very high	3 Å²	3	15.8 Å²	15.8	2%	0.016	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	172.5	180	67.8	27	0	0	0	115.1	H60 A62 D63 N92 G93 K94	H60-D90 IonicContact CE1-OD2 3.64Å; H60-D90 IonicContact CG-OD2 2.83Å; H60-D90 WeakPolarHBondContact ND1-CB 3.32Å; H60-D90 IonicContact ND1-OD2 2.65Å; H60-D90 PolarHBondContact ND1-OD2 3.14Å; A62-D90 HydrophobicContact CB-CB 4.19Å; D63-D90 CarbonylContact O-C 3.58Å; D63-D90 VanDerWaalsContact O-CA 3.26Å; D63-D90 WeakPolarHBondContact O-CA 3.41Å; D63-D90 WeakPolarHBondContact O-CB 3.43Å; D90-N92 PolarHBondContact O-N 3.36Å; D90-N92 VanDerWaalsContact OD1-C 3.28Å; D90-N92 WeakPolarHBondContact OD1-CA 3.4Å; D90-N92 WeakPolarHBondContact OD1-CB 3.42Å; D90-N92 PolarHBondContact OD1-N 3.32Å; D90-G93 PolarHBondContact O-N 3.01Å; D90-G93 PolarHBondContact OD1-N 3.38Å; D90-K94 PolarHBondContact N-O 3.32Å; D90-K94 WeakPolarHBondContact OD1-CB 3.48Å; D90-K94 PolarHBondContact OD1-N 3.04Å; D90-K94 WeakPolarHBondContact OD2-CB 3.41Å
91	V	92.4	Very high	91.7	Very high	33 Å²	33	16.1 Å²	16.1	20%	0.2	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-24.4	177.4	175	0	0	0	0	112.5	H22 A62 D63 V65 G93 K114 P115	H22-V91 HydrophobicContact CB-CG2 4.11Å; A62-V91 HydrophobicContact CB-CB 4.4Å; D63-V91 HydrophobicContact CB-CG2 4.14Å; D63-V91 WeakPolarHBondContact O-CG2 3.34Å; D63-V91 PolarHBondContact O-N 3.17Å; V65-V91 HydrophobicContact CG2-CB 4.31Å; V65-V91 HydrophobicContact CG2-CG2 3.43Å; V65-V91 VanDerWaalsContact CG2-CG2 3.43Å; V91-G93 VanDerWaalsContact C-N 3.25Å; V91-G93 PolarHBondContact O-N 3.41Å; V91-K114 CarbonylContact O-C 3.46Å; V91-K114 VanDerWaalsContact O-C 3.26Å; V91-P115 HydrophobicContact CG1-CB 4.35Å; V91-P115 WeakPolarHBondContact O-CA 3.34Å; V91-P115 WeakPolarHBondContact O-CD 3.28Å
92	N	91.6	Very high	91.8	Very high	78 Å²	78	15.2 Å²	15.2	42%	0.417	9%	0.085	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	8	177.3	-71.5	-13.2	0	0	0	112.6	A62 D90 K94 Q110 A113	A62-N92 HydrophobicContact CB-CB 4.25Å; D90-N92 PolarHBondContact O-N 3.36Å; D90-N92 VanDerWaalsContact OD1-C 3.28Å; D90-N92 WeakPolarHBondContact OD1-CA 3.4Å; D90-N92 WeakPolarHBondContact OD1-CB 3.42Å; D90-N92 PolarHBondContact OD1-N 3.32Å; N92-K94 VanDerWaalsContact C-N 3.28Å; N92-K94 PolarHBondContact O-N 3.29Å; N92-Q110 PolarHBondContact O-NE2 2.92Å; N92-A113 VanDerWaalsContact O-CA 3.3Å; N92-A113 WeakPolarHBondContact O-CA 3.46Å
93	G	90.5	Very high	91.9	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	9%	0.09	C	C	.	.	S	Bend	trans	73.7	17.3	176.2	0	0	0	0	0	114.7	D90 V91 H112 K114	D90-G93 PolarHBondContact O-N 3.01Å; D90-G93 PolarHBondContact OD1-N 3.38Å; V91-G93 VanDerWaalsContact C-N 3.25Å; V91-G93 PolarHBondContact O-N 3.41Å; G93-H112 WeakPolarHBondContact CA-O 3.23Å; G93-K114 WeakPolarHBondContact CA-O 3.36Å; G93-K114 PolarHBondContact N-O 3.28Å
94	K	93.4	Very high	92.2	Very high	31 Å²	31	18.6 Å²	18.6	14%	0.135	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	128.3	172.1	-173	-176.9	-177.3	-177.8	0	109.1	H60 A89 D90 N92 I96 E108 I109	H60-K94 PolarHBondContact CE1-O 3.06Å; A89-K94 WeakPolarHBondContact CA-O 3.41Å; D90-K94 PolarHBondContact N-O 3.32Å; D90-K94 WeakPolarHBondContact OD1-CB 3.48Å; D90-K94 PolarHBondContact OD1-N 3.04Å; D90-K94 WeakPolarHBondContact OD2-CB 3.41Å; N92-K94 VanDerWaalsContact C-N 3.28Å; N92-K94 PolarHBondContact O-N 3.29Å; K94-I96 HydrophobicContact CD-CD1 4.3Å; K94-I96 HydrophobicContact CD-CG1 4.31Å; K94-I96 HydrophobicContact CG-CG1 4.26Å; K94-E108 WeakPolarHBondContact CE-OE2 3.23Å; K94-E108 IonicContact NZ-OE1 3.28Å; K94-E108 PolarHBondContact NZ-OE1 3.02Å; K94-E108 IonicContact NZ-OE2 2.96Å; K94-E108 PolarHBondContact NZ-OE2 2.93Å; K94-I109 CarbonylContact C-O 3.48Å; K94-I109 WeakPolarHBondContact CA-O 3.39Å
95	I	95.1	Very high	92.4	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	134.3	170.3	-55.2	174	0	0	0	107.7	S88 A89 E108 I109 I116 V119 L132 A134	S88-I95 CarbonylContact O-C 3.56Å; S88-I95 VanDerWaalsContact O-CA 3.26Å; S88-I95 WeakPolarHBondContact O-CA 3.49Å; A89-I95 HydrophobicContact CB-CG1 4.14Å; I95-E108 WeakPolarHBondContact O-CA 3.33Å; I95-I109 HydrophobicContact CB-CB 4.23Å; I95-I109 PolarHBondContact N-O 3.49Å; I95-I109 PolarHBondContact O-N 3Å; I95-I116 HydrophobicContact CD1-CD1 3.72Å; I95-I116 HydrophobicContact CG1-CD1 3.22Å; I95-V119 HydrophobicContact CD1-CG2 4.45Å; I95-L132 HydrophobicContact CG2-CD2 3.84Å; I95-A134 HydrophobicContact CD1-CB 3.66Å
96	I	95.1	Very high	92.3	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	130.3	173.6	-56.1	-179.8	0	0	0	107.6	K59 A87 S88 K94 W98 A105 E108	K59-I96 HydrophobicContact CB-CD1 4.06Å; K59-I96 HydrophobicContact CD-CD1 4.3Å; K59-I96 HydrophobicContact CG-CD1 4.23Å; A87-I96 WeakPolarHBondContact CA-O 3.34Å; S88-I96 PolarHBondContact N-O 3.43Å; S88-I96 PolarHBondContact O-N 3.5Å; K94-I96 HydrophobicContact CD-CD1 4.3Å; K94-I96 HydrophobicContact CD-CG1 4.31Å; K94-I96 HydrophobicContact CG-CG1 4.26Å; I96-W98 HydrophobicContact CB-CZ2 4.08Å; I96-W98 HydrophobicContact CD1-CZ2 4.04Å; I96-W98 HydrophobicContact CG2-CD2 3.78Å; I96-W98 HydrophobicContact CG2-CE3 4.33Å; I96-W98 HydrophobicContact CG2-CG 4.28Å; I96-W98 HydrophobicContact CG2-CH2 4.31Å; I96-W98 HydrophobicContact CG2-CZ2 3.67Å; I96-A105 HydrophobicContact CG2-CB 3.45Å; I96-A105 VanDerWaalsContact CG2-CB 3.45Å; I96-E108 HydrophobicContact CG1-CG 4.33Å
97	V	94.9	Very high	92.1	Very high	0 Å²	0	21 Å²	21	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	128.7	171.6	-178.7	0	0	0	0	107.5	L86 A105 Q106 C107 W121 A146	L86-V97 CarbonylContact O-C 3.59Å; L86-V97 WeakPolarHBondContact O-CA 3.47Å; V97-A105 CarbonylContact O-C 3.51Å; V97-A105 WeakPolarHBondContact O-CA 3.36Å; V97-Q106 PolarHBondContact O-N 2.96Å; V97-C107 VanDerWaalsContact CB-SG 3.53Å; V97-C107 WeakPolarHBondContact CG2-SG 3.47Å; V97-C107 PolarHBondContact N-O 2.81Å; V97-C107 PolarHBondContact O-N 3.28Å; V97-W121 HydrophobicContact CG1-CH2 4.05Å; V97-W121 HydrophobicContact CG1-CZ2 4.49Å; V97-W121 HydrophobicContact CG2-CH2 4.44Å; V97-A146 HydrophobicContact CG1-CB 4.41Å; V97-A146 HydrophobicContact CG2-CB 3.97Å
98	W	93.6	Very high	92	Very high	3 Å²	3	25 Å²	25	1%	0.011	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	141.7	-170.1	-57.7	92.4	0	0	0	111.2	L57 K59 R85 L86 S88 I96 V100 A105	L57-W98 HydrophobicContact CB-CD2 4.31Å; L57-W98 HydrophobicContact CB-CE3 4.14Å; L57-W98 HydrophobicContact CB-CH2 3.8Å; L57-W98 HydrophobicContact CB-CZ2 4.08Å; L57-W98 HydrophobicContact CB-CZ3 3.89Å; L57-W98 HydrophobicContact CD1-CB 4.09Å; L57-W98 HydrophobicContact CD1-CD2 3.81Å; L57-W98 HydrophobicContact CD1-CE3 4.1Å; L57-W98 HydrophobicContact CD1-CG 3.82Å; L57-W98 HydrophobicContact CD2-CD2 4.48Å; L57-W98 HydrophobicContact CD2-CE3 3.92Å; L57-W98 HydrophobicContact CD2-CZ3 4.14Å; L57-W98 HydrophobicContact CG-CD2 4.44Å; L57-W98 HydrophobicContact CG-CE3 4.29Å; L57-W98 HydrophobicContact CG-CZ3 4.46Å; K59-W98 HydrophobicContact CB-CH2 3.26Å; K59-W98 HydrophobicContact CB-CZ2 3.99Å; K59-W98 HydrophobicContact CB-CZ3 4.04Å; K59-W98 HydrophobicContact CD-CH2 4.29Å; K59-W98 HydrophobicContact CD-CZ3 4.43Å; K59-W98 HydrophobicContact CG-CH2 4.4Å; R85-W98 WeakPolarHBondContact CA-O 3.39Å; L86-W98 HydrophobicContact CB-CB 4.36Å; L86-W98 PolarHBondContact N-O 3.14Å; L86-W98 VanDerWaalsContact N-O 3.17Å; L86-W98 PolarHBondContact O-N 2.91Å; S88-W98 PolarHBondContact OG-NE1 3.24Å; I96-W98 HydrophobicContact CB-CZ2 4.08Å; I96-W98 HydrophobicContact CD1-CZ2 4.04Å; I96-W98 HydrophobicContact CG2-CD2 3.78Å; I96-W98 HydrophobicContact CG2-CE3 4.33Å; I96-W98 HydrophobicContact CG2-CG 4.28Å; I96-W98 HydrophobicContact CG2-CH2 4.31Å; I96-W98 HydrophobicContact CG2-CZ2 3.67Å; W98-V100 HydrophobicContact CB-CG2 4.28Å; W98-A105 HydrophobicContact CD2-CB 4.45Å; W98-A105 HydrophobicContact CE3-CB 3.94Å; W98-A105 HydrophobicContact CZ3-CB 4.08Å
99	D	91.6	Very high	91.8	Very high	38 Å²	38	25.1 Å²	25.1	20%	0.203	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	103.9	151.4	-172.1	-31.2	0	0	0	107.2	A101 A102 G103 V104 Q106	D99-A101 PolarHBondContact OD1-N 3.1Å; D99-A102 HydrophobicContact CB-CB 4.08Å; D99-A102 PolarHBondContact OD1-N 2.94Å; D99-G103 WeakPolarHBondContact O-CA 3.33Å; D99-G103 PolarHBondContact O-N 3.47Å; D99-V104 PolarHBondContact N-O 3.07Å; D99-V104 PolarHBondContact O-N 3.43Å; D99-V104 VanDerWaalsContact O-N 3.13Å; D99-Q106 HydrophobicContact CB-CG 3.93Å
100	V	91.6	Very high	91.6	Very high	3 Å²	3	30.2 Å²	30.2	2%	0.018	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-41.2	-176.5	-179	0	0	0	0	110	V45 Q55 L57 W69 L84 L86 W98 A102 G103	V45-V100 HydrophobicContact CB-CG1 4.41Å; V45-V100 HydrophobicContact CG1-CG1 4.32Å; V45-V100 HydrophobicContact CG2-CG1 3.88Å; Q55-V100 PolarHBondContact NE2-O 3.5Å; Q55-V100 PolarHBondContact OE1-O 2.89Å; L57-V100 HydrophobicContact CD1-CG2 4.21Å; W69-V100 HydrophobicContact CH2-CB 4.2Å; W69-V100 HydrophobicContact CH2-CG1 4.13Å; W69-V100 HydrophobicContact CH2-CG2 3.68Å; W69-V100 HydrophobicContact CZ3-CB 4.39Å; W69-V100 HydrophobicContact CZ3-CG2 3.71Å; L84-V100 HydrophobicContact CB-CB 3.8Å; L84-V100 HydrophobicContact CB-CG2 4.44Å; L84-V100 HydrophobicContact CD1-CB 4.48Å; L84-V100 WeakPolarHBondContact O-CG2 3.43Å; L84-V100 PolarHBondContact O-N 3.29Å; L86-V100 HydrophobicContact CB-CG2 3.72Å; L86-V100 HydrophobicContact CD2-CG2 4.27Å; W98-V100 HydrophobicContact CB-CG2 4.28Å; V100-A102 VanDerWaalsContact C-N 3.28Å; V100-A102 PolarHBondContact O-N 3.19Å; V100-G103 PolarHBondContact O-N 3.16Å
101	A	88.3	Confident	91.1	Very high	25 Å²	25	32.7 Å²	32.7	21%	0.207	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-40.7	179.3	0	0	0	0	0	111.9	L84 D99 M832	L84-A101 HydrophobicContact CD1-CB 4.42Å; D99-A101 PolarHBondContact OD1-N 3.1Å; A101-M832 PolarHBondContact O-N 3.39Å
102	A	86.7	Confident	90.6	Very high	24 Å²	24	34.2 Å²	34.2	20%	0.198	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-20	175.9	0	0	0	0	0	114.2	D99 V100 V104 R831	D99-A102 HydrophobicContact CB-CB 4.08Å; D99-A102 PolarHBondContact OD1-N 2.94Å; V100-A102 VanDerWaalsContact C-N 3.28Å; V100-A102 PolarHBondContact O-N 3.19Å; A102-V104 VanDerWaalsContact C-N 3.3Å; A102-V104 HydrophobicContact CB-CB 4.47Å; A102-V104 HydrophobicContact CB-CG2 4.3Å; A102-R831 WeakPolarHBondContact O-CG 3.36Å
103	G	87.4	Confident	90.3	Very high	11 Å²	11	34.5 Å²	34.5	11%	0.113	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.8	25.3	-173.8	0	0	0	0	0	114.1	D99 V100	D99-G103 WeakPolarHBondContact O-CA 3.33Å; D99-G103 PolarHBondContact O-N 3.47Å; V100-G103 PolarHBondContact O-N 3.16Å
104	V	89.9	Confident	90.2	Very high	86 Å²	86	39.9 Å²	39.9	52%	0.521	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	140.2	-174	-178.5	0	0	0	0	110.2	D99 A102 Q106	D99-V104 PolarHBondContact N-O 3.07Å; D99-V104 PolarHBondContact O-N 3.43Å; D99-V104 VanDerWaalsContact O-N 3.13Å; A102-V104 VanDerWaalsContact C-N 3.3Å; A102-V104 HydrophobicContact CB-CB 4.47Å; A102-V104 HydrophobicContact CB-CG2 4.3Å; V104-Q106 PolarHBondContact O-N 3.12Å
105	A	91.6	Very high	90	Very high	17 Å²	17	40.9 Å²	40.9	14%	0.14	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	116.5	169.9	0	0	0	0	0	110.1	K59 I96 V97 W98	K59-A105 HydrophobicContact CD-CB 3.54Å; K59-A105 VanDerWaalsContact NZ-CB 3.32Å; I96-A105 HydrophobicContact CG2-CB 3.45Å; I96-A105 VanDerWaalsContact CG2-CB 3.45Å; V97-A105 CarbonylContact O-C 3.51Å; V97-A105 WeakPolarHBondContact O-CA 3.36Å; W98-A105 HydrophobicContact CD2-CB 4.45Å; W98-A105 HydrophobicContact CE3-CB 3.94Å; W98-A105 HydrophobicContact CZ3-CB 4.08Å
106	Q	89.6	Confident	89.8	Confident	70 Å²	70	40.9 Å²	40.9	33%	0.327	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	-47.5	176.6	-69.3	-176.1	-12.9	0	0	111.2	V97 D99 V104	V97-Q106 PolarHBondContact O-N 2.96Å; D99-Q106 HydrophobicContact CB-CG 3.93Å; V104-Q106 PolarHBondContact O-N 3.12Å
107	C	90.8	Very high	89.5	Confident	14 Å²	14	44.4 Å²	44.4	10%	0.095	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	156.6	176.2	83.3	0	0	0	0	112.3	V97 A146	V97-C107 VanDerWaalsContact CB-SG 3.53Å; V97-C107 WeakPolarHBondContact CG2-SG 3.47Å; V97-C107 PolarHBondContact N-O 2.81Å; V97-C107 PolarHBondContact O-N 3.28Å; C107-A146 PolarHBondContact SG-O 2.91Å
108	E	92.8	Very high	89.3	Confident	87 Å²	87	45.3 Å²	45.3	41%	0.407	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	128.2	172.2	-58.3	-168.4	158.7	0	0	109	K59 K94 I95 I96	K59-E108 WeakPolarHBondContact CD-OE1 3.35Å; K59-E108 WeakPolarHBondContact CE-OE1 3.4Å; K59-E108 IonicContact NZ-OE1 3.51Å; K59-E108 PolarHBondContact NZ-OE1 3.45Å; K94-E108 WeakPolarHBondContact CE-OE2 3.23Å; K94-E108 IonicContact NZ-OE1 3.28Å; K94-E108 PolarHBondContact NZ-OE1 3.02Å; K94-E108 IonicContact NZ-OE2 2.96Å; K94-E108 PolarHBondContact NZ-OE2 2.93Å; I95-E108 WeakPolarHBondContact O-CA 3.33Å; I96-E108 HydrophobicContact CG1-CG 4.33Å
109	I	92.9	Very high	89.3	Confident	4 Å²	4	45.4 Å²	45.4	2%	0.021	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	130.8	-174.1	-56.9	170	0	0	0	108	K94 I95 W144	K94-I109 CarbonylContact C-O 3.48Å; K94-I109 WeakPolarHBondContact CA-O 3.39Å; I95-I109 HydrophobicContact CB-CB 4.23Å; I95-I109 PolarHBondContact N-O 3.49Å; I95-I109 PolarHBondContact O-N 3Å; I109-W144 HydrophobicContact CD1-CB 4.11Å; I109-W144 HydrophobicContact CD1-CD2 4.32Å; I109-W144 HydrophobicContact CD1-CE3 4.38Å; I109-W144 HydrophobicContact CD1-CG 4.21Å; I109-W144 HydrophobicContact CG2-CD2 3.5Å; I109-W144 VanDerWaalsContact CG2-CD2 3.5Å; I109-W144 VanDerWaalsContact CG2-CE2 3.49Å; I109-W144 HydrophobicContact CG2-CE3 3.49Å; I109-W144 VanDerWaalsContact CG2-CE3 3.49Å; I109-W144 HydrophobicContact CG2-CG 4.25Å; I109-W144 HydrophobicContact CG2-CH2 3.56Å; I109-W144 HydrophobicContact CG2-CZ2 3.55Å; I109-W144 HydrophobicContact CG2-CZ3 3.51Å
110	Q	89.7	Confident	89.3	Confident	108 Å²	108	45.7 Å²	45.7	51%	0.505	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	124.2	173.8	-169.1	174.2	20.2	0	0	110	N92	N92-Q110 PolarHBondContact O-NE2 2.92Å
111	E	82.7	Confident	89.3	Confident	54 Å²	54	46 Å²	46	25%	0.252	25%	0.254	S	S	.	.	S	Bend	trans	-107.6	-41.3	174.3	-179.5	92.7	167.4	0	0	111	W144 K151 K154	E111-W144 HydrophobicContact CB-CH2 4.42Å; E111-W144 HydrophobicContact CB-CZ2 4.14Å; E111-K151 VanDerWaalsContact CD-NZ 3.25Å; E111-K151 IonicContact OE1-NZ 2.6Å; E111-K151 PolarHBondContact OE1-NZ 3.33Å; E111-K151 IonicContact OE2-NZ 2.76Å; E111-K151 PolarHBondContact OE2-NZ 2.85Å; E111-K154 IonicContact OE1-NZ 2.94Å; E111-K154 PolarHBondContact OE1-NZ 2.7Å
112	H	82.1	Confident	89.3	Confident	66 Å²	66	45.8 Å²	45.8	31%	0.306	25%	0.249	S	C	.	.			trans	-139.7	151.5	-175.3	-67.7	-50.7	0	0	0	111.6	G93 K114 K154	G93-H112 WeakPolarHBondContact CA-O 3.23Å; H112-K114 VanDerWaalsContact C-N 3.28Å; H112-K114 PolarHBondContact O-N 3.41Å; H112-K114 VanDerWaalsContact O-N 3.16Å; H112-K154 PolarHBondContact NE2-NZ 3.4Å
113	A	86.4	Confident	88.9	Confident	83 Å²	83	47.3 Å²	47.3	69%	0.686	25%	0.25	S	C	*	.	S	Bend	trans	-87.3	55.3	177.8	0	0	0	0	0	112.3	N92	N92-A113 VanDerWaalsContact O-CA 3.3Å; N92-A113 WeakPolarHBondContact O-CA 3.46Å
114	K	88.9	Confident	88	Confident	113 Å²	113	49.1 Å²	49.1	49%	0.491	26%	0.257	S	S	.	.	S	Bend	trans	-141.4	152.1	-179.6	-74.5	-169.1	178.5	-176.7	0	110.9	V91 G93 H112 I116 P137	V91-K114 CarbonylContact O-C 3.46Å; V91-K114 VanDerWaalsContact O-C 3.26Å; G93-K114 WeakPolarHBondContact CA-O 3.36Å; G93-K114 PolarHBondContact N-O 3.28Å; H112-K114 VanDerWaalsContact C-N 3.28Å; H112-K114 PolarHBondContact O-N 3.41Å; H112-K114 VanDerWaalsContact O-N 3.16Å; K114-I116 PolarHBondContact O-N 3.48Å; K114-P137 HydrophobicContact CB-CB 4.18Å; K114-P137 HydrophobicContact CB-CG 3.99Å; K114-P137 HydrophobicContact CD-CB 4.14Å
115	P	87.9	Confident	87	Confident	52 Å²	52	46.2 Å²	46.2	34%	0.338	24%	0.237	S	C	.	.			trans	-65.7	126.9	-173.3	25.1	-35.2	0	0	0	111.3	V91 Q117 P137	V91-P115 HydrophobicContact CG1-CB 4.35Å; V91-P115 WeakPolarHBondContact O-CA 3.34Å; V91-P115 WeakPolarHBondContact O-CD 3.28Å; P115-Q117 PolarHBondContact O-N 2.91Å; P115-P137 VanDerWaalsContact O-CD 3.26Å; P115-P137 WeakPolarHBondContact O-CD 3.42Å; P115-P137 WeakPolarHBondContact O-CG 3.32Å
116	I	91.1	Very high	85.7	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.005	24%	0.236	C	C	.	.			trans	-67.4	131.2	177.4	-71.2	152.8	0	0	0	109.5	A89 I95 K114 V119	A89-I116 HydrophobicContact CB-CB 4.04Å; A89-I116 HydrophobicContact CB-CD1 3.64Å; A89-I116 HydrophobicContact CB-CG1 4.48Å; A89-I116 HydrophobicContact CB-CG2 4.17Å; I95-I116 HydrophobicContact CD1-CD1 3.72Å; I95-I116 HydrophobicContact CG1-CD1 3.22Å; K114-I116 PolarHBondContact O-N 3.48Å; I116-V119 HydrophobicContact CG2-CG2 3.44Å; I116-V119 VanDerWaalsContact CG2-CG2 3.44Å
117	Q	90.1	Very high	84.4	Confident	73 Å²	73	45.4 Å²	45.4	34%	0.341	24%	0.24	S	C	.	.			trans	-79.6	-45.8	-176.2	-65.8	-60.9	-34.4	0	0	111.3	K66 P115 I135 P137	K66-Q117 WeakPolarHBondContact CE-O 3.47Å; P115-Q117 PolarHBondContact O-N 2.91Å; Q117-I135 HydrophobicContact CB-CB 4.29Å; Q117-I135 HydrophobicContact CB-CG2 3.97Å; Q117-I135 HydrophobicContact CG-CG2 4.42Å; Q117-I135 PolarHBondContact N-O 3.32Å; Q117-P137 HydrophobicContact CG-CG 4.21Å
118	D	90.8	Very high	83	Confident	20 Å²	20	47.5 Å²	47.5	11%	0.107	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	155.3	180	-148.7	9.8	0	0	0	112.2	K66 I135 F164	K66-D118 WeakPolarHBondContact CE-OD1 3.27Å; K66-D118 IonicContact NZ-OD1 3.17Å; K66-D118 PolarHBondContact NZ-OD1 3.39Å; D118-I135 HydrophobicContact CB-CD1 4.44Å; D118-I135 PolarHBondContact O-N 2.88Å; D118-F164 HydrophobicContact CB-CD1 3.85Å; D118-F164 HydrophobicContact CB-CE1 3.75Å
119	V	92.9	Very high	81.6	Confident	5 Å²	5	51.1 Å²	51.1	3%	0.03	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	139.1	-177.8	179.7	0	0	0	0	108.7	K68 A89 I95 I116 L132 L133 A134	K68-V119 WeakPolarHBondContact CG-O 3.14Å; A89-V119 HydrophobicContact CB-CG2 4.31Å; I95-V119 HydrophobicContact CD1-CG2 4.45Å; I116-V119 HydrophobicContact CG2-CG2 3.44Å; I116-V119 VanDerWaalsContact CG2-CG2 3.44Å; V119-L132 HydrophobicContact CG1-CD1 3.41Å; V119-L132 VanDerWaalsContact CG1-CD1 3.41Å; V119-L132 HydrophobicContact CG1-CD2 3.91Å; V119-L132 HydrophobicContact CG1-CG 3.69Å; V119-L133 WeakPolarHBondContact CA-O 3.03Å; V119-A134 HydrophobicContact CG2-CB 4.27Å
120	Q	91.9	Very high	80.9	Confident	43 Å²	43	51.6 Å²	51.6	20%	0.201	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	140.4	174.5	-165.5	174	0.1	0	0	111.9	L133 F164	Q120-L133 PolarHBondContact N-O 3.42Å; Q120-L133 PolarHBondContact O-N 2.96Å; Q120-F164 HydrophobicContact CB-CE1 4.48Å; Q120-F164 HydrophobicContact CB-CE2 3.67Å; Q120-F164 HydrophobicContact CB-CZ 3.43Å; Q120-F164 VanDerWaalsContact CB-CZ 3.43Å
121	W	91.1	Very high	80.9	Confident	11 Å²	11	46.8 Å²	46.8	4%	0.042	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	139.6	170.6	-64.6	99.6	0	0	0	111.2	K68 W69 A70 A87 V97 D130 L132 A146	K68-W121 PolarHBondContact O-NE1 3.27Å; W69-W121 VanDerWaalsContact C-CD1 3.43Å; W69-W121 PolarHBondContact O-NE1 2.8Å; A70-W121 HydrophobicContact CB-CD2 4.2Å; A70-W121 HydrophobicContact CB-CZ2 4.3Å; A87-W121 HydrophobicContact CB-CZ2 3.57Å; V97-W121 HydrophobicContact CG1-CH2 4.05Å; V97-W121 HydrophobicContact CG1-CZ2 4.49Å; V97-W121 HydrophobicContact CG2-CH2 4.44Å; W121-D130 HydrophobicContact CZ3-CB 3.76Å; W121-L132 HydrophobicContact CD2-CD1 3.56Å; W121-L132 HydrophobicContact CE3-CB 4.33Å; W121-L132 HydrophobicContact CE3-CD1 3.82Å; W121-L132 HydrophobicContact CG-CD1 3.98Å; W121-L132 HydrophobicContact CH2-CD1 4.34Å; W121-L132 HydrophobicContact CZ2-CD1 4.11Å; W121-L132 HydrophobicContact CZ3-CB 4.27Å; W121-L132 HydrophobicContact CZ3-CD1 4.17Å; W121-A146 HydrophobicContact CH2-CB 3.52Å; W121-A146 HydrophobicContact CZ3-CB 3.4Å; W121-A146 VanDerWaalsContact CZ3-CB 3.4Å
122	L	87.6	Confident	81.3	Confident	20 Å²	20	44.2 Å²	44.2	11%	0.105	23%	0.233	C	C	.	.			trans	-78.4	133.6	173.4	-66.2	-174.8	0	0	0	111.1	L131 L143 F166 F188 P190	L122-L131 HydrophobicContact CB-CB 4.28Å; L122-L131 HydrophobicContact CD1-CB 3.82Å; L122-L131 HydrophobicContact CD1-CD1 4.14Å; L122-L131 HydrophobicContact CG-CB 4.2Å; L122-L131 PolarHBondContact N-O 3.33Å; L122-L143 HydrophobicContact CD1-CD1 3.72Å; L122-L143 HydrophobicContact CD1-CD2 4.49Å; L122-L143 HydrophobicContact CG-CD1 4.32Å; L122-F166 HydrophobicContact CD2-CE1 4.31Å; L122-F166 HydrophobicContact CD2-CE2 3.76Å; L122-F166 HydrophobicContact CD2-CZ 3.49Å; L122-F166 VanDerWaalsContact CD2-CZ 3.49Å; L122-F188 HydrophobicContact CD1-CE1 4.13Å; L122-F188 HydrophobicContact CD1-CZ 4.09Å; L122-F188 HydrophobicContact CD2-CE1 3.87Å; L122-F188 HydrophobicContact CD2-CZ 3.88Å; L122-P190 HydrophobicContact CD1-CG 4.41Å
123	W	77.9	Confident	81.8	Confident	56 Å²	56	41.1 Å²	41.1	21%	0.212	22%	0.218	C	C	.	.			trans	-110.8	0.5	-175.6	59.3	-92.8	0	0	0	113.9	N73 Q125 P168 P171	N73-W123 WeakPolarHBondContact ND2-CA 3.47Å; N73-W123 PolarHBondContact ND2-O 3.29Å; W123-Q125 VanDerWaalsContact C-N 3.32Å; W123-Q125 PolarHBondContact O-N 2.9Å; W123-P168 WeakPolarHBondContact CH2-O 3.48Å; W123-P171 HydrophobicContact CH2-CB 4.13Å; W123-P171 HydrophobicContact CH2-CG 4.26Å; W123-P171 HydrophobicContact CZ2-CB 3.97Å
124	N	70.1	Confident	82.2	Confident	48 Å²	48	37.1 Å²	37.1	26%	0.257	19%	0.186	S	C	.	.			trans	-95.6	32.9	-174.9	-171.4	36.7	0	0	0	113.5	P171 Q1123	N124-P171 HydrophobicContact CB-CB 3.63Å; N124-P171 HydrophobicContact CB-CG 3.78Å; N124-P171 WeakPolarHBondContact ND2-CG 3.27Å; N124-Q1123 PolarHBondContact ND2-NE2 3.05Å
125	Q	68.7	Low	82.3	Confident	25 Å²	25	31.8 Å²	31.8	12%	0.117	16%	0.162	C	C	.	.			trans	-128.4	125.8	-175.8	-65.9	-177.6	79.9	0	0	110.4	N73 W123 A127 R129 L131	N73-Q125 PolarHBondContact ND2-O 3.36Å; N73-Q125 VanDerWaalsContact ND2-O 3.15Å; W123-Q125 VanDerWaalsContact C-N 3.32Å; W123-Q125 PolarHBondContact O-N 2.9Å; Q125-A127 PolarHBondContact O-N 3.2Å; Q125-R129 PolarHBondContact NE2-O 3.05Å; Q125-L131 VanDerWaalsContact NE2-CG 3.33Å
126	D	63.8	Low	82.4	Confident	22 Å²	22	29.3 Å²	29.3	12%	0.118	15%	0.146	C	C	.	.	S	Bend	trans	-78.9	-8.8	177	-69.2	-14.9	0	0	0	113.2	K1124 S1125	D126-K1124 VanDerWaalsContact OD2-CA 3.32Å; D126-K1124 WeakPolarHBondContact OD2-CA 3.35Å; D126-K1124 WeakPolarHBondContact OD2-CB 3.17Å; D126-K1124 PolarHBondContact OD2-N 3.34Å; D126-S1125 WeakPolarHBondContact OD1-CB 3.38Å; D126-S1125 PolarHBondContact OD1-OG 2.96Å; D126-S1125 PolarHBondContact OD2-N 2.91Å
127	A	62.9	Low	81.9	Confident	49 Å²	49	30 Å²	30	41%	0.405	15%	0.151	S	C	.	.	S	Bend	trans	-114.2	148.6	175.3	0	0	0	0	0	109.6	Q125 R129	Q125-A127 PolarHBondContact O-N 3.2Å; A127-R129 PolarHBondContact O-N 3.4Å
128	S	59.8	Low	81.4	Confident	57 Å²	57	29 Å²	29	40%	0.399	15%	0.15	S	C	.	.			trans	-65	73.5	175.7	62.2	0	0	0	0	111.1
129	R	65.3	Low	81.2	Confident	164 Å²	164	29.1 Å²	29.1	62%	0.619	15%	0.151	S	C	*	.			trans	-112.4	97.2	167.9	-73.4	-176.6	-178.7	177	2.8	105.5	Q125 A127 L131	Q125-R129 PolarHBondContact NE2-O 3.05Å; A127-R129 PolarHBondContact O-N 3.4Å; R129-L131 HydrophobicContact CB-CD2 4.41Å; R129-L131 HydrophobicContact CB-CG 4.15Å; R129-L131 PolarHBondContact O-N 3.44Å
130	D	77.4	Confident	81	Confident	14 Å²	14	32 Å²	32	8%	0.075	16%	0.162	C	C	.	.			trans	-71.9	77.4	-179.4	-84.3	30.3	0	0	0	108.8	R85 W121 A146	R85-D130 WeakPolarHBondContact CD-OD2 3.35Å; R85-D130 IonicContact CZ-OD2 3.74Å; R85-D130 IonicContact NE-OD2 3.97Å; R85-D130 IonicContact NH1-OD1 2.76Å; R85-D130 IonicContact NH1-OD2 3.19Å; R85-D130 PolarHBondContact NH1-OD2 3.37Å; W121-D130 HydrophobicContact CZ3-CB 3.76Å; D130-A146 HydrophobicContact CB-CB 4.07Å; D130-A146 WeakPolarHBondContact O-CA 3.45Å; D130-A146 WeakPolarHBondContact O-CB 3.49Å; D130-A146 PolarHBondContact O-N 3.02Å
131	L	89.1	Confident	81	Confident	7 Å²	7	30 Å²	30	4%	0.037	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	127.2	-179.2	-61.1	-167.7	0	0	0	109.6	L122 Q125 R129 L143 W144 N145 L152 P190	L122-L131 HydrophobicContact CB-CB 4.28Å; L122-L131 HydrophobicContact CD1-CB 3.82Å; L122-L131 HydrophobicContact CD1-CD1 4.14Å; L122-L131 HydrophobicContact CG-CB 4.2Å; L122-L131 PolarHBondContact N-O 3.33Å; Q125-L131 VanDerWaalsContact NE2-CG 3.33Å; R129-L131 HydrophobicContact CB-CD2 4.41Å; R129-L131 HydrophobicContact CB-CG 4.15Å; R129-L131 PolarHBondContact O-N 3.44Å; L131-L143 HydrophobicContact CB-CD1 4.19Å; L131-L143 HydrophobicContact CD1-CD2 4.3Å; L131-W144 WeakPolarHBondContact CA-O 3.48Å; L131-N145 HydrophobicContact CD2-CB 4.24Å; L131-L152 HydrophobicContact CD1-CD1 4.02Å; L131-L152 HydrophobicContact CD2-CD1 3.61Å; L131-L152 HydrophobicContact CG-CD1 4.45Å; L131-P190 HydrophobicContact CD1-CB 3.92Å
132	L	92.2	Very high	81.1	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	118.7	-176.2	-168.4	71.5	0	0	0	109.8	A87 I95 V119 W121 W144 A146	A87-L132 HydrophobicContact CB-CD1 4.1Å; A87-L132 HydrophobicContact CB-CD2 4.06Å; I95-L132 HydrophobicContact CG2-CD2 3.84Å; V119-L132 HydrophobicContact CG1-CD1 3.41Å; V119-L132 VanDerWaalsContact CG1-CD1 3.41Å; V119-L132 HydrophobicContact CG1-CD2 3.91Å; V119-L132 HydrophobicContact CG1-CG 3.69Å; W121-L132 HydrophobicContact CD2-CD1 3.56Å; W121-L132 HydrophobicContact CE3-CB 4.33Å; W121-L132 HydrophobicContact CE3-CD1 3.82Å; W121-L132 HydrophobicContact CG-CD1 3.98Å; W121-L132 HydrophobicContact CH2-CD1 4.34Å; W121-L132 HydrophobicContact CZ2-CD1 4.11Å; W121-L132 HydrophobicContact CZ3-CB 4.27Å; W121-L132 HydrophobicContact CZ3-CD1 4.17Å; L132-W144 HydrophobicContact CB-CB 4.43Å; L132-W144 PolarHBondContact N-O 3.08Å; L132-W144 PolarHBondContact O-N 3.39Å; L132-A146 HydrophobicContact CB-CB 4.34Å
133	L	92.6	Very high	81.3	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	124.8	172.9	-166.3	71.3	0	0	0	109	V119 Q120 I141 L143 W153 F164 F166 F188	V119-L133 WeakPolarHBondContact CA-O 3.03Å; Q120-L133 PolarHBondContact N-O 3.42Å; Q120-L133 PolarHBondContact O-N 2.96Å; L133-I141 HydrophobicContact CD1-CG2 3.38Å; L133-I141 HydrophobicContact CD2-CG2 4.07Å; L133-I141 HydrophobicContact CG-CG2 3.78Å; L133-L143 HydrophobicContact CB-CD1 4.23Å; L133-L143 HydrophobicContact CD1-CB 4.05Å; L133-L143 HydrophobicContact CD1-CD1 3.9Å; L133-W153 HydrophobicContact CD1-CH2 4.03Å; L133-F164 HydrophobicContact CB-CZ 4.33Å; L133-F164 HydrophobicContact CD2-CD2 4.26Å; L133-F164 HydrophobicContact CD2-CE2 3.74Å; L133-F164 HydrophobicContact CD2-CZ 4.07Å; L133-F164 HydrophobicContact CG-CZ 4.37Å; L133-F166 HydrophobicContact CD2-CE2 4.02Å; L133-F166 HydrophobicContact CD2-CZ 3.75Å; L133-F188 HydrophobicContact CD1-CE2 4.2Å; L133-F188 HydrophobicContact CD1-CZ 4.5Å; L133-F188 HydrophobicContact CD2-CE2 4.12Å; L133-F188 HydrophobicContact CD2-CZ 4.42Å
134	A	93.2	Very high	82	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	138.1	-179.7	0	0	0	0	0	111.8	I95 V119 V142	I95-A134 HydrophobicContact CD1-CB 3.66Å; V119-A134 HydrophobicContact CG2-CB 4.27Å; A134-V142 PolarHBondContact N-O 3.45Å; A134-V142 PolarHBondContact O-N 2.99Å
135	I	92.1	Very high	83	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	111.5	172.1	-59.5	-166.7	0	0	0	109.5	Q117 D118 Y140 I141 I161 F164	Q117-I135 HydrophobicContact CB-CB 4.29Å; Q117-I135 HydrophobicContact CB-CG2 3.97Å; Q117-I135 HydrophobicContact CG-CG2 4.42Å; Q117-I135 PolarHBondContact N-O 3.32Å; D118-I135 HydrophobicContact CB-CD1 4.44Å; D118-I135 PolarHBondContact O-N 2.88Å; I135-Y140 WeakPolarHBondContact CA-O 3.49Å; I135-I141 HydrophobicContact CG1-CG1 4.42Å; I135-I161 HydrophobicContact CD1-CB 4.36Å; I135-I161 HydrophobicContact CD1-CG2 3.59Å; I135-I161 HydrophobicContact CG2-CB 4.1Å; I135-I161 HydrophobicContact CG2-CG2 4.4Å; I135-F164 HydrophobicContact CD1-CB 4Å; I135-F164 HydrophobicContact CD1-CD1 3.21Å; I135-F164 HydrophobicContact CD1-CE1 3.92Å; I135-F164 HydrophobicContact CD1-CG 3.95Å; I135-F164 HydrophobicContact CG1-CD1 3.62Å; I135-F164 HydrophobicContact CG1-CE1 3.79Å
136	H	90.1	Very high	83.9	Confident	1 Å²	1	24.7 Å²	24.7	1%	0.005	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	129.8	174.7	-65.6	-87.5	0	0	0	110	Y140 W144	H136-Y140 PolarHBondContact N-O 3.46Å; H136-Y140 PolarHBondContact O-N 3.5Å; H136-W144 AromaticContact NE2-NE1 3.44Å; H136-W144 PolarHBondContact NE2-NE1 3.06Å
137	P	81.4	Confident	85	Confident	15 Å²	15	26.6 Å²	26.6	10%	0.097	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	149	174	-18.4	27.6	0	0	0	111.7	K114 P115 Q117	K114-P137 HydrophobicContact CB-CB 4.18Å; K114-P137 HydrophobicContact CB-CG 3.99Å; K114-P137 HydrophobicContact CD-CB 4.14Å; P115-P137 VanDerWaalsContact O-CD 3.26Å; P115-P137 WeakPolarHBondContact O-CD 3.42Å; P115-P137 WeakPolarHBondContact O-CG 3.32Å; Q117-P137 HydrophobicContact CG-CG 4.21Å
138	P	77.8	Confident	86.1	Confident	51 Å²	51	28.3 Å²	28.3	33%	0.331	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	cis	-81.7	-32.6	0.9	25.9	-26.8	0	0	0	114.7	N160 I161	P138-N160 VanDerWaalsContact CB-OD1 3.32Å; P138-N160 WeakPolarHBondContact CB-OD1 3.33Å; P138-N160 VanDerWaalsContact O-CA 3.3Å; P138-N160 WeakPolarHBondContact O-CA 3.44Å; P138-N160 PolarHBondContact O-OD1 3.18Å; P138-I161 PolarHBondContact O-N 3.01Å
139	N	86.8	Confident	87.5	Confident	23 Å²	23	26.6 Å²	26.6	12%	0.123	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-151.8	26.4	-163.2	57.2	-1.2	0	0	0	113.5	Y157 D159	N139-Y157 WeakPolarHBondContact CB-O 3.37Å; N139-Y157 PolarHBondContact ND2-O 2.94Å; N139-Y157 PolarHBondContact O-N 3.21Å; N139-D159 WeakPolarHBondContact CB-O 3.41Å
140	Y	89.7	Confident	88.7	Confident	65 Å²	65	22.2 Å²	22.2	26%	0.255	13%	0.128	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	139.2	-177.1	-58.8	-71	0	0	0	112.2	I135 H136 K154 K155 S156	I135-Y140 WeakPolarHBondContact CA-O 3.49Å; H136-Y140 PolarHBondContact N-O 3.46Å; H136-Y140 PolarHBondContact O-N 3.5Å; Y140-K154 HydrophobicContact CD1-CD 4.4Å; Y140-K154 HydrophobicContact CD1-CG 4.38Å; Y140-K155 WeakPolarHBondContact CA-O 3.36Å; Y140-S156 WeakPolarHBondContact CE1-OG 3.43Å
141	I	91.9	Very high	89.4	Confident	2 Å²	2	26 Å²	26	1%	0.01	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	129.7	164.3	-58	-176	0	0	0	107.7	L133 I135 W153 K154 K155 Y157 I161 L176	L133-I141 HydrophobicContact CD1-CG2 3.38Å; L133-I141 HydrophobicContact CD2-CG2 4.07Å; L133-I141 HydrophobicContact CG-CG2 3.78Å; I135-I141 HydrophobicContact CG1-CG1 4.42Å; I141-W153 HydrophobicContact CG2-CH2 4.42Å; I141-W153 HydrophobicContact CG2-CZ3 4.31Å; I141-K154 WeakPolarHBondContact O-CA 3.19Å; I141-K155 PolarHBondContact N-O 3.13Å; I141-K155 PolarHBondContact O-N 2.92Å; I141-Y157 HydrophobicContact CB-CE2 4.43Å; I141-Y157 HydrophobicContact CD1-CD2 4.29Å; I141-Y157 HydrophobicContact CD1-CE2 3.68Å; I141-Y157 HydrophobicContact CG1-CD2 4.31Å; I141-Y157 HydrophobicContact CG1-CE2 3.97Å; I141-I161 HydrophobicContact CD1-CD1 4.02Å; I141-I161 HydrophobicContact CG1-CD1 3.77Å; I141-L176 HydrophobicContact CD1-CD1 3.7Å; I141-L176 HydrophobicContact CD1-CD2 3.53Å; I141-L176 HydrophobicContact CD1-CG 4.27Å
142	V	92.5	Very high	89.5	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	130.6	179.4	-172	0	0	0	0	109.3	A134 W144 K151 K154	A134-V142 PolarHBondContact N-O 3.45Å; A134-V142 PolarHBondContact O-N 2.99Å; V142-W144 HydrophobicContact CB-CZ2 4.37Å; V142-W144 HydrophobicContact CG1-CD2 4.04Å; V142-W144 HydrophobicContact CG1-CG 4.38Å; V142-W144 HydrophobicContact CG1-CH2 4.46Å; V142-W144 HydrophobicContact CG1-CZ2 3.62Å; V142-K151 HydrophobicContact CG1-CD 3.62Å; V142-K151 HydrophobicContact CG1-CG 3.69Å; V142-K154 HydrophobicContact CG2-CB 4.22Å; V142-K154 HydrophobicContact CG2-CD 4.26Å; V142-K154 HydrophobicContact CG2-CG 3.96Å
143	L	92.8	Very high	89.5	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	124.5	172.2	-173.2	69.5	0	0	0	109.6	L122 L131 L133 L152 W153 P190	L122-L143 HydrophobicContact CD1-CD1 3.72Å; L122-L143 HydrophobicContact CD1-CD2 4.49Å; L122-L143 HydrophobicContact CG-CD1 4.32Å; L131-L143 HydrophobicContact CB-CD1 4.19Å; L131-L143 HydrophobicContact CD1-CD2 4.3Å; L133-L143 HydrophobicContact CB-CD1 4.23Å; L133-L143 HydrophobicContact CD1-CB 4.05Å; L133-L143 HydrophobicContact CD1-CD1 3.9Å; L143-L152 HydrophobicContact CB-CB 4.5Å; L143-L152 HydrophobicContact CD2-CB 4.39Å; L143-L152 HydrophobicContact CD2-CD1 3.85Å; L143-L152 HydrophobicContact CG-CB 4.47Å; L143-L152 HydrophobicContact CG-CD1 4.1Å; L143-L152 PolarHBondContact O-N 2.95Å; L143-W153 HydrophobicContact CB-CD2 3.98Å; L143-W153 HydrophobicContact CB-CE3 4.43Å; L143-W153 HydrophobicContact CB-CG 4.48Å; L143-W153 HydrophobicContact CB-CH2 4.22Å; L143-W153 HydrophobicContact CB-CZ2 3.76Å; L143-W153 HydrophobicContact CD2-CZ2 3.91Å; L143-W153 VanDerWaalsContact CD2-NE1 3.32Å; L143-W153 HydrophobicContact CG-CZ2 4.38Å; L143-W153 PolarHBondContact N-O 2.99Å; L143-W153 VanDerWaalsContact N-O 3.1Å; L143-P190 HydrophobicContact CD2-CB 4.4Å
144	W	92.3	Very high	89.5	Confident	13 Å²	13	33.9 Å²	33.9	5%	0.049	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	146.8	-178.9	-60.3	95.1	0	0	0	110.7	I109 E111 L131 L132 H136 V142 K151	I109-W144 HydrophobicContact CD1-CB 4.11Å; I109-W144 HydrophobicContact CD1-CD2 4.32Å; I109-W144 HydrophobicContact CD1-CE3 4.38Å; I109-W144 HydrophobicContact CD1-CG 4.21Å; I109-W144 HydrophobicContact CG2-CD2 3.5Å; I109-W144 VanDerWaalsContact CG2-CD2 3.5Å; I109-W144 VanDerWaalsContact CG2-CE2 3.49Å; I109-W144 HydrophobicContact CG2-CE3 3.49Å; I109-W144 VanDerWaalsContact CG2-CE3 3.49Å; I109-W144 HydrophobicContact CG2-CG 4.25Å; I109-W144 HydrophobicContact CG2-CH2 3.56Å; I109-W144 HydrophobicContact CG2-CZ2 3.55Å; I109-W144 HydrophobicContact CG2-CZ3 3.51Å; E111-W144 HydrophobicContact CB-CH2 4.42Å; E111-W144 HydrophobicContact CB-CZ2 4.14Å; L131-W144 WeakPolarHBondContact CA-O 3.48Å; L132-W144 HydrophobicContact CB-CB 4.43Å; L132-W144 PolarHBondContact N-O 3.08Å; L132-W144 PolarHBondContact O-N 3.39Å; H136-W144 AromaticContact NE2-NE1 3.44Å; H136-W144 PolarHBondContact NE2-NE1 3.06Å; V142-W144 HydrophobicContact CB-CZ2 4.37Å; V142-W144 HydrophobicContact CG1-CD2 4.04Å; V142-W144 HydrophobicContact CG1-CG 4.38Å; V142-W144 HydrophobicContact CG1-CH2 4.46Å; V142-W144 HydrophobicContact CG1-CZ2 3.62Å; W144-K151 HydrophobicContact CE3-CB 3.86Å; W144-K151 HydrophobicContact CH2-CB 4.06Å; W144-K151 HydrophobicContact CH2-CD 4.2Å; W144-K151 HydrophobicContact CH2-CG 4.47Å; W144-K151 HydrophobicContact CZ2-CD 4.48Å; W144-K151 HydrophobicContact CZ3-CB 3.57Å; W144-K151 HydrophobicContact CZ3-CG 4.39Å
145	N	90.9	Very high	89.4	Confident	35 Å²	35	36.1 Å²	36.1	19%	0.187	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	113.4	157.8	-177.6	-14.8	0	0	0	107.6	L131 D147 T148 G149 T150	L131-N145 HydrophobicContact CD2-CB 4.24Å; N145-D147 WeakPolarHBondContact OD1-CB 3.34Å; N145-D147 PolarHBondContact OD1-N 3.27Å; N145-D147 VanDerWaalsContact OD1-N 3.09Å; N145-T148 PolarHBondContact ND2-OG1 3.3Å; N145-G149 CarbonylContact O-C 3.11Å; N145-G149 WeakPolarHBondContact O-CA 3.48Å; N145-G149 PolarHBondContact O-N 3.48Å; N145-T150 PolarHBondContact N-O 3.29Å; N145-T150 PolarHBondContact O-N 2.96Å
146	A	88.1	Confident	89.3	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-21.2	-175.3	0	0	0	0	0	113.2	V97 C107 W121 D130 L132	V97-A146 HydrophobicContact CG1-CB 4.41Å; V97-A146 HydrophobicContact CG2-CB 3.97Å; C107-A146 PolarHBondContact SG-O 2.91Å; W121-A146 HydrophobicContact CH2-CB 3.52Å; W121-A146 HydrophobicContact CZ3-CB 3.4Å; W121-A146 VanDerWaalsContact CZ3-CB 3.4Å; D130-A146 HydrophobicContact CB-CB 4.07Å; D130-A146 WeakPolarHBondContact O-CA 3.45Å; D130-A146 WeakPolarHBondContact O-CB 3.49Å; D130-A146 PolarHBondContact O-N 3.02Å; L132-A146 HydrophobicContact CB-CB 4.34Å
147	D	85.3	Confident	89.2	Confident	63 Å²	63	40 Å²	40	34%	0.337	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-45.5	174.4	-70.2	-46.2	0	0	0	111.1	R85 N145	R85-D147 IonicContact CZ-OD1 3.99Å; R85-D147 IonicContact NH1-OD1 2.99Å; R85-D147 PolarHBondContact NH1-OD1 2.98Å; R85-D147 IonicContact NH2-OD1 2.79Å; N145-D147 WeakPolarHBondContact OD1-CB 3.34Å; N145-D147 PolarHBondContact OD1-N 3.27Å; N145-D147 VanDerWaalsContact OD1-N 3.09Å
148	T	87.4	Confident	89.4	Confident	85 Å²	85	43.7 Å²	43.7	52%	0.521	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.3	-15.3	-173.6	59.4	0	0	0	0	113.5	N145 T150	N145-T148 PolarHBondContact ND2-OG1 3.3Å; T148-T150 PolarHBondContact O-N 3.48Å; T148-T150 WeakPolarHBondContact OG1-CG2 3.42Å; T148-T150 PolarHBondContact OG1-N 3.21Å; T148-T150 PolarHBondContact OG1-OG1 3.04Å
149	G	88.4	Confident	89.7	Confident	20 Å²	20	43.2 Å²	43.2	21%	0.206	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.9	13.2	-169.8	0	0	0	0	0	114.2	N145	N145-G149 CarbonylContact O-C 3.11Å; N145-G149 WeakPolarHBondContact O-CA 3.48Å; N145-G149 PolarHBondContact O-N 3.48Å
150	T	90.9	Very high	89.7	Confident	73 Å²	73	46.1 Å²	46.1	45%	0.448	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	136.3	-176.5	59.5	0	0	0	0	112.2	N145 T148 L152	N145-T150 PolarHBondContact N-O 3.29Å; N145-T150 PolarHBondContact O-N 2.96Å; T148-T150 PolarHBondContact O-N 3.48Å; T148-T150 WeakPolarHBondContact OG1-CG2 3.42Å; T148-T150 PolarHBondContact OG1-N 3.21Å; T148-T150 PolarHBondContact OG1-OG1 3.04Å; T150-L152 PolarHBondContact O-N 3.31Å
151	K	92.3	Very high	89.7	Confident	94 Å²	94	43.2 Å²	43.2	41%	0.409	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	122.1	173	-176.7	162.5	62.1	-163.4	0	110.8	E111 V142 W144 K154	E111-K151 VanDerWaalsContact CD-NZ 3.25Å; E111-K151 IonicContact OE1-NZ 2.6Å; E111-K151 PolarHBondContact OE1-NZ 3.33Å; E111-K151 IonicContact OE2-NZ 2.76Å; E111-K151 PolarHBondContact OE2-NZ 2.85Å; V142-K151 HydrophobicContact CG1-CD 3.62Å; V142-K151 HydrophobicContact CG1-CG 3.69Å; W144-K151 HydrophobicContact CE3-CB 3.86Å; W144-K151 HydrophobicContact CH2-CB 4.06Å; W144-K151 HydrophobicContact CH2-CD 4.2Å; W144-K151 HydrophobicContact CH2-CG 4.47Å; W144-K151 HydrophobicContact CZ2-CD 4.48Å; W144-K151 HydrophobicContact CZ3-CB 3.57Å; W144-K151 HydrophobicContact CZ3-CG 4.39Å; K151-K154 HydrophobicContact CD-CB 4.43Å
152	L	90.3	Very high	89.5	Confident	79 Å²	79	46.6 Å²	46.6	41%	0.414	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	-52.4	175.6	-66	-179.3	0	0	0	111.3	L131 L143 T150	L131-L152 HydrophobicContact CD1-CD1 4.02Å; L131-L152 HydrophobicContact CD2-CD1 3.61Å; L131-L152 HydrophobicContact CG-CD1 4.45Å; L143-L152 HydrophobicContact CB-CB 4.5Å; L143-L152 HydrophobicContact CD2-CB 4.39Å; L143-L152 HydrophobicContact CD2-CD1 3.85Å; L143-L152 HydrophobicContact CG-CB 4.47Å; L143-L152 HydrophobicContact CG-CD1 4.1Å; L143-L152 PolarHBondContact O-N 2.95Å; T150-L152 PolarHBondContact O-N 3.31Å
153	W	92.7	Very high	89.2	Confident	23 Å²	23	47.7 Å²	47.7	9%	0.087	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	165.1	174.6	54.1	-103.9	0	0	0	111.6	L133 I141 L143 K155 F188 P190 P193	L133-W153 HydrophobicContact CD1-CH2 4.03Å; I141-W153 HydrophobicContact CG2-CH2 4.42Å; I141-W153 HydrophobicContact CG2-CZ3 4.31Å; L143-W153 HydrophobicContact CB-CD2 3.98Å; L143-W153 HydrophobicContact CB-CE3 4.43Å; L143-W153 HydrophobicContact CB-CG 4.48Å; L143-W153 HydrophobicContact CB-CH2 4.22Å; L143-W153 HydrophobicContact CB-CZ2 3.76Å; L143-W153 HydrophobicContact CD2-CZ2 3.91Å; L143-W153 VanDerWaalsContact CD2-NE1 3.32Å; L143-W153 HydrophobicContact CG-CZ2 4.38Å; L143-W153 PolarHBondContact N-O 2.99Å; L143-W153 VanDerWaalsContact N-O 3.1Å; W153-K155 HydrophobicContact CE3-CB 4.5Å; W153-K155 HydrophobicContact CZ3-CB 4.21Å; W153-F188 HydrophobicContact CH2-CD2 4.39Å; W153-F188 AromaticContact CH2-CE2 3.8Å; W153-F188 HydrophobicContact CH2-CE2 3.8Å; W153-F188 HydrophobicContact CZ2-CD2 4.4Å; W153-F188 AromaticContact CZ2-CE2 3.72Å; W153-F188 HydrophobicContact CZ2-CE2 3.72Å; W153-F188 HydrophobicContact CZ2-CZ 4.27Å; W153-P190 PolarHBondContact NE1-O 3.36Å; W153-P190 VanDerWaalsContact NE1-O 3.13Å; W153-P193 HydrophobicContact CB-CB 4.33Å; W153-P193 HydrophobicContact CD2-CB 3.95Å; W153-P193 HydrophobicContact CE3-CB 3.87Å; W153-P193 HydrophobicContact CG-CB 4.17Å
154	K	92.1	Very high	89.2	Confident	70 Å²	70	48.1 Å²	48.1	30%	0.304	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	136.9	178	174.1	173.6	-172	172.6	0	109.9	E111 H112 Y140 I141 V142 K151	E111-K154 IonicContact OE1-NZ 2.94Å; E111-K154 PolarHBondContact OE1-NZ 2.7Å; H112-K154 PolarHBondContact NE2-NZ 3.4Å; Y140-K154 HydrophobicContact CD1-CD 4.4Å; Y140-K154 HydrophobicContact CD1-CG 4.38Å; I141-K154 WeakPolarHBondContact O-CA 3.19Å; V142-K154 HydrophobicContact CG2-CB 4.22Å; V142-K154 HydrophobicContact CG2-CD 4.26Å; V142-K154 HydrophobicContact CG2-CG 3.96Å; K151-K154 HydrophobicContact CD-CB 4.43Å
155	K	91.3	Very high	89.1	Confident	47 Å²	47	48.5 Å²	48.5	20%	0.204	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	137.7	173.7	-173.8	71.9	176.6	-160.9	0	110	Y140 I141 W153 Y157 P194 S195	Y140-K155 WeakPolarHBondContact CA-O 3.36Å; I141-K155 PolarHBondContact N-O 3.13Å; I141-K155 PolarHBondContact O-N 2.92Å; W153-K155 HydrophobicContact CE3-CB 4.5Å; W153-K155 HydrophobicContact CZ3-CB 4.21Å; K155-Y157 HydrophobicContact CB-CE2 4.15Å; K155-Y157 HydrophobicContact CG-CD2 4.39Å; K155-Y157 HydrophobicContact CG-CE2 3.65Å; K155-P194 WeakPolarHBondContact CE-O 3.42Å; K155-P194 PolarHBondContact NZ-O 2.98Å; K155-S195 PolarHBondContact NZ-O 3.31Å
156	S	90.7	Very high	89.1	Confident	63 Å²	63	47.3 Å²	47.3	44%	0.441	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	139	174.9	-167.6	0	0	0	0	110	Y140	Y140-S156 WeakPolarHBondContact CE1-OG 3.43Å
157	Y	88.7	Confident	89.2	Confident	18 Å²	18	47.7 Å²	47.7	7%	0.071	27%	0.272	C	S	.	.			trans	-111.4	165.8	172.7	-68.2	-91.5	0	0	0	110.5	N139 I141 K155 I161 L176 I185	N139-Y157 WeakPolarHBondContact CB-O 3.37Å; N139-Y157 PolarHBondContact ND2-O 2.94Å; N139-Y157 PolarHBondContact O-N 3.21Å; I141-Y157 HydrophobicContact CB-CE2 4.43Å; I141-Y157 HydrophobicContact CD1-CD2 4.29Å; I141-Y157 HydrophobicContact CD1-CE2 3.68Å; I141-Y157 HydrophobicContact CG1-CD2 4.31Å; I141-Y157 HydrophobicContact CG1-CE2 3.97Å; K155-Y157 HydrophobicContact CB-CE2 4.15Å; K155-Y157 HydrophobicContact CG-CD2 4.39Å; K155-Y157 HydrophobicContact CG-CE2 3.65Å; Y157-I161 HydrophobicContact CD2-CD1 3.72Å; Y157-I161 HydrophobicContact CE2-CD1 4.49Å; Y157-I161 HydrophobicContact CG-CD1 4.14Å; Y157-L176 HydrophobicContact CD1-CD1 4.18Å; Y157-L176 HydrophobicContact CD2-CD1 4.31Å; Y157-L176 HydrophobicContact CE1-CD1 3.93Å; Y157-L176 HydrophobicContact CE2-CD1 4.07Å; Y157-L176 HydrophobicContact CG-CD1 4.37Å; Y157-I185 HydrophobicContact CE1-CD1 4.01Å; Y157-I185 WeakPolarHBondContact OH-CD1 3.35Å
158	A	84.3	Confident	89.2	Confident	94 Å²	94	46.8 Å²	46.8	78%	0.777	27%	0.27	S	S	*	.	S	Bend	trans	-77.3	-40.4	-179.2	0	0	0	0	0	112.4
159	D	84.6	Confident	89.1	Confident	41 Å²	41	44 Å²	44	22%	0.219	25%	0.25	C	S	.	.	S	Bend	trans	-97.3	158.9	-175.7	-55.5	-42.1	0	0	0	112	N139 I161 T178 K200	N139-D159 WeakPolarHBondContact CB-O 3.41Å; D159-I161 PolarHBondContact O-N 3.01Å; D159-T178 HydrophobicContact CB-CG2 4.15Å; D159-K200 IonicContact OD1-NZ 2.82Å; D159-K200 WeakPolarHBondContact OD2-CE 3.42Å; D159-K200 IonicContact OD2-NZ 2.65Å; D159-K200 PolarHBondContact OD2-NZ 3.43Å
160	N	87	Confident	88.8	Confident	84 Å²	84	43.9 Å²	43.9	45%	0.449	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-69	131	174.1	-68.9	-16.2	0	0	0	110.6	P138 T178 S179	P138-N160 VanDerWaalsContact CB-OD1 3.32Å; P138-N160 WeakPolarHBondContact CB-OD1 3.33Å; P138-N160 VanDerWaalsContact O-CA 3.3Å; P138-N160 WeakPolarHBondContact O-CA 3.44Å; P138-N160 PolarHBondContact O-OD1 3.18Å; N160-T178 WeakPolarHBondContact O-CA 3.37Å; N160-T178 WeakPolarHBondContact O-CB 3.36Å; N160-S179 PolarHBondContact O-N 3.23Å; N160-S179 VanDerWaalsContact O-N 3.16Å
161	I	88.8	Confident	88.3	Confident	3 Å²	3	40.9 Å²	40.9	2%	0.015	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	126.9	-178.4	-47.9	165	0	0	0	108.9	I135 P138 I141 Y157 D159 L176	I135-I161 HydrophobicContact CD1-CB 4.36Å; I135-I161 HydrophobicContact CD1-CG2 3.59Å; I135-I161 HydrophobicContact CG2-CB 4.1Å; I135-I161 HydrophobicContact CG2-CG2 4.4Å; P138-I161 PolarHBondContact O-N 3.01Å; I141-I161 HydrophobicContact CD1-CD1 4.02Å; I141-I161 HydrophobicContact CG1-CD1 3.77Å; Y157-I161 HydrophobicContact CD2-CD1 3.72Å; Y157-I161 HydrophobicContact CE2-CD1 4.49Å; Y157-I161 HydrophobicContact CG-CD1 4.14Å; D159-I161 PolarHBondContact O-N 3.01Å; I161-L176 HydrophobicContact CD1-CD1 4.16Å; I161-L176 HydrophobicContact CG2-CB 4.14Å; I161-L176 HydrophobicContact CG2-CD2 4.39Å
162	L	87.4	Confident	87.9	Confident	74 Å²	74	38 Å²	38	39%	0.387	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	-44.1	-177.5	-60.7	176.8	0	0	0	111.9	L177	L162-L177 HydrophobicContact CB-CD2 4.37Å; L162-L177 HydrophobicContact CB-CG 4.4Å; L162-L177 HydrophobicContact CD1-CG 4.49Å; L162-L177 PolarHBondContact N-O 3.44Å
163	S	87.6	Confident	87.8	Confident	23 Å²	23	37.4 Å²	37.4	16%	0.161	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	168.9	179.4	64.2	0	0	0	0	110.9	L177	S163-L177 PolarHBondContact O-N 3.38Å; S163-L177 WeakPolarHBondContact OG-CB 3.27Å; S163-L177 WeakPolarHBondContact OG-CD2 3.45Å
164	F	92.3	Very high	87.7	Confident	9 Å²	9	36.4 Å²	36.4	4%	0.039	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	158.9	174.9	71.3	-79.4	0	0	0	112.2	D118 Q120 L133 I135 F166 L174 T175 L176	D118-F164 HydrophobicContact CB-CD1 3.85Å; D118-F164 HydrophobicContact CB-CE1 3.75Å; Q120-F164 HydrophobicContact CB-CE1 4.48Å; Q120-F164 HydrophobicContact CB-CE2 3.67Å; Q120-F164 HydrophobicContact CB-CZ 3.43Å; Q120-F164 VanDerWaalsContact CB-CZ 3.43Å; L133-F164 HydrophobicContact CB-CZ 4.33Å; L133-F164 HydrophobicContact CD2-CD2 4.26Å; L133-F164 HydrophobicContact CD2-CE2 3.74Å; L133-F164 HydrophobicContact CD2-CZ 4.07Å; L133-F164 HydrophobicContact CG-CZ 4.37Å; I135-F164 HydrophobicContact CD1-CB 4Å; I135-F164 HydrophobicContact CD1-CD1 3.21Å; I135-F164 HydrophobicContact CD1-CE1 3.92Å; I135-F164 HydrophobicContact CD1-CG 3.95Å; I135-F164 HydrophobicContact CG1-CD1 3.62Å; I135-F164 HydrophobicContact CG1-CE1 3.79Å; F164-F166 HydrophobicContact CD2-CD2 4.38Å; F164-F166 HydrophobicContact CD2-CE2 4.21Å; F164-F166 HydrophobicContact CE2-CD2 4.12Å; F164-F166 AromaticContact CE2-CE2 3.71Å; F164-F166 HydrophobicContact CE2-CE2 3.71Å; F164-L174 HydrophobicContact CB-CD1 4.19Å; F164-L174 HydrophobicContact CD2-CD1 3.64Å; F164-L174 HydrophobicContact CG-CD1 4.36Å; F164-T175 CarbonylContact C-O 3.47Å; F164-T175 WeakPolarHBondContact CA-O 3.31Å; F164-T175 WeakPolarHBondContact CB-O 3.13Å; F164-L176 HydrophobicContact CB-CD2 3.6Å
165	S	90.9	Very high	87.6	Confident	20 Å²	20	33.1 Å²	33.1	14%	0.14	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	137.2	175.7	-161.2	0	0	0	0	110.4	L174 T175 Y252	S165-L174 WeakPolarHBondContact O-CD1 3.47Å; S165-T175 PolarHBondContact N-O 3.3Å; S165-T175 PolarHBondContact O-N 3.31Å; S165-T175 PolarHBondContact O-OG1 2.84Å; S165-T175 VanDerWaalsContact O-OG1 3.13Å; S165-Y252 WeakPolarHBondContact O-CE2 3.16Å
166	F	90.8	Very high	87.6	Confident	11 Å²	11	30.9 Å²	30.9	5%	0.048	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	144.7	172	-79.3	-75.8	0	0	0	110.7	L122 L133 F164 P168 L174 F188 Y252	L122-F166 HydrophobicContact CD2-CE1 4.31Å; L122-F166 HydrophobicContact CD2-CE2 3.76Å; L122-F166 HydrophobicContact CD2-CZ 3.49Å; L122-F166 VanDerWaalsContact CD2-CZ 3.49Å; L133-F166 HydrophobicContact CD2-CE2 4.02Å; L133-F166 HydrophobicContact CD2-CZ 3.75Å; F164-F166 HydrophobicContact CD2-CD2 4.38Å; F164-F166 HydrophobicContact CD2-CE2 4.21Å; F164-F166 HydrophobicContact CE2-CD2 4.12Å; F164-F166 AromaticContact CE2-CE2 3.71Å; F164-F166 HydrophobicContact CE2-CE2 3.71Å; F166-P168 WeakPolarHBondContact O-CD 3.46Å; F166-L174 HydrophobicContact CD1-CB 4.3Å; F166-L174 HydrophobicContact CD1-CD1 3.84Å; F166-L174 HydrophobicContact CD2-CD1 4.23Å; F166-L174 HydrophobicContact CE1-CB 4.23Å; F166-L174 HydrophobicContact CE1-CD1 3.79Å; F166-L174 HydrophobicContact CE1-CG 4.43Å; F166-L174 HydrophobicContact CE2-CD1 4.2Å; F166-L174 HydrophobicContact CG-CD1 4.07Å; F166-L174 HydrophobicContact CZ-CD1 3.98Å; F166-F188 AromaticContact CE1-CD1 3.76Å; F166-F188 HydrophobicContact CE1-CD1 3.76Å; F166-F188 HydrophobicContact CE1-CD2 4.36Å; F166-F188 AromaticContact CE1-CE1 3.77Å; F166-F188 HydrophobicContact CE1-CE1 3.77Å; F166-F188 HydrophobicContact CE1-CE2 4.35Å; F166-F188 HydrophobicContact CE1-CG 4.07Å; F166-F188 HydrophobicContact CE1-CZ 4.08Å; F166-F188 HydrophobicContact CZ-CD1 4.34Å; F166-F188 AromaticContact CZ-CE1 3.91Å; F166-F188 HydrophobicContact CZ-CE1 3.91Å; F166-F188 HydrophobicContact CZ-CE2 4.19Å; F166-F188 AromaticContact CZ-CZ 3.82Å; F166-F188 HydrophobicContact CZ-CZ 3.82Å; F166-Y252 VanDerWaalsContact C-CD2 3.47Å; F166-Y252 WeakPolarHBondContact O-CD2 3.46Å
167	D	88.9	Confident	87.5	Confident	7 Å²	7	28 Å²	28	4%	0.037	17%	0.166	C	C	.	.			trans	-68.8	121.8	168.2	-176	-17.6	0	0	0	109.4	F169 D170 H173 Y252	D167-F169 PolarHBondContact O-N 2.89Å; D167-F169 PolarHBondContact OD1-N 3.46Å; D167-D170 WeakPolarHBondContact CB-O 3.23Å; D167-D170 CarbonylContact O-C 3.56Å; D167-D170 PolarHBondContact O-N 3.33Å; D167-H173 HydrophobicContact CB-CB 3.85Å; D167-H173 PolarHBondContact N-O 3.47Å; D167-H173 VanDerWaalsContact N-O 3.12Å; D167-Y252 HydrophobicContact CB-CD1 4.37Å; D167-Y252 HydrophobicContact CB-CE1 4.02Å; D167-Y252 HydrophobicContact CB-CE2 4.25Å
168	P	86.1	Confident	87.4	Confident	44 Å²	44	27.3 Å²	27.3	29%	0.286	16%	0.164	S	C	.	.	S	Bend	trans	-62.9	-23.7	179.7	-23.9	35.4	0	0	0	114.3	W123 F166 Y252 P254	W123-P168 WeakPolarHBondContact CH2-O 3.48Å; F166-P168 WeakPolarHBondContact O-CD 3.46Å; P168-Y252 VanDerWaalsContact CD-CB 3.44Å; P168-P254 HydrophobicContact CB-CB 4.34Å; P168-P254 HydrophobicContact CG-CB 4.1Å
169	F	84.9	Confident	87.2	Confident	26 Å²	26	24.4 Å²	24.4	11%	0.114	14%	0.138	C	C	.	.	S	Bend	trans	-97.2	-27.9	-176.8	-60.9	-87.1	0	0	0	112.4	D167 P254 R257 C966 D968	D167-F169 PolarHBondContact O-N 2.89Å; D167-F169 PolarHBondContact OD1-N 3.46Å; F169-P254 VanDerWaalsContact CZ-O 3.3Å; F169-P254 WeakPolarHBondContact CZ-O 3.46Å; F169-R257 HydrophobicContact CB-CG 4.27Å; F169-R257 HydrophobicContact CD1-CB 4.41Å; F169-R257 HydrophobicContact CD2-CB 3.96Å; F169-R257 HydrophobicContact CD2-CG 4.19Å; F169-R257 HydrophobicContact CE2-CB 4.13Å; F169-R257 VanDerWaalsContact CE2-N 3.35Å; F169-R257 HydrophobicContact CG-CB 4.11Å; F169-R257 HydrophobicContact CG-CG 4.15Å; F169-R257 HydrophobicContact CZ-CB 4.41Å; F169-C966 WeakPolarHBondContact CE1-O 3.44Å; F169-D968 HydrophobicContact CD1-CB 3.81Å; F169-D968 HydrophobicContact CE1-CB 3.81Å
170	D	83.1	Confident	86.8	Confident	18 Å²	18	25.2 Å²	25.2	10%	0.096	14%	0.14	C	C	.	.			trans	-135.5	99	178	-160	-21.5	0	0	0	113.1	D167 S172 H173 N1090	D167-D170 WeakPolarHBondContact CB-O 3.23Å; D167-D170 CarbonylContact O-C 3.56Å; D167-D170 PolarHBondContact O-N 3.33Å; D170-S172 VanDerWaalsContact CG-OG 3.29Å; D170-S172 PolarHBondContact O-N 3.11Å; D170-S172 PolarHBondContact OD1-N 2.87Å; D170-S172 PolarHBondContact OD1-OG 3.03Å; D170-H173 VanDerWaalsContact CG-CD2 3.47Å; D170-H173 PolarHBondContact O-N 3.49Å; D170-H173 IonicContact OD2-CD2 3.27Å; D170-H173 PolarHBondContact OD2-CD2 3.33Å; D170-H173 IonicContact OD2-NE2 2.88Å; D170-N1090 PolarHBondContact OD2-ND2 3.15Å
171	P	79.9	Confident	86.5	Confident	10 Å²	10	21.2 Å²	21.2	7%	0.065	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-8.7	-176	25.5	-33.1	0	0	0	114.4	W123 N124 H173	W123-P171 HydrophobicContact CH2-CB 4.13Å; W123-P171 HydrophobicContact CH2-CG 4.26Å; W123-P171 HydrophobicContact CZ2-CB 3.97Å; N124-P171 HydrophobicContact CB-CB 3.63Å; N124-P171 HydrophobicContact CB-CG 3.78Å; N124-P171 WeakPolarHBondContact ND2-CG 3.27Å; P171-H173 VanDerWaalsContact C-N 3.27Å
172	S	84.1	Confident	86.4	Confident	34 Å²	34	21.3 Å²	21.3	24%	0.238	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-17.9	171.2	67.2	0	0	0	0	112.9	D170 S186 F188	D170-S172 VanDerWaalsContact CG-OG 3.29Å; D170-S172 PolarHBondContact O-N 3.11Å; D170-S172 PolarHBondContact OD1-N 2.87Å; D170-S172 PolarHBondContact OD1-OG 3.03Å; S172-S186 CarbonylContact O-C 3.58Å; S172-S186 VanDerWaalsContact O-C 3.29Å; S172-F188 VanDerWaalsContact O-CB 3.28Å; S172-F188 WeakPolarHBondContact O-CB 3.32Å; S172-F188 PolarHBondContact O-N 2.97Å
173	H	88.2	Confident	86.5	Confident	67 Å²	67	18.1 Å²	18.1	31%	0.31	10%	0.103	S	C	.	.			trans	-95.7	126.2	179.3	-70.4	-94.6	0	0	0	111.4	D167 D170 P171 I185 S186	D167-H173 HydrophobicContact CB-CB 3.85Å; D167-H173 PolarHBondContact N-O 3.47Å; D167-H173 VanDerWaalsContact N-O 3.12Å; D170-H173 VanDerWaalsContact CG-CD2 3.47Å; D170-H173 PolarHBondContact O-N 3.49Å; D170-H173 IonicContact OD2-CD2 3.27Å; D170-H173 PolarHBondContact OD2-CD2 3.33Å; D170-H173 IonicContact OD2-NE2 2.88Å; P171-H173 VanDerWaalsContact C-N 3.27Å; H173-I185 CarbonylContact C-O 3.52Å; H173-I185 VanDerWaalsContact CA-O 3.31Å; H173-I185 WeakPolarHBondContact CA-O 3.08Å; H173-S186 VanDerWaalsContact CE1-CB 3.49Å; H173-S186 WeakPolarHBondContact CE1-CB 3.03Å
174	L	90.3	Very high	86.5	Confident	2 Å²	2	19 Å²	19	1%	0.01	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	132.7	-179.2	175	70.5	0	0	0	109.5	F164 S165 F166 L176 I185 F188	F164-L174 HydrophobicContact CB-CD1 4.19Å; F164-L174 HydrophobicContact CD2-CD1 3.64Å; F164-L174 HydrophobicContact CG-CD1 4.36Å; S165-L174 WeakPolarHBondContact O-CD1 3.47Å; F166-L174 HydrophobicContact CD1-CB 4.3Å; F166-L174 HydrophobicContact CD1-CD1 3.84Å; F166-L174 HydrophobicContact CD2-CD1 4.23Å; F166-L174 HydrophobicContact CE1-CB 4.23Å; F166-L174 HydrophobicContact CE1-CD1 3.79Å; F166-L174 HydrophobicContact CE1-CG 4.43Å; F166-L174 HydrophobicContact CE2-CD1 4.2Å; F166-L174 HydrophobicContact CG-CD1 4.07Å; F166-L174 HydrophobicContact CZ-CD1 3.98Å; L174-L176 HydrophobicContact CD2-CD2 3.96Å; L174-L176 HydrophobicContact CG-CD2 4.11Å; L174-I185 HydrophobicContact CB-CB 4.23Å; L174-I185 HydrophobicContact CD2-CD1 4.02Å; L174-I185 HydrophobicContact CG-CD1 4.47Å; L174-I185 PolarHBondContact N-O 3.4Å; L174-I185 WeakPolarHBondContact O-CB 3.37Å; L174-I185 PolarHBondContact O-N 3.16Å; L174-F188 HydrophobicContact CD2-CD2 4.21Å
175	T	90.6	Very high	86.4	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	136.4	171.3	44.3	0	0	0	0	111.5	F164 S165 I182 V183 F184 L250 Y252 M260	F164-T175 CarbonylContact C-O 3.47Å; F164-T175 WeakPolarHBondContact CA-O 3.31Å; F164-T175 WeakPolarHBondContact CB-O 3.13Å; S165-T175 PolarHBondContact N-O 3.3Å; S165-T175 PolarHBondContact O-N 3.31Å; S165-T175 PolarHBondContact O-OG1 2.84Å; S165-T175 VanDerWaalsContact O-OG1 3.13Å; T175-I182 HydrophobicContact CG2-CG2 4.45Å; T175-V183 WeakPolarHBondContact CA-O 3.45Å; T175-F184 HydrophobicContact CG2-CD1 3.2Å; T175-F184 HydrophobicContact CG2-CE1 3.26Å; T175-F184 HydrophobicContact CG2-CG 4.06Å; T175-F184 HydrophobicContact CG2-CZ 4.17Å; T175-L250 WeakPolarHBondContact OG1-CD2 3.26Å; T175-Y252 HydrophobicContact CG2-CE2 4.02Å; T175-Y252 WeakPolarHBondContact CG2-OH 3.2Å; T175-Y252 WeakPolarHBondContact OG1-CE2 3.43Å; T175-M260 HydrophobicContact CG2-SD 4.33Å
176	L	90.1	Very high	86.1	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	131.1	174.1	-51.4	179.2	0	0	0	109.4	I141 Y157 I161 F164 L174 I182 V183 I185	I141-L176 HydrophobicContact CD1-CD1 3.7Å; I141-L176 HydrophobicContact CD1-CD2 3.53Å; I141-L176 HydrophobicContact CD1-CG 4.27Å; Y157-L176 HydrophobicContact CD1-CD1 4.18Å; Y157-L176 HydrophobicContact CD2-CD1 4.31Å; Y157-L176 HydrophobicContact CE1-CD1 3.93Å; Y157-L176 HydrophobicContact CE2-CD1 4.07Å; Y157-L176 HydrophobicContact CG-CD1 4.37Å; I161-L176 HydrophobicContact CD1-CD1 4.16Å; I161-L176 HydrophobicContact CG2-CB 4.14Å; I161-L176 HydrophobicContact CG2-CD2 4.39Å; F164-L176 HydrophobicContact CB-CD2 3.6Å; L174-L176 HydrophobicContact CD2-CD2 3.96Å; L174-L176 HydrophobicContact CG-CD2 4.11Å; L176-I182 CarbonylContact O-C 3.54Å; L176-I182 WeakPolarHBondContact O-CA 3.28Å; L176-V183 HydrophobicContact CB-CB 4.24Å; L176-V183 PolarHBondContact N-O 3.16Å; L176-V183 PolarHBondContact O-N 3.12Å; L176-I185 HydrophobicContact CD1-CD1 3.56Å; L176-I185 HydrophobicContact CD2-CD1 4.46Å; L176-I185 HydrophobicContact CG-CD1 3.84Å
177	L	88.3	Confident	85.9	Confident	3 Å²	3	23.7 Å²	23.7	2%	0.016	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	116.7	167.2	-178.2	64.9	0	0	0	108.4	L162 S163 I182 L244 L250	L162-L177 HydrophobicContact CB-CD2 4.37Å; L162-L177 HydrophobicContact CB-CG 4.4Å; L162-L177 HydrophobicContact CD1-CG 4.49Å; L162-L177 PolarHBondContact N-O 3.44Å; S163-L177 PolarHBondContact O-N 3.38Å; S163-L177 WeakPolarHBondContact OG-CB 3.27Å; S163-L177 WeakPolarHBondContact OG-CD2 3.45Å; L177-I182 HydrophobicContact CD1-CG1 4.23Å; L177-L244 HydrophobicContact CD1-CD2 4.11Å; L177-L250 HydrophobicContact CB-CD1 4.35Å; L177-L250 HydrophobicContact CD1-CD1 4.41Å
178	T	86.4	Confident	85.8	Confident	4 Å²	4	24.1 Å²	24.1	3%	0.025	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	165.5	174.3	78.7	0	0	0	0	110.9	D159 N160 E180 G181 V183	D159-T178 HydrophobicContact CB-CG2 4.15Å; N160-T178 WeakPolarHBondContact O-CA 3.37Å; N160-T178 WeakPolarHBondContact O-CB 3.36Å; T178-E180 PolarHBondContact O-N 3.36Å; T178-E180 VanDerWaalsContact O-N 3.14Å; T178-E180 PolarHBondContact OG1-N 3.16Å; T178-G181 WeakPolarHBondContact CA-O 3.36Å; T178-G181 PolarHBondContact N-O 3.2Å; T178-G181 PolarHBondContact O-N 3.34Å; T178-G181 PolarHBondContact OG1-N 3.5Å; T178-G181 PolarHBondContact OG1-O 3.4Å; T178-V183 HydrophobicContact CG2-CG2 3.88Å
179	S	79.8	Confident	85.7	Confident	33 Å²	33	23.6 Å²	23.6	23%	0.231	13%	0.133	C	C	.	.	S	Bend	trans	-60.1	-21.9	177.3	56.8	0	0	0	0	114	N160	N160-S179 PolarHBondContact O-N 3.23Å; N160-S179 VanDerWaalsContact O-N 3.16Å
180	E	76.6	Confident	85.7	Confident	57 Å²	57	24.9 Å²	24.9	27%	0.266	14%	0.144	S	C	.	.	S	Bend	trans	-108.9	-21.5	-175.8	-66.6	-81	136.8	0	0	113.1	T178 Y202 K236	T178-E180 PolarHBondContact O-N 3.36Å; T178-E180 VanDerWaalsContact O-N 3.14Å; T178-E180 PolarHBondContact OG1-N 3.16Å; E180-Y202 WeakPolarHBondContact O-CD1 3.29Å; E180-Y202 VanDerWaalsContact O-CE1 3.31Å; E180-Y202 WeakPolarHBondContact O-CE1 3.42Å; E180-K236 WeakPolarHBondContact OE2-CE 3.44Å; E180-K236 IonicContact OE2-NZ 3.67Å; E180-K236 PolarHBondContact OE2-NZ 2.82Å
181	G	81.6	Confident	85.7	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	17%	0.172	C	C	.	.			trans	-173.5	179.1	-166.7	0	0	0	0	0	113.9	T178 V201 L244	T178-G181 WeakPolarHBondContact CA-O 3.36Å; T178-G181 PolarHBondContact N-O 3.2Å; T178-G181 PolarHBondContact O-N 3.34Å; T178-G181 PolarHBondContact OG1-N 3.5Å; T178-G181 PolarHBondContact OG1-O 3.4Å; G181-V201 WeakPolarHBondContact CA-O 3.09Å; G181-L244 VanDerWaalsContact CA-CD1 3.42Å
182	I	86.9	Confident	86	Confident	5 Å²	5	35.2 Å²	35.2	3%	0.026	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	133.6	167.9	-59	175.6	0	0	0	108	T175 L176 L177 F184 K200 V201 I203 L244 L250 M260 L262	T175-I182 HydrophobicContact CG2-CG2 4.45Å; L176-I182 CarbonylContact O-C 3.54Å; L176-I182 WeakPolarHBondContact O-CA 3.28Å; L177-I182 HydrophobicContact CD1-CG1 4.23Å; I182-F184 HydrophobicContact CB-CE2 4.41Å; I182-F184 HydrophobicContact CG2-CD2 4.31Å; I182-F184 HydrophobicContact CG2-CE2 3.81Å; I182-F184 HydrophobicContact CG2-CZ 3.96Å; I182-K200 CarbonylContact O-C 3.49Å; I182-K200 WeakPolarHBondContact O-CA 3.23Å; I182-V201 PolarHBondContact N-O 3.2Å; I182-V201 PolarHBondContact O-N 2.94Å; I182-I203 HydrophobicContact CD1-CD1 3.62Å; I182-I203 HydrophobicContact CD1-CG1 4.36Å; I182-I203 HydrophobicContact CG1-CD1 4.48Å; I182-L244 HydrophobicContact CG1-CD2 4.49Å; I182-L250 HydrophobicContact CD1-CD1 3.7Å; I182-L250 HydrophobicContact CG1-CD1 3.97Å; I182-L250 HydrophobicContact CG2-CD1 3.97Å; I182-M260 HydrophobicContact CD1-CE 3.86Å; I182-L262 HydrophobicContact CD1-CD1 4.25Å; I182-L262 HydrophobicContact CD1-CD2 3.89Å
183	V	88.1	Confident	86.2	Confident	8 Å²	8	36.5 Å²	36.5	5%	0.048	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	121.1	177.5	179.5	0	0	0	0	109.1	T175 L176 T178 I185 P197 K200	T175-V183 WeakPolarHBondContact CA-O 3.45Å; L176-V183 HydrophobicContact CB-CB 4.24Å; L176-V183 PolarHBondContact N-O 3.16Å; L176-V183 PolarHBondContact O-N 3.12Å; T178-V183 HydrophobicContact CG2-CG2 3.88Å; V183-I185 HydrophobicContact CG1-CG1 4.45Å; V183-P197 WeakPolarHBondContact CG1-O 3.38Å; V183-K200 HydrophobicContact CG2-CB 4.23Å; V183-K200 HydrophobicContact CG2-CG 4.09Å
184	F	88.7	Confident	86.3	Confident	41 Å²	41	33.4 Å²	33.4	18%	0.18	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	127	174.6	-65.1	-91.4	0	0	0	110.5	T175 I182 G198 K199 V201 M260 L273	T175-F184 HydrophobicContact CG2-CD1 3.2Å; T175-F184 HydrophobicContact CG2-CE1 3.26Å; T175-F184 HydrophobicContact CG2-CG 4.06Å; T175-F184 HydrophobicContact CG2-CZ 4.17Å; I182-F184 HydrophobicContact CB-CE2 4.41Å; I182-F184 HydrophobicContact CG2-CD2 4.31Å; I182-F184 HydrophobicContact CG2-CE2 3.81Å; I182-F184 HydrophobicContact CG2-CZ 3.96Å; F184-G198 CarbonylContact O-C 3.29Å; F184-G198 WeakPolarHBondContact O-CA 3.38Å; F184-K199 HydrophobicContact CB-CB 4.45Å; F184-K199 PolarHBondContact N-O 2.88Å; F184-K199 PolarHBondContact O-N 3.42Å; F184-V201 HydrophobicContact CD2-CG2 3.84Å; F184-V201 HydrophobicContact CE2-CB 4.38Å; F184-V201 HydrophobicContact CE2-CG2 3.87Å; F184-M260 HydrophobicContact CZ-CE 4.29Å; F184-L273 HydrophobicContact CE1-CD1 4.24Å; F184-L273 HydrophobicContact CE1-CD2 3.72Å; F184-L273 HydrophobicContact CZ-CD2 3.75Å
185	I	89.3	Confident	86	Confident	3 Å²	3	38.1 Å²	38.1	2%	0.015	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	131.7	174.5	-62	161.2	0	0	0	106.9	Y157 H173 L174 L176 V183 D187 P194	Y157-I185 HydrophobicContact CE1-CD1 4.01Å; Y157-I185 WeakPolarHBondContact OH-CD1 3.35Å; H173-I185 CarbonylContact C-O 3.52Å; H173-I185 VanDerWaalsContact CA-O 3.31Å; H173-I185 WeakPolarHBondContact CA-O 3.08Å; L174-I185 HydrophobicContact CB-CB 4.23Å; L174-I185 HydrophobicContact CD2-CD1 4.02Å; L174-I185 HydrophobicContact CG-CD1 4.47Å; L174-I185 PolarHBondContact N-O 3.4Å; L174-I185 WeakPolarHBondContact O-CB 3.37Å; L174-I185 PolarHBondContact O-N 3.16Å; L176-I185 HydrophobicContact CD1-CD1 3.56Å; L176-I185 HydrophobicContact CD2-CD1 4.46Å; L176-I185 HydrophobicContact CG-CD1 3.84Å; V183-I185 HydrophobicContact CG1-CG1 4.45Å; I185-D187 WeakPolarHBondContact CG2-OD1 3.47Å; I185-P194 HydrophobicContact CG2-CB 4.03Å; I185-P194 HydrophobicContact CG2-CG 4.15Å
186	S	85.1	Confident	85.6	Confident	77 Å²	77	39.3 Å²	39.3	54%	0.538	24%	0.238	S	C	.	.			trans	-119.5	1	-176.9	58.6	0	0	0	0	113.3	S172 H173	S172-S186 CarbonylContact O-C 3.58Å; S172-S186 VanDerWaalsContact O-C 3.29Å; H173-S186 VanDerWaalsContact CE1-CB 3.49Å; H173-S186 WeakPolarHBondContact CE1-CB 3.03Å
187	D	86.3	Confident	85.1	Confident	58 Å²	58	44.2 Å²	44.2	31%	0.31	27%	0.27	S	S	.	.			trans	-121.9	30.4	-174.7	68.8	-30.4	0	0	0	112.3	I185 S189 S195	I185-D187 WeakPolarHBondContact CG2-OD1 3.47Å; D187-S189 PolarHBondContact O-N 3.21Å; D187-S195 WeakPolarHBondContact OD2-CB 3.37Å; D187-S195 PolarHBondContact OD2-N 3.5Å; D187-S195 PolarHBondContact OD2-OG 3.17Å
188	F	87.4	Confident	84.8	Confident	17 Å²	17	45.5 Å²	45.5	8%	0.075	28%	0.284	C	S	.	.			trans	-66.4	127.5	177.7	-179	-93.3	0	0	0	110.6	L122 L133 W153 F166 S172 L174	L122-F188 HydrophobicContact CD1-CE1 4.13Å; L122-F188 HydrophobicContact CD1-CZ 4.09Å; L122-F188 HydrophobicContact CD2-CE1 3.87Å; L122-F188 HydrophobicContact CD2-CZ 3.88Å; L133-F188 HydrophobicContact CD1-CE2 4.2Å; L133-F188 HydrophobicContact CD1-CZ 4.5Å; L133-F188 HydrophobicContact CD2-CE2 4.12Å; L133-F188 HydrophobicContact CD2-CZ 4.42Å; W153-F188 HydrophobicContact CH2-CD2 4.39Å; W153-F188 AromaticContact CH2-CE2 3.8Å; W153-F188 HydrophobicContact CH2-CE2 3.8Å; W153-F188 HydrophobicContact CZ2-CD2 4.4Å; W153-F188 AromaticContact CZ2-CE2 3.72Å; W153-F188 HydrophobicContact CZ2-CE2 3.72Å; W153-F188 HydrophobicContact CZ2-CZ 4.27Å; F166-F188 AromaticContact CE1-CD1 3.76Å; F166-F188 HydrophobicContact CE1-CD1 3.76Å; F166-F188 HydrophobicContact CE1-CD2 4.36Å; F166-F188 AromaticContact CE1-CE1 3.77Å; F166-F188 HydrophobicContact CE1-CE1 3.77Å; F166-F188 HydrophobicContact CE1-CE2 4.35Å; F166-F188 HydrophobicContact CE1-CG 4.07Å; F166-F188 HydrophobicContact CE1-CZ 4.08Å; F166-F188 HydrophobicContact CZ-CD1 4.34Å; F166-F188 AromaticContact CZ-CE1 3.91Å; F166-F188 HydrophobicContact CZ-CE1 3.91Å; F166-F188 HydrophobicContact CZ-CE2 4.19Å; F166-F188 AromaticContact CZ-CZ 3.82Å; F166-F188 HydrophobicContact CZ-CZ 3.82Å; S172-F188 VanDerWaalsContact O-CB 3.28Å; S172-F188 WeakPolarHBondContact O-CB 3.32Å; S172-F188 PolarHBondContact O-N 2.97Å; L174-F188 HydrophobicContact CD2-CD2 4.21Å
189	S	84.7	Confident	84.8	Confident	32 Å²	32	50 Å²	50	22%	0.224	30%	0.303	C	S	.	.			trans	-141	145.1	173.4	81.4	0	0	0	0	111.1	D187 S191 K192	D187-S189 PolarHBondContact O-N 3.21Å; S189-S191 PolarHBondContact O-N 3.27Å; S189-K192 PolarHBondContact OG-N 3.43Å; S189-K192 PolarHBondContact OG-O 3.29Å
190	P	84	Confident	85	Confident	53 Å²	53	50.9 Å²	50.9	34%	0.344	30%	0.303	S	S	.	.	S	Bend	trans	-64.2	-30.4	174.6	-24.3	34.6	0	0	0	113.2	L122 L131 L143 W153	L122-P190 HydrophobicContact CD1-CG 4.41Å; L131-P190 HydrophobicContact CD1-CB 3.92Å; L143-P190 HydrophobicContact CD2-CB 4.4Å; W153-P190 PolarHBondContact NE1-O 3.36Å; W153-P190 VanDerWaalsContact NE1-O 3.13Å
191	S	83.9	Confident	85.1	Confident	100 Å²	100	48.4 Å²	48.4	70%	0.699	29%	0.292	S	S	*	.	S	Bend	trans	-85	-28.8	-172.4	60.3	0	0	0	0	114	S189	S189-S191 PolarHBondContact O-N 3.27Å
192	K	86.4	Confident	84.9	Confident	146 Å²	146	49.6 Å²	49.6	64%	0.635	30%	0.296	S	S	*	.	S	Bend	trans	-135.1	140.5	-178.6	-66	-178.4	-178.3	176.7	0	111	S189	S189-K192 PolarHBondContact OG-N 3.43Å; S189-K192 PolarHBondContact OG-O 3.29Å
193	P	88.1	Confident	84.1	Confident	60 Å²	60	49.5 Å²	49.5	39%	0.39	30%	0.296	S	S	.	.			trans	-64.5	153.8	173.8	29.4	-35.2	0	0	0	110.9	W153 S195	W153-P193 HydrophobicContact CB-CB 4.33Å; W153-P193 HydrophobicContact CD2-CB 3.95Å; W153-P193 HydrophobicContact CE3-CB 3.87Å; W153-P193 HydrophobicContact CG-CB 4.17Å; P193-S195 PolarHBondContact O-N 3.17Å
194	P	89.4	Confident	82.8	Confident	3 Å²	3	50.4 Å²	50.4	2%	0.019	30%	0.303	C	S	.	.			trans	-52.6	136.1	174.2	-27	34.9	0	0	0	111.7	K155 I185	K155-P194 WeakPolarHBondContact CE-O 3.42Å; K155-P194 PolarHBondContact NZ-O 2.98Å; I185-P194 HydrophobicContact CG2-CB 4.03Å; I185-P194 HydrophobicContact CG2-CG 4.15Å
195	S	84.1	Confident	81	Confident	100 Å²	100	49.5 Å²	49.5	70%	0.699	30%	0.302	S	S	*	.	S	Bend	trans	-73.6	-51.1	-173.4	63	0	0	0	0	111.3	K155 D187 P193	K155-S195 PolarHBondContact NZ-O 3.31Å; D187-S195 WeakPolarHBondContact OD2-CB 3.37Å; D187-S195 PolarHBondContact OD2-N 3.5Å; D187-S195 PolarHBondContact OD2-OG 3.17Å; P193-S195 PolarHBondContact O-N 3.17Å
196	G	82.5	Confident	78.8	Confident	26 Å²	26	51.1 Å²	51.1	27%	0.268	31%	0.312	S	S	.	.	S	Bend	trans	-95.7	176.5	-178.6	0	0	0	0	0	115.3	G198	G196-G198 PolarHBondContact O-N 3.49Å
197	P	80	Confident	76.9	Confident	102 Å²	102	55.1 Å²	55.1	66%	0.662	32%	0.322	S	S	*	.			trans	-75.8	-2.7	170.9	32.1	-35	0	0	0	113.5	V183	V183-P197 WeakPolarHBondContact CG1-O 3.38Å
198	G	82.4	Confident	74.4	Confident	30 Å²	30	54.3 Å²	54.3	31%	0.309	32%	0.321	S	S	.	.			trans	81.8	167.7	-173.8	0	0	0	0	0	113.2	F184 G196 K200	F184-G198 CarbonylContact O-C 3.29Å; F184-G198 WeakPolarHBondContact O-CA 3.38Å; G196-G198 PolarHBondContact O-N 3.49Å; G198-K200 PolarHBondContact O-N 3.29Å
199	K	85.1	Confident	71.6	Confident	98 Å²	98	57.7 Å²	57.7	43%	0.426	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	107.2	175.4	-178	179.8	178.7	180	0	109	F184 V201	F184-K199 HydrophobicContact CB-CB 4.45Å; F184-K199 PolarHBondContact N-O 2.88Å; F184-K199 PolarHBondContact O-N 3.42Å; K199-V201 HydrophobicContact CG-CG2 4.23Å
200	K	83.4	Confident	69.1	Low	52 Å²	52	62.1 Å²	62.1	23%	0.226	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	136.2	176.8	-171	172.1	-179.6	-176.9	0	110.7	D159 I182 V183 G198 Y202	D159-K200 IonicContact OD1-NZ 2.82Å; D159-K200 WeakPolarHBondContact OD2-CE 3.42Å; D159-K200 IonicContact OD2-NZ 2.65Å; D159-K200 PolarHBondContact OD2-NZ 3.43Å; I182-K200 CarbonylContact O-C 3.49Å; I182-K200 WeakPolarHBondContact O-CA 3.23Å; V183-K200 HydrophobicContact CG2-CB 4.23Å; V183-K200 HydrophobicContact CG2-CG 4.09Å; G198-K200 PolarHBondContact O-N 3.29Å; K200-Y202 HydrophobicContact CD-CE1 4.44Å; K200-Y202 VanDerWaalsContact CE-OH 3.25Å; K200-Y202 WeakPolarHBondContact CE-OH 3.32Å; K200-Y202 HydrophobicContact CG-CE2 4.48Å; K200-Y202 PolarHBondContact NZ-OH 3.38Å
201	V	80.3	Confident	66.7	Low	6 Å²	6	63.1 Å²	63.1	4%	0.036	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	144.6	178.3	-155	0	0	0	0	111.5	G181 I182 F184 K199 I232 T233	G181-V201 WeakPolarHBondContact CA-O 3.09Å; I182-V201 PolarHBondContact N-O 3.2Å; I182-V201 PolarHBondContact O-N 2.94Å; F184-V201 HydrophobicContact CD2-CG2 3.84Å; F184-V201 HydrophobicContact CE2-CB 4.38Å; F184-V201 HydrophobicContact CE2-CG2 3.87Å; K199-V201 HydrophobicContact CG-CG2 4.23Å; V201-I232 HydrophobicContact CB-CG2 4.02Å; V201-I232 HydrophobicContact CG1-CB 4.07Å; V201-I232 HydrophobicContact CG1-CG2 3.11Å; V201-I232 HydrophobicContact CG2-CG2 4.45Å; V201-T233 VanDerWaalsContact CG1-O 3.26Å; V201-T233 WeakPolarHBondContact CG1-O 3.49Å
202	Y	76.7	Confident	64.1	Low	24 Å²	24	67.1 Å²	67.1	9%	0.094	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	149.1	-176.9	-58.8	-83.9	0	0	0	111.1	E180 K200 I232 T233 E235 K236 P237	E180-Y202 WeakPolarHBondContact O-CD1 3.29Å; E180-Y202 VanDerWaalsContact O-CE1 3.31Å; E180-Y202 WeakPolarHBondContact O-CE1 3.42Å; K200-Y202 HydrophobicContact CD-CE1 4.44Å; K200-Y202 VanDerWaalsContact CE-OH 3.25Å; K200-Y202 WeakPolarHBondContact CE-OH 3.32Å; K200-Y202 HydrophobicContact CG-CE2 4.48Å; K200-Y202 PolarHBondContact NZ-OH 3.38Å; Y202-I232 WeakPolarHBondContact O-CA 3.39Å; Y202-T233 PolarHBondContact N-O 3.27Å; Y202-T233 PolarHBondContact O-N 2.95Å; Y202-E235 WeakPolarHBondContact CD2-O 3.32Å; Y202-K236 HydrophobicContact CE1-CG 4.1Å; Y202-K236 HydrophobicContact CE2-CB 3.91Å; Y202-K236 HydrophobicContact CE2-CG 4.39Å; Y202-P237 HydrophobicContact CG-CG 4.49Å
203	I	70.9	Confident	61.5	Low	4 Å²	4	67.9 Å²	67.9	2%	0.021	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	113.4	176.6	-57.9	-166.5	0	0	0	108	I182 I230 L244 L262	I182-I203 HydrophobicContact CD1-CD1 3.62Å; I182-I203 HydrophobicContact CD1-CG1 4.36Å; I182-I203 HydrophobicContact CG1-CD1 4.48Å; I203-I230 HydrophobicContact CG2-CG2 3.39Å; I203-L244 HydrophobicContact CB-CD1 4.42Å; I203-L244 HydrophobicContact CB-CD2 4.45Å; I203-L244 HydrophobicContact CB-CG 4.36Å; I203-L244 HydrophobicContact CD1-CD2 4.01Å; I203-L244 HydrophobicContact CG1-CD1 4.47Å; I203-L244 HydrophobicContact CG1-CD2 4.33Å; I203-L262 HydrophobicContact CD1-CD1 3.11Å
204	S	59.4	Low	58.7	Low	26 Å²	26	74.6 Å²	74.6	18%	0.182	43%	0.428	C	S	.	.	B	Isolated β-bridge	trans	-92.8	124.3	175.9	51	0	0	0	0	109.9	I230 L231	S204-I230 WeakPolarHBondContact O-CG1 3.43Å; S204-L231 PolarHBondContact OG-O 3.35Å
205	S	51.9	Low	56	Low	23 Å²	23	83 Å²	83	16%	0.161	47%	0.472	C	S	.	.			trans	-82.9	152.6	173.5	83.2	0	0	0	0	111.4	T243	S205-T243 WeakPolarHBondContact OG-CG2 3.15Å
206	P	42.9	Very low	53.3	Low	36 Å²	36	82.7 Å²	82.7	23%	0.234	48%	0.476	C	S	.	.	G	3₁₀ helix	trans	-87.8	-3.3	177.7	7.4	11.2	0	0	0	113.7	S208 K227 V228 I230	P206-S208 PolarHBondContact O-N 3.25Å; P206-K227 WeakPolarHBondContact CB-O 3.33Å; P206-V228 HydrophobicContact CG-CB 3.88Å; P206-V228 HydrophobicContact CG-CG1 3.73Å; P206-V228 HydrophobicContact CG-CG2 3.87Å; P206-I230 HydrophobicContact CG-CG1 4.25Å
207	H	44.3	Very low	50.9	Low	162 Å²	162	88.6 Å²	88.6	75%	0.75	51%	0.507	S	S	*	.	G	3₁₀ helix	trans	-80.2	0.9	-174.3	-73.7	7.9	0	0	0	114.1
208	S	34.8	Very low	48.6	Very low	41 Å²	41	88.4 Å²	88.4	29%	0.287	51%	0.514	S	S	.	.	G	3₁₀ helix	trans	-127.3	34.2	-178.4	56	0	0	0	0	114.5	P206 P210 F241	P206-S208 PolarHBondContact O-N 3.25Å; S208-P210 WeakPolarHBondContact O-CD 3.47Å; S208-F241 WeakPolarHBondContact O-CE1 3.39Å; S208-F241 WeakPolarHBondContact O-CZ 3.47Å; S208-F241 VanDerWaalsContact OG-CD1 3.24Å; S208-F241 WeakPolarHBondContact OG-CD1 3.44Å
209	S	28.3	Very low	46.4	Very low	87 Å²	87	94.3 Å²	94.3	61%	0.608	54%	0.544	S	S	*	.			trans	-81.7	123.2	166	62.8	0	0	0	0	111.5	A211	S209-A211 PolarHBondContact O-N 3.25Å; S209-A211 VanDerWaalsContact O-N 3.09Å
210	P	31.5	Very low	44	Very low	125 Å²	125	92.3 Å²	92.3	81%	0.812	55%	0.552	S	S	*	*			trans	-84.1	78.3	175.8	33.3	-31.5	0	0	0	110.5	S208	S208-P210 WeakPolarHBondContact O-CD 3.47Å
211	A	34	Very low	41.9	Very low	74 Å²	74	93.7 Å²	93.7	61%	0.612	57%	0.573	S	S	*	*			trans	-159.5	122.6	163.2	0	0	0	0	0	111.6	S209	S209-A211 PolarHBondContact O-N 3.25Å; S209-A211 VanDerWaalsContact O-N 3.09Å
212	H	29.9	Very low	39.8	Very low	184 Å²	184	102.6 Å²	102.6	85%	0.852	61%	0.611	S	S	*	*			trans	84.4	78.6	174.3	-63.2	-66.9	0	0	0	118.6	K214	H212-K214 PolarHBondContact O-N 3.02Å; H212-K214 VanDerWaalsContact O-N 3.13Å
213	N	30.8	Very low	38.1	Very low	162 Å²	162	110.2 Å²	110.2	87%	0.866	65%	0.645	S	S	*	*			trans	-52.1	104.9	139.6	-91.2	-23	0	0	0	110.5
214	K	30.5	Very low	36.5	Very low	201 Å²	201	112.9 Å²	112.9	87%	0.874	67%	0.667	S	S	*	*			trans	-166.5	105.9	140.7	-105.3	174.6	-174.3	-176.9	0	108.1	H212 A216	H212-K214 PolarHBondContact O-N 3.02Å; H212-K214 VanDerWaalsContact O-N 3.13Å; K214-A216 PolarHBondContact O-N 2.95Å
215	L	32.6	Very low	35.6	Very low	179 Å²	179	114.5 Å²	114.5	94%	0.937	67%	0.674	S	S	*	*			trans	-63.3	125.3	169.9	-85.3	106	0	0	0	109.6
216	A	28	Very low	34.8	Very low	95 Å²	95	120.4 Å²	120.4	79%	0.785	70%	0.704	S	S	*	*			trans	-118.8	125.6	158.6	0	0	0	0	0	108.4	K214 A218	K214-A216 PolarHBondContact O-N 2.95Å; A216-A218 PolarHBondContact O-N 3.28Å
217	T	32	Very low	34.7	Very low	150 Å²	150	127 Å²	127	92%	0.92	73%	0.728	S	S	*	*			trans	-66.2	104.3	175.8	42.5	0	0	0	0	110.7
218	A	30.6	Very low	34.7	Very low	98 Å²	98	120.6 Å²	120.6	81%	0.81	70%	0.701	S	S	*	*			trans	-153	124.8	164	0	0	0	0	0	110.5	A216	A216-A218 PolarHBondContact O-N 3.28Å
219	T	36.9	Very low	35.4	Very low	153 Å²	153	124.3 Å²	124.3	94%	0.939	71%	0.712	S	S	*	*			trans	-80.1	123.5	177.7	43.1	0	0	0	0	110.8
220	G	34.9	Very low	36.6	Very low	57 Å²	57	120.4 Å²	120.4	59%	0.588	68%	0.684	S	S	*	*			trans	162.4	126.7	167	0	0	0	0	0	114.6	K222 K223	G220-K222 PolarHBondContact O-N 2.9Å; G220-K223 PolarHBondContact O-N 3.18Å
221	A	37.8	Very low	37.6	Very low	80 Å²	80	117.5 Å²	117.5	66%	0.661	66%	0.661	S	S	*	*	G	3₁₀ helix	trans	-56	-19.9	174.9	0	0	0	0	0	114.1	K223 A224	A221-K223 VanDerWaalsContact C-N 3.35Å; A221-K223 PolarHBondContact O-N 3Å; A221-A224 PolarHBondContact O-N 3.17Å
222	K	37.8	Very low	38.8	Very low	193 Å²	193	115.1 Å²	115.1	84%	0.839	64%	0.638	S	S	*	*	G	3₁₀ helix	trans	-66	-22.3	-177.2	-73.5	-174.3	173.4	-174.8	0	115.3	G220	G220-K222 PolarHBondContact O-N 2.9Å
223	K	39.4	Very low	40.4	Very low	184 Å²	184	108.5 Å²	108.5	80%	0.8	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-96.9	-10.4	178.3	-105	-175.3	-178.6	177.3	0	115.2	G220 A221 L225	G220-K223 PolarHBondContact O-N 3.18Å; A221-K223 VanDerWaalsContact C-N 3.35Å; A221-K223 PolarHBondContact O-N 3Å; K223-L225 VanDerWaalsContact C-N 3.34Å
224	A	38.8	Very low	41.8	Very low	60 Å²	60	107.2 Å²	107.2	50%	0.496	60%	0.599	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.7	-34.2	173.8	0	0	0	0	0	111.4	A221 K227 V228	A221-A224 PolarHBondContact O-N 3.17Å; A224-K227 PolarHBondContact O-N 3.48Å; A224-V228 WeakPolarHBondContact O-CG2 3.33Å
225	L	40.3	Very low	43.2	Very low	60 Å²	60	105.4 Å²	105.4	31%	0.314	59%	0.594	S	S	.	*	G	3₁₀ helix	trans	-67.8	-35.5	-176.8	-90.3	115.3	0	0	0	115	K223 K227 V228 E338	K223-L225 VanDerWaalsContact C-N 3.34Å; L225-K227 PolarHBondContact O-N 3.46Å; L225-K227 VanDerWaalsContact O-N 3.08Å; L225-V228 PolarHBondContact O-N 2.92Å; L225-E338 WeakPolarHBondContact CD2-OE1 3.18Å; L225-E338 WeakPolarHBondContact CD2-OE2 3.5Å
226	N	35.4	Very low	44.4	Very low	148 Å²	148	102.8 Å²	102.8	79%	0.791	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-69.2	-8	-180	-83.5	-2.3	0	0	0	114.1
227	K	39.3	Very low	45.8	Very low	174 Å²	174	99.5 Å²	99.5	76%	0.757	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-113.4	-6.4	177.1	-76.2	-173	174	-172.8	0	114.1	P206 A224 L225 K229	P206-K227 WeakPolarHBondContact CB-O 3.33Å; A224-K227 PolarHBondContact O-N 3.48Å; L225-K227 PolarHBondContact O-N 3.46Å; L225-K227 VanDerWaalsContact O-N 3.08Å; K227-K229 PolarHBondContact O-N 3.04Å
228	V	44.4	Very low	46.8	Very low	27 Å²	27	95.9 Å²	95.9	16%	0.164	53%	0.526	C	S	.	.			trans	-94.5	72.8	-178.8	-175.7	0	0	0	0	109.8	P206 A224 L225 I230	P206-V228 HydrophobicContact CG-CB 3.88Å; P206-V228 HydrophobicContact CG-CG1 3.73Å; P206-V228 HydrophobicContact CG-CG2 3.87Å; A224-V228 WeakPolarHBondContact O-CG2 3.33Å; L225-V228 PolarHBondContact O-N 2.92Å; V228-I230 HydrophobicContact CG1-CD1 3.83Å; V228-I230 HydrophobicContact CG1-CG1 3.84Å
229	K	50	Low	47.8	Very low	120 Å²	120	95.6 Å²	95.6	52%	0.522	52%	0.524	S	S	.	.			trans	-93.9	85.8	162.6	-78.9	-176.4	177.8	177.1	0	107.6	K227 L231	K227-K229 PolarHBondContact O-N 3.04Å; K229-L231 PolarHBondContact O-N 3.44Å
230	I	53.7	Low	48.2	Very low	5 Å²	5	96.4 Å²	96.4	3%	0.026	52%	0.517	C	S	.	.			trans	-76.2	103.6	168.6	-66.4	173.4	0	0	0	106.1	I203 S204 P206 V228 L269 T278	I203-I230 HydrophobicContact CG2-CG2 3.39Å; S204-I230 WeakPolarHBondContact O-CG1 3.43Å; P206-I230 HydrophobicContact CG-CG1 4.25Å; V228-I230 HydrophobicContact CG1-CD1 3.83Å; V228-I230 HydrophobicContact CG1-CG1 3.84Å; I230-L269 HydrophobicContact CD1-CD1 3.42Å; I230-L269 VanDerWaalsContact CD1-CD1 3.42Å; I230-L269 HydrophobicContact CD1-CD2 4.42Å; I230-T278 HydrophobicContact CB-CG2 3.92Å; I230-T278 HydrophobicContact CD1-CG2 4.3Å; I230-T278 HydrophobicContact CG2-CG2 4.47Å
231	L	53.4	Low	48.8	Very low	64 Å²	64	96 Å²	96	34%	0.335	50%	0.5	S	S	.	.	B	Isolated β-bridge	trans	-87.3	122.5	173.6	-86	143.9	0	0	0	108.2	S204 K229 T233 T993	S204-L231 PolarHBondContact OG-O 3.35Å; K229-L231 PolarHBondContact O-N 3.44Å; L231-T233 HydrophobicContact CB-CG2 3.88Å; L231-T233 PolarHBondContact O-N 3.28Å; L231-T233 VanDerWaalsContact O-N 3.16Å; L231-T993 HydrophobicContact CD2-CG2 4.4Å
232	I	59.2	Low	49.4	Very low	23 Å²	23	94 Å²	94	12%	0.118	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	94.2	168.9	-74.6	177.9	0	0	0	106.1	V201 Y202 L271 N276	V201-I232 HydrophobicContact CB-CG2 4.02Å; V201-I232 HydrophobicContact CG1-CB 4.07Å; V201-I232 HydrophobicContact CG1-CG2 3.11Å; V201-I232 HydrophobicContact CG2-CG2 4.45Å; Y202-I232 WeakPolarHBondContact O-CA 3.39Å; I232-L271 HydrophobicContact CD1-CD1 3.82Å; I232-L271 HydrophobicContact CD1-CD2 4.05Å; I232-L271 HydrophobicContact CD1-CG 4.37Å; I232-N276 HydrophobicContact CB-CB 3.85Å; I232-N276 WeakPolarHBondContact CB-O 3.46Å; I232-N276 HydrophobicContact CD1-CB 4.25Å; I232-N276 HydrophobicContact CG2-CB 3.64Å
233	T	61.8	Low	50.3	Low	46 Å²	46	86.6 Å²	86.6	28%	0.282	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	140	-175.6	59.3	0	0	0	0	111.5	V201 Y202 L231 E235	V201-T233 VanDerWaalsContact CG1-O 3.26Å; V201-T233 WeakPolarHBondContact CG1-O 3.49Å; Y202-T233 PolarHBondContact N-O 3.27Å; Y202-T233 PolarHBondContact O-N 2.95Å; L231-T233 HydrophobicContact CB-CG2 3.88Å; L231-T233 PolarHBondContact O-N 3.28Å; L231-T233 VanDerWaalsContact O-N 3.16Å; T233-E235 VanDerWaalsContact C-N 3.31Å; T233-E235 PolarHBondContact OG1-O 3.3Å
234	Q	60.9	Low	51.2	Low	134 Å²	134	78 Å²	78	63%	0.626	41%	0.411	S	S	*	.	S	Bend	trans	-77.2	-22.6	173.9	-65.2	178.6	30.8	0	0	112
235	E	59.8	Low	52.2	Low	163 Å²	163	81.2 Å²	81.2	76%	0.762	42%	0.42	S	S	*	.	S	Bend	trans	-77.4	136.3	175.3	-63.7	-174.6	171.6	0	0	110.4	Y202 T233 P237	Y202-E235 WeakPolarHBondContact CD2-O 3.32Å; T233-E235 VanDerWaalsContact C-N 3.31Å; T233-E235 PolarHBondContact OG1-O 3.3Å; E235-P237 WeakPolarHBondContact O-CD 3.43Å
236	K	57.1	Low	53.6	Low	124 Å²	124	83.7 Å²	83.7	54%	0.539	43%	0.433	S	S	.	.			trans	-67.8	113.1	176.7	-172.9	171.9	-174.4	165.8	0	108.3	E180 Y202	E180-K236 WeakPolarHBondContact OE2-CE 3.44Å; E180-K236 IonicContact OE2-NZ 3.67Å; E180-K236 PolarHBondContact OE2-NZ 2.82Å; Y202-K236 HydrophobicContact CE1-CG 4.1Å; Y202-K236 HydrophobicContact CE2-CB 3.91Å; Y202-K236 HydrophobicContact CE2-CG 4.39Å
237	P	58.1	Low	55.8	Low	26 Å²	26	77.2 Å²	77.2	17%	0.169	40%	0.4	C	S	.	.			trans	-66.5	158.8	175.3	28.5	-32.5	0	0	0	110.1	Y202 E235 F241 I242	Y202-P237 HydrophobicContact CG-CG 4.49Å; E235-P237 WeakPolarHBondContact O-CD 3.43Å; P237-F241 HydrophobicContact CB-CB 4.1Å; P237-I242 HydrophobicContact CG-CG1 4.31Å
238	S	53.1	Low	57.9	Low	74 Å²	74	73 Å²	73	52%	0.517	39%	0.385	S	S	.	.			trans	-58.6	150.2	175.1	48.9	0	0	0	0	110.8	E240 F241	S238-E240 PolarHBondContact O-N 2.95Å; S238-F241 PolarHBondContact O-N 3Å; S238-F241 WeakPolarHBondContact OG-CD2 3.48Å; S238-F241 WeakPolarHBondContact OG-CE2 3.06Å
239	A	50.8	Low	60	Low	92 Å²	92	73.7 Å²	73.7	76%	0.76	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-56.6	-18.8	-167.5	0	0	0	0	0	115.2	F241	A239-F241 VanDerWaalsContact C-N 3.27Å; A239-F241 PolarHBondContact O-N 3.49Å
240	E	45.5	Very low	61.9	Low	170 Å²	170	68.4 Å²	68.4	79%	0.794	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-76.1	-4	177.1	-66	-179.2	160.3	0	0	114.5	S238	S238-E240 PolarHBondContact O-N 2.95Å
241	F	47.7	Very low	63.7	Low	50 Å²	50	68.6 Å²	68.6	22%	0.219	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-116.5	-1	-171.4	-66.7	-90.7	0	0	0	115.4	S208 P237 S238 A239 T243	S208-F241 WeakPolarHBondContact O-CE1 3.39Å; S208-F241 WeakPolarHBondContact O-CZ 3.47Å; S208-F241 VanDerWaalsContact OG-CD1 3.24Å; S208-F241 WeakPolarHBondContact OG-CD1 3.44Å; P237-F241 HydrophobicContact CB-CB 4.1Å; S238-F241 PolarHBondContact O-N 3Å; S238-F241 WeakPolarHBondContact OG-CD2 3.48Å; S238-F241 WeakPolarHBondContact OG-CE2 3.06Å; A239-F241 VanDerWaalsContact C-N 3.27Å; A239-F241 PolarHBondContact O-N 3.49Å; F241-T243 PolarHBondContact O-N 2.67Å
242	I	50.9	Low	65.5	Low	36 Å²	36	66.2 Å²	66.2	19%	0.185	35%	0.353	C	S	.	.	B	Isolated β-bridge	trans	-84.7	107.8	-176.4	-55.6	172.5	0	0	0	109.3	P237	P237-I242 HydrophobicContact CG-CG1 4.31Å
243	T	56.2	Low	66.9	Low	39 Å²	39	65.1 Å²	65.1	24%	0.239	35%	0.347	C	S	.	.			trans	-103.4	10	-176.5	49.8	0	0	0	0	114.5	S205 F241 N245 Y264	S205-T243 WeakPolarHBondContact OG-CG2 3.15Å; F241-T243 PolarHBondContact O-N 2.67Å; T243-N245 VanDerWaalsContact C-N 3.33Å; T243-N245 PolarHBondContact O-N 3.14Å; T243-Y264 WeakPolarHBondContact O-CE1 3.3Å
244	L	59.7	Low	68	Low	3 Å²	3	64 Å²	64	2%	0.016	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-76.4	-15.4	-174.3	-77.7	161.7	0	0	0	114.5	L177 G181 I182 I203 D246 C247	L177-L244 HydrophobicContact CD1-CD2 4.11Å; G181-L244 VanDerWaalsContact CA-CD1 3.42Å; I182-L244 HydrophobicContact CG1-CD2 4.49Å; I203-L244 HydrophobicContact CB-CD1 4.42Å; I203-L244 HydrophobicContact CB-CD2 4.45Å; I203-L244 HydrophobicContact CB-CG 4.36Å; I203-L244 HydrophobicContact CD1-CD2 4.01Å; I203-L244 HydrophobicContact CG1-CD1 4.47Å; I203-L244 HydrophobicContact CG1-CD2 4.33Å; L244-D246 PolarHBondContact O-N 3.48Å; L244-C247 HydrophobicContact CD2-CB 4.29Å; L244-C247 WeakPolarHBondContact O-CB 3.33Å; L244-C247 PolarHBondContact O-N 2.94Å; L244-C247 VanDerWaalsContact O-N 3.11Å
245	N	59.7	Low	69.1	Low	127 Å²	127	57.9 Å²	57.9	68%	0.679	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-61.5	-25.1	176.3	-75.8	-23.9	0	0	0	113	T243	T243-N245 VanDerWaalsContact C-N 3.33Å; T243-N245 PolarHBondContact O-N 3.14Å
246	D	69.7	Low	70.2	Confident	112 Å²	112	50.6 Å²	50.6	60%	0.599	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-97.6	1.7	179.7	-64.7	-26.2	0	0	0	113.1	L244 L248 Y264 P265	L244-D246 PolarHBondContact O-N 3.48Å; D246-L248 PolarHBondContact O-N 3.21Å; D246-Y264 HydrophobicContact CB-CD1 4.45Å; D246-P265 WeakPolarHBondContact O-CD 3.48Å
247	C	81.4	Confident	71.5	Confident	13 Å²	13	46.5 Å²	46.5	9%	0.088	26%	0.26	C	S	.	.			trans	-74.3	116	178.2	-171.8	0	0	0	0	110	L244 Y264	L244-C247 HydrophobicContact CD2-CB 4.29Å; L244-C247 WeakPolarHBondContact O-CB 3.33Å; L244-C247 PolarHBondContact O-N 2.94Å; L244-C247 VanDerWaalsContact O-N 3.11Å; C247-Y264 HydrophobicContact CB-CE1 4Å
248	L	83.7	Confident	72.8	Confident	84 Å²	84	46.9 Å²	46.9	44%	0.44	26%	0.261	S	S	.	.			trans	-81	-36.1	-175.5	-62.3	178.8	0	0	0	112.4	D246 L263 P265 F291	D246-L248 PolarHBondContact O-N 3.21Å; L248-L263 HydrophobicContact CB-CD2 4.14Å; L248-L263 HydrophobicContact CB-CG 4.2Å; L248-L263 HydrophobicContact CD1-CD2 4.46Å; L248-L263 HydrophobicContact CD1-CG 4.46Å; L248-L263 PolarHBondContact N-O 2.74Å; L248-P265 HydrophobicContact CD1-CG 4.1Å; L248-P265 HydrophobicContact CG-CG 4.34Å; L248-F291 WeakPolarHBondContact CD1-O 3.34Å
249	Q	87.4	Confident	74.4	Confident	43 Å²	43	43.7 Å²	43.7	20%	0.201	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	143.1	-172.1	-171.6	-176.5	-12.5	0	0	111.4	L263 V294	Q249-L263 HydrophobicContact CB-CB 3.88Å; Q249-L263 HydrophobicContact CB-CD2 4Å; Q249-L263 PolarHBondContact O-N 3.04Å; Q249-V294 PolarHBondContact NE2-O 3.25Å; Q249-V294 PolarHBondContact OE1-O 3.18Å; Q249-V294 VanDerWaalsContact OE1-O 3.12Å
250	L	90.5	Very high	76.3	Confident	8 Å²	8	39.3 Å²	39.3	4%	0.042	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	130.2	169.5	-178.7	154.3	0	0	0	108.2	T175 L177 I182 M260 L262	T175-L250 WeakPolarHBondContact OG1-CD2 3.26Å; L177-L250 HydrophobicContact CB-CD1 4.35Å; L177-L250 HydrophobicContact CD1-CD1 4.41Å; I182-L250 HydrophobicContact CD1-CD1 3.7Å; I182-L250 HydrophobicContact CG1-CD1 3.97Å; I182-L250 HydrophobicContact CG2-CD1 3.97Å; L250-M260 HydrophobicContact CD1-CE 4.24Å; L250-M260 HydrophobicContact CD1-SD 3.97Å; L250-M260 HydrophobicContact CD2-CG 4.47Å; L250-M260 HydrophobicContact CD2-SD 3.87Å; L250-M260 HydrophobicContact CG-CG 4.43Å; L250-M260 HydrophobicContact CG-SD 3.88Å; L250-L262 HydrophobicContact CB-CD2 4.1Å; L250-L262 HydrophobicContact CD1-CD2 3.83Å; L250-L262 HydrophobicContact CG-CD2 3.88Å
251	A	90.4	Very high	78.5	Confident	10 Å²	10	31.2 Å²	31.2	8%	0.083	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	143	178	0	0	0	0	0	111.9	M260 L261	A251-M260 WeakPolarHBondContact O-CG 3.3Å; A251-L261 PolarHBondContact N-O 2.6Å; A251-L261 PolarHBondContact O-N 3.25Å
252	Y	91.2	Very high	80.5	Confident	13 Å²	13	28.8 Å²	28.8	5%	0.051	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	150.4	166	-75.7	-87.5	0	0	0	111.4	S165 F166 D167 P168 T175 P254 L273	S165-Y252 WeakPolarHBondContact O-CE2 3.16Å; F166-Y252 VanDerWaalsContact C-CD2 3.47Å; F166-Y252 WeakPolarHBondContact O-CD2 3.46Å; D167-Y252 HydrophobicContact CB-CD1 4.37Å; D167-Y252 HydrophobicContact CB-CE1 4.02Å; D167-Y252 HydrophobicContact CB-CE2 4.25Å; P168-Y252 VanDerWaalsContact CD-CB 3.44Å; T175-Y252 HydrophobicContact CG2-CE2 4.02Å; T175-Y252 WeakPolarHBondContact CG2-OH 3.2Å; T175-Y252 WeakPolarHBondContact OG1-CE2 3.43Å; Y252-P254 WeakPolarHBondContact O-CD 3.11Å; Y252-L273 HydrophobicContact CD1-CD1 4.29Å; Y252-L273 HydrophobicContact CE1-CD1 3.53Å
253	L	89.1	Confident	82.3	Confident	1 Å²	1	27.1 Å²	27.1	1%	0.005	14%	0.144	C	C	.	.			trans	-81.9	114.9	169.8	-83.2	152.1	0	0	0	109.2	S255 K256 H259 I270 P296 L303	L253-S255 VanDerWaalsContact C-N 3.25Å; L253-S255 PolarHBondContact O-N 3.4Å; L253-K256 PolarHBondContact O-N 2.96Å; L253-H259 HydrophobicContact CB-CB 4.11Å; L253-H259 HydrophobicContact CD1-CB 3.56Å; L253-H259 HydrophobicContact CG-CB 4.44Å; L253-H259 PolarHBondContact N-O 3.01Å; L253-I270 HydrophobicContact CD1-CG2 3.81Å; L253-P296 HydrophobicContact CD2-CB 3.95Å; L253-L303 HydrophobicContact CD2-CD2 4.14Å
254	P	86.3	Confident	83.8	Confident	21 Å²	21	25.9 Å²	25.9	14%	0.136	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-16.8	-179.1	34.2	-34.5	0	0	0	112	P168 F169 Y252 P296 C297 F298	P168-P254 HydrophobicContact CB-CB 4.34Å; P168-P254 HydrophobicContact CG-CB 4.1Å; F169-P254 VanDerWaalsContact CZ-O 3.3Å; F169-P254 WeakPolarHBondContact CZ-O 3.46Å; Y252-P254 WeakPolarHBondContact O-CD 3.11Å; P254-P296 HydrophobicContact CG-CB 4.41Å; P254-P296 HydrophobicContact CG-CG 4.36Å; P254-C297 WeakPolarHBondContact CG-O 3.41Å; P254-F298 HydrophobicContact CB-CB 4.15Å; P254-F298 HydrophobicContact CB-CD2 4.02Å; P254-F298 HydrophobicContact CG-CB 4.19Å
255	S	83.6	Confident	85.1	Confident	7 Å²	7	27.8 Å²	27.8	5%	0.049	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-24.9	173.8	61.1	0	0	0	0	113.7	L253 D301	L253-S255 VanDerWaalsContact C-N 3.25Å; L253-S255 PolarHBondContact O-N 3.4Å; S255-D301 PolarHBondContact OG-OD1 3.45Å
256	K	82.4	Confident	86.4	Confident	9 Å²	9	27.5 Å²	27.5	4%	0.039	14%	0.137	C	C	.	.	S	Bend	trans	-144.4	126.9	-169.6	-76	179.8	174.1	161.6	0	113.3	L253 H259 D301 R317 F979	L253-K256 PolarHBondContact O-N 2.96Å; K256-H259 HydrophobicContact CB-CB 4.38Å; K256-D301 WeakPolarHBondContact CE-OD2 3.18Å; K256-D301 IonicContact NZ-OD2 3.25Å; K256-D301 PolarHBondContact NZ-OD2 2.79Å; K256-R317 VanDerWaalsContact NZ-CD 3.25Å; K256-R317 VanDerWaalsContact NZ-CZ 3.25Å; K256-F979 HydrophobicContact CG-CZ 4.26Å
257	R	84.1	Confident	87.2	Confident	39 Å²	39	24.9 Å²	24.9	15%	0.147	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	144.9	175.2	-169.7	166.8	-174.9	159.5	7.1	112.5	F169 H259 D968	F169-R257 HydrophobicContact CB-CG 4.27Å; F169-R257 HydrophobicContact CD1-CB 4.41Å; F169-R257 HydrophobicContact CD2-CB 3.96Å; F169-R257 HydrophobicContact CD2-CG 4.19Å; F169-R257 HydrophobicContact CE2-CB 4.13Å; F169-R257 VanDerWaalsContact CE2-N 3.35Å; F169-R257 HydrophobicContact CG-CB 4.11Å; F169-R257 HydrophobicContact CG-CG 4.15Å; F169-R257 HydrophobicContact CZ-CB 4.41Å; R257-H259 PolarHBondContact O-N 3.43Å; R257-H259 PolarHBondContact O-ND1 3.1Å; R257-D968 WeakPolarHBondContact CD-OD2 3.48Å; R257-D968 IonicContact CZ-OD2 2.71Å; R257-D968 IonicContact NE-OD2 3.07Å; R257-D968 IonicContact NH1-OD2 3.83Å; R257-D968 PolarHBondContact NH1-OD2 3.22Å
258	N	84.4	Confident	87.6	Confident	34 Å²	34	24.3 Å²	24.3	18%	0.182	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.9	17.8	176.2	-58.6	-21.3	0	0	0	115.4	L273 E274	N258-L273 HydrophobicContact CB-CB 4.5Å; N258-L273 WeakPolarHBondContact O-CB 3.2Å; N258-L273 WeakPolarHBondContact O-CG 3.01Å; N258-L273 PolarHBondContact O-N 3.29Å; N258-E274 HydrophobicContact CB-CG 4.05Å; N258-E274 PolarHBondContact ND2-OE1 3.19Å
259	H	88.2	Confident	87.7	Confident	6 Å²	6	20.3 Å²	20.3	3%	0.028	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	137.7	173.7	-70.3	65.7	0	0	0	111.2	L253 K256 R257 L271	L253-H259 HydrophobicContact CB-CB 4.11Å; L253-H259 HydrophobicContact CD1-CB 3.56Å; L253-H259 HydrophobicContact CG-CB 4.44Å; L253-H259 PolarHBondContact N-O 3.01Å; K256-H259 HydrophobicContact CB-CB 4.38Å; R257-H259 PolarHBondContact O-N 3.43Å; R257-H259 PolarHBondContact O-ND1 3.1Å; H259-L271 CarbonylContact C-O 3.53Å; H259-L271 VanDerWaalsContact CA-O 3.31Å; H259-L271 WeakPolarHBondContact CA-O 3.5Å
260	M	90.1	Very high	87.8	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	144.7	-179.8	-169.7	177.7	69.8	0	0	110.7	T175 I182 F184 L250 A251 L262 I270 L271 L273	T175-M260 HydrophobicContact CG2-SD 4.33Å; I182-M260 HydrophobicContact CD1-CE 3.86Å; F184-M260 HydrophobicContact CZ-CE 4.29Å; L250-M260 HydrophobicContact CD1-CE 4.24Å; L250-M260 HydrophobicContact CD1-SD 3.97Å; L250-M260 HydrophobicContact CD2-CG 4.47Å; L250-M260 HydrophobicContact CD2-SD 3.87Å; L250-M260 HydrophobicContact CG-CG 4.43Å; L250-M260 HydrophobicContact CG-SD 3.88Å; A251-M260 WeakPolarHBondContact O-CG 3.3Å; M260-L262 HydrophobicContact CE-CD2 4.09Å; M260-L262 HydrophobicContact CE-CG 4.39Å; M260-I270 WeakPolarHBondContact O-CA 3.09Å; M260-L271 HydrophobicContact CE-CD1 3.65Å; M260-L271 PolarHBondContact N-O 3.48Å; M260-L271 PolarHBondContact O-N 3.44Å; M260-L273 HydrophobicContact CB-CD1 4.3Å; M260-L273 HydrophobicContact CB-CD2 4.07Å; M260-L273 HydrophobicContact CB-CG 4.27Å; M260-L273 HydrophobicContact CE-CD2 4.14Å; M260-L273 HydrophobicContact SD-CD2 4.39Å
261	L	91.4	Very high	87.6	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	133	178.8	-176.5	151.1	0	0	0	110.1	A251 L263 I268 L269 V294 L303	A251-L261 PolarHBondContact N-O 2.6Å; A251-L261 PolarHBondContact O-N 3.25Å; L261-L263 HydrophobicContact CD2-CB 4.25Å; L261-I268 HydrophobicContact CD1-CG2 3.57Å; L261-I268 HydrophobicContact CD2-CG2 3.99Å; L261-I268 HydrophobicContact CG-CG2 3.58Å; L261-L269 WeakPolarHBondContact CA-O 3.46Å; L261-V294 HydrophobicContact CD1-CG1 3.93Å; L261-V294 HydrophobicContact CD2-CB 4.48Å; L261-L303 HydrophobicContact CD1-CD1 4.24Å; L261-L303 HydrophobicContact CD1-CD2 3.85Å
262	L	89.4	Confident	87.3	Confident	0 Å²	0	17.4 Å²	17.4	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	127.8	168.1	-61.1	175.7	0	0	0	109.8	I182 I203 L250 M260 Y264 L269 L271	I182-L262 HydrophobicContact CD1-CD1 4.25Å; I182-L262 HydrophobicContact CD1-CD2 3.89Å; I203-L262 HydrophobicContact CD1-CD1 3.11Å; L250-L262 HydrophobicContact CB-CD2 4.1Å; L250-L262 HydrophobicContact CD1-CD2 3.83Å; L250-L262 HydrophobicContact CG-CD2 3.88Å; M260-L262 HydrophobicContact CE-CD2 4.09Å; M260-L262 HydrophobicContact CE-CG 4.39Å; L262-Y264 HydrophobicContact CB-CE2 4.11Å; L262-L269 HydrophobicContact CB-CB 4.35Å; L262-L269 PolarHBondContact N-O 2.89Å; L262-L269 PolarHBondContact O-N 3.08Å; L262-L271 HydrophobicContact CD1-CD1 3.36Å; L262-L271 HydrophobicContact CD1-CG 4.27Å; L262-L271 HydrophobicContact CG-CD1 3.87Å
263	L	89.8	Confident	86.9	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	125.3	-179.5	-177.5	62.1	0	0	0	110.8	L248 Q249 L261 I268 F291 V294	L248-L263 HydrophobicContact CB-CD2 4.14Å; L248-L263 HydrophobicContact CB-CG 4.2Å; L248-L263 HydrophobicContact CD1-CD2 4.46Å; L248-L263 HydrophobicContact CD1-CG 4.46Å; L248-L263 PolarHBondContact N-O 2.74Å; Q249-L263 HydrophobicContact CB-CB 3.88Å; Q249-L263 HydrophobicContact CB-CD2 4Å; Q249-L263 PolarHBondContact O-N 3.04Å; L261-L263 HydrophobicContact CD2-CB 4.25Å; L263-I268 HydrophobicContact CD1-CG1 3.79Å; L263-F291 HydrophobicContact CD1-CB 3.79Å; L263-F291 HydrophobicContact CD1-CD2 4.19Å; L263-F291 HydrophobicContact CD1-CG 4.18Å; L263-V294 HydrophobicContact CD1-CG2 3.58Å; L263-V294 HydrophobicContact CD2-CB 4.42Å; L263-V294 HydrophobicContact CD2-CG2 4.03Å; L263-V294 HydrophobicContact CG-CG2 4.39Å
264	Y	87.8	Confident	86.5	Confident	14 Å²	14	20.1 Å²	20.1	6%	0.055	10%	0.095	C	C	.	.			trans	-116.5	161.6	165.5	-64.8	-89.8	0	0	0	109.4	T243 D246 C247 L262 R266 E267 L269	T243-Y264 WeakPolarHBondContact O-CE1 3.3Å; D246-Y264 HydrophobicContact CB-CD1 4.45Å; C247-Y264 HydrophobicContact CB-CE1 4Å; L262-Y264 HydrophobicContact CB-CE2 4.11Å; Y264-R266 PolarHBondContact O-N 3.18Å; Y264-E267 WeakPolarHBondContact CA-O 3.41Å; Y264-E267 WeakPolarHBondContact CB-O 3.26Å; Y264-E267 HydrophobicContact CD2-CG 4.06Å; Y264-E267 HydrophobicContact CG-CG 4.12Å; Y264-E267 PolarHBondContact N-O 3.05Å; Y264-E267 PolarHBondContact O-N 3.34Å; Y264-E267 VanDerWaalsContact O-O 3.06Å; Y264-L269 HydrophobicContact CD2-CD1 4.21Å; Y264-L269 HydrophobicContact CD2-CG 4.3Å; Y264-L269 HydrophobicContact CE2-CD1 3.69Å; Y264-L269 HydrophobicContact CE2-CG 4.22Å
265	P	86.6	Confident	85.9	Confident	43 Å²	43	19.3 Å²	19.3	28%	0.279	9%	0.09	S	C	.	.	S	Bend	trans	-55.3	-29.2	-177.8	-27.7	34.3	0	0	0	114.3	D246 L248 P290 F291	D246-P265 WeakPolarHBondContact O-CD 3.48Å; L248-P265 HydrophobicContact CD1-CG 4.1Å; L248-P265 HydrophobicContact CG-CG 4.34Å; P265-P290 HydrophobicContact CB-CB 4.27Å; P265-P290 CarbonylContact O-C 3.56Å; P265-P290 WeakPolarHBondContact O-CA 3.48Å; P265-P290 WeakPolarHBondContact O-CB 3.47Å; P265-F291 PolarHBondContact O-N 3.41Å
266	R	86.5	Confident	85.6	Confident	121 Å²	121	20.5 Å²	20.5	46%	0.457	10%	0.095	S	C	.	.	S	Bend	trans	-122.4	-1.6	-177.6	-65.6	-174	178	-138.9	-3.8	114.7	Y264 I284 R286	Y264-R266 PolarHBondContact O-N 3.18Å; R266-I284 PolarHBondContact O-N 2.83Å; R266-R286 PolarHBondContact NH1-O 3.22Å
267	E	87.2	Confident	85.3	Confident	57 Å²	57	20.7 Å²	20.7	27%	0.266	10%	0.096	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	144.9	-177.4	60.1	-174.8	-179.3	0	0	111.6	Y264 I282	Y264-E267 WeakPolarHBondContact CA-O 3.41Å; Y264-E267 WeakPolarHBondContact CB-O 3.26Å; Y264-E267 HydrophobicContact CD2-CG 4.06Å; Y264-E267 HydrophobicContact CG-CG 4.12Å; Y264-E267 PolarHBondContact N-O 3.05Å; Y264-E267 PolarHBondContact O-N 3.34Å; Y264-E267 VanDerWaalsContact O-O 3.06Å; E267-I282 CarbonylContact C-O 3.54Å; E267-I282 VanDerWaalsContact CA-O 3.32Å; E267-I282 WeakPolarHBondContact CA-O 3.37Å
268	I	88.8	Confident	85	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	122.6	170	-53	169.4	0	0	0	106.5	L261 L263 V281 I282 F291 V294	L261-I268 HydrophobicContact CD1-CG2 3.57Å; L261-I268 HydrophobicContact CD2-CG2 3.99Å; L261-I268 HydrophobicContact CG-CG2 3.58Å; L263-I268 HydrophobicContact CD1-CG1 3.79Å; I268-V281 WeakPolarHBondContact O-CA 3.3Å; I268-I282 HydrophobicContact CB-CB 4.05Å; I268-I282 HydrophobicContact CB-CD1 4.39Å; I268-I282 HydrophobicContact CD1-CB 4.33Å; I268-I282 HydrophobicContact CD1-CD1 4.2Å; I268-I282 HydrophobicContact CD1-CG2 4.48Å; I268-I282 HydrophobicContact CG1-CB 4.46Å; I268-I282 PolarHBondContact N-O 3.19Å; I268-I282 PolarHBondContact O-N 3.47Å; I268-F291 HydrophobicContact CD1-CD2 4.21Å; I268-F291 HydrophobicContact CD1-CE1 4.16Å; I268-F291 HydrophobicContact CD1-CE2 3.73Å; I268-F291 HydrophobicContact CD1-CZ 3.71Å; I268-F291 HydrophobicContact CG1-CD2 3.9Å; I268-F291 HydrophobicContact CG1-CE2 3.63Å; I268-F291 HydrophobicContact CG1-CZ 4.15Å; I268-V294 HydrophobicContact CD1-CG2 3.78Å; I268-V294 HydrophobicContact CG1-CG2 4.34Å
269	L	87.3	Confident	84.8	Confident	0 Å²	0	18 Å²	18	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	131.1	176.2	-54.2	-179.3	0	0	0	109.3	I230 L261 L262 Y264 T278 V281	I230-L269 HydrophobicContact CD1-CD1 3.42Å; I230-L269 VanDerWaalsContact CD1-CD1 3.42Å; I230-L269 HydrophobicContact CD1-CD2 4.42Å; L261-L269 WeakPolarHBondContact CA-O 3.46Å; L262-L269 HydrophobicContact CB-CB 4.35Å; L262-L269 PolarHBondContact N-O 2.89Å; L262-L269 PolarHBondContact O-N 3.08Å; Y264-L269 HydrophobicContact CD2-CD1 4.21Å; Y264-L269 HydrophobicContact CD2-CG 4.3Å; Y264-L269 HydrophobicContact CE2-CD1 3.69Å; Y264-L269 HydrophobicContact CE2-CG 4.22Å; L269-T278 HydrophobicContact CB-CG2 4.48Å; L269-V281 HydrophobicContact CD2-CB 4.45Å; L269-V281 HydrophobicContact CD2-CG1 4.03Å; L269-V281 HydrophobicContact CD2-CG2 3.85Å
270	I	87.8	Confident	84.4	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	116.5	173.6	-60	172.8	0	0	0	107.5	L253 M260 T278 V279 G280 L339 Y341	L253-I270 HydrophobicContact CD1-CG2 3.81Å; M260-I270 WeakPolarHBondContact O-CA 3.09Å; I270-T278 CarbonylContact O-C 3.56Å; I270-T278 WeakPolarHBondContact O-CA 3.21Å; I270-V279 PolarHBondContact O-N 2.91Å; I270-G280 PolarHBondContact N-O 3.06Å; I270-G280 PolarHBondContact O-N 3.24Å; I270-L339 HydrophobicContact CG2-CD1 4.2Å; I270-Y341 HydrophobicContact CD1-CD2 3.82Å; I270-Y341 HydrophobicContact CD1-CE2 3.11Å
271	L	86.3	Confident	84.1	Confident	1 Å²	1	20 Å²	20	1%	0.005	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	137.7	-177.2	-61	174.9	0	0	0	110.3	I232 H259 M260 L262 Q277 T278	I232-L271 HydrophobicContact CD1-CD1 3.82Å; I232-L271 HydrophobicContact CD1-CD2 4.05Å; I232-L271 HydrophobicContact CD1-CG 4.37Å; H259-L271 CarbonylContact C-O 3.53Å; H259-L271 VanDerWaalsContact CA-O 3.31Å; H259-L271 WeakPolarHBondContact CA-O 3.5Å; M260-L271 HydrophobicContact CE-CD1 3.65Å; M260-L271 PolarHBondContact N-O 3.48Å; M260-L271 PolarHBondContact O-N 3.44Å; L262-L271 HydrophobicContact CD1-CD1 3.36Å; L262-L271 HydrophobicContact CD1-CG 4.27Å; L262-L271 HydrophobicContact CG-CD1 3.87Å; L271-Q277 WeakPolarHBondContact CA-O 3.38Å; L271-T278 HydrophobicContact CD2-CG2 3.41Å; L271-T278 VanDerWaalsContact CD2-CG2 3.41Å
272	D	85.4	Confident	83.8	Confident	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	122.1	162.6	-176.9	-23.9	0	0	0	108.6	E274 N276 Q277 V279 Q987	D272-E274 WeakPolarHBondContact OD1-CB 3.29Å; D272-E274 PolarHBondContact OD1-N 3.03Å; D272-N276 WeakPolarHBondContact O-CA 3.44Å; D272-N276 PolarHBondContact O-N 3.43Å; D272-Q277 PolarHBondContact N-O 3.46Å; D272-Q277 PolarHBondContact O-N 3.44Å; D272-V279 HydrophobicContact CB-CG2 3.56Å; D272-Q987 WeakPolarHBondContact OD2-CG 3.41Å; D272-Q987 PolarHBondContact OD2-NE2 2.8Å
273	L	83.2	Confident	83.5	Confident	30 Å²	30	23.7 Å²	23.7	16%	0.157	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-16.6	-176.1	-61.1	179	0	0	0	113.5	F184 Y252 N258 M260 N276	F184-L273 HydrophobicContact CE1-CD1 4.24Å; F184-L273 HydrophobicContact CE1-CD2 3.72Å; F184-L273 HydrophobicContact CZ-CD2 3.75Å; Y252-L273 HydrophobicContact CD1-CD1 4.29Å; Y252-L273 HydrophobicContact CE1-CD1 3.53Å; N258-L273 HydrophobicContact CB-CB 4.5Å; N258-L273 WeakPolarHBondContact O-CB 3.2Å; N258-L273 WeakPolarHBondContact O-CG 3.01Å; N258-L273 PolarHBondContact O-N 3.29Å; M260-L273 HydrophobicContact CB-CD1 4.3Å; M260-L273 HydrophobicContact CB-CD2 4.07Å; M260-L273 HydrophobicContact CB-CG 4.27Å; M260-L273 HydrophobicContact CE-CD2 4.14Å; M260-L273 HydrophobicContact SD-CD2 4.39Å; L273-N276 PolarHBondContact O-OD1 3.4Å; L273-N276 VanDerWaalsContact O-OD1 3.07Å
274	E	79.7	Confident	83.1	Confident	41 Å²	41	25 Å²	25	19%	0.192	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-47.3	176.6	-66.6	-179.4	174.2	0	0	110.7	N258 D272 R983 Q987 K999 Q1003	N258-E274 HydrophobicContact CB-CG 4.05Å; N258-E274 PolarHBondContact ND2-OE1 3.19Å; D272-E274 WeakPolarHBondContact OD1-CB 3.29Å; D272-E274 PolarHBondContact OD1-N 3.03Å; E274-R983 IonicContact OE1-CZ 2.78Å; E274-R983 IonicContact OE1-NH1 3.2Å; E274-R983 PolarHBondContact OE1-NH1 3.49Å; E274-R983 IonicContact OE1-NH2 3.6Å; E274-R983 PolarHBondContact OE1-NH2 3.38Å; E274-R983 IonicContact OE2-CZ 3.9Å; E274-R983 IonicContact OE2-NE 3.49Å; E274-R983 IonicContact OE2-NH1 3.24Å; E274-R983 IonicContact OE2-NH2 3.52Å; E274-R983 PolarHBondContact OE2-NH2 3.22Å; E274-Q987 PolarHBondContact OE2-NE2 2.96Å; E274-Q987 VanDerWaalsContact OE2-NE2 3.14Å; E274-K999 PolarHBondContact O-NZ 2.99Å; E274-Q1003 PolarHBondContact OE2-NE2 3.31Å; E274-Q1003 PolarHBondContact OE2-OE1 3.49Å
275	V	74.6	Confident	82.6	Confident	4 Å²	4	31.5 Å²	31.5	2%	0.024	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-14.3	178.5	-173.9	0	0	0	0	111.7	Q277 Q987 H996	V275-Q277 HydrophobicContact CG1-CB 4.23Å; V275-Q987 HydrophobicContact CG2-CB 3.97Å; V275-Q987 VanDerWaalsContact CG2-CD 3.43Å; V275-Q987 HydrophobicContact CG2-CG 3.6Å; V275-H996 HydrophobicContact CG1-CB 4.08Å; V275-H996 WeakPolarHBondContact CG1-ND1 3.36Å; V275-H996 PolarHBondContact O-NE2 2.98Å
276	N	77	Confident	82	Confident	31 Å²	31	40.2 Å²	40.2	17%	0.166	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.4	45.4	-178.6	-73.2	-41	0	0	0	112.1	I232 D272 L273	I232-N276 HydrophobicContact CB-CB 3.85Å; I232-N276 WeakPolarHBondContact CB-O 3.46Å; I232-N276 HydrophobicContact CD1-CB 4.25Å; I232-N276 HydrophobicContact CG2-CB 3.64Å; D272-N276 WeakPolarHBondContact O-CA 3.44Å; D272-N276 PolarHBondContact O-N 3.43Å; L273-N276 PolarHBondContact O-OD1 3.4Å; L273-N276 VanDerWaalsContact O-OD1 3.07Å
277	Q	76.3	Confident	81.5	Confident	14 Å²	14	40.7 Å²	40.7	7%	0.065	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	152.9	-175.7	-170.2	171.4	-10.4	0	0	111.9	L271 D272 V275 V279 K990 H996	L271-Q277 WeakPolarHBondContact CA-O 3.38Å; D272-Q277 PolarHBondContact N-O 3.46Å; D272-Q277 PolarHBondContact O-N 3.44Å; V275-Q277 HydrophobicContact CG1-CB 4.23Å; Q277-V279 PolarHBondContact O-N 3.27Å; Q277-K990 VanDerWaalsContact CD-O 3.24Å; Q277-K990 PolarHBondContact NE2-O 2.51Å; Q277-K990 PolarHBondContact OE1-O 2.91Å; Q277-H996 PolarHBondContact OE1-CE1 2.79Å; Q277-H996 VanDerWaalsContact OE1-CE1 3.29Å; Q277-H996 PolarHBondContact OE1-ND1 3.4Å; Q277-H996 VanDerWaalsContact OE1-ND1 3.08Å
278	T	78.3	Confident	81.2	Confident	10 Å²	10	39.2 Å²	39.2	6%	0.061	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	120.1	171.9	51.9	0	0	0	0	111.4	I230 L269 I270 L271	I230-T278 HydrophobicContact CB-CG2 3.92Å; I230-T278 HydrophobicContact CD1-CG2 4.3Å; I230-T278 HydrophobicContact CG2-CG2 4.47Å; L269-T278 HydrophobicContact CB-CG2 4.48Å; I270-T278 CarbonylContact O-C 3.56Å; I270-T278 WeakPolarHBondContact O-CA 3.21Å; L271-T278 HydrophobicContact CD2-CG2 3.41Å; L271-T278 VanDerWaalsContact CD2-CG2 3.41Å
279	V	79.4	Confident	81.1	Confident	7 Å²	7	41.7 Å²	41.7	4%	0.042	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	-33.4	178.7	176.7	0	0	0	0	112.4	I270 D272 Q277 L339 L986	I270-V279 PolarHBondContact O-N 2.91Å; D272-V279 HydrophobicContact CB-CG2 3.56Å; Q277-V279 PolarHBondContact O-N 3.27Å; V279-L339 HydrophobicContact CB-CD1 4.08Å; V279-L339 HydrophobicContact CG1-CB 4.06Å; V279-L339 HydrophobicContact CG1-CD1 3.36Å; V279-L339 HydrophobicContact CG1-CG 3.72Å; V279-L339 PolarHBondContact O-N 3.36Å; V279-L986 HydrophobicContact CB-CD2 4.1Å; V279-L986 HydrophobicContact CG1-CD1 3.41Å; V279-L986 VanDerWaalsContact CG1-CD1 3.41Å; V279-L986 HydrophobicContact CG1-CD2 3.16Å; V279-L986 HydrophobicContact CG1-CG 3.62Å; V279-L986 HydrophobicContact CG2-CD2 3.75Å
280	G	79.8	Confident	81.3	Confident	3 Å²	3	42.6 Å²	42.6	3%	0.031	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	142.4	179	0	0	0	0	0	111.2	I270	I270-G280 PolarHBondContact N-O 3.06Å; I270-G280 PolarHBondContact O-N 3.24Å
281	V	82.8	Confident	81.5	Confident	45 Å²	45	42.7 Å²	42.7	27%	0.273	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	123.5	174.4	-179.4	0	0	0	0	108.8	I268 L269 A283	I268-V281 WeakPolarHBondContact O-CA 3.3Å; L269-V281 HydrophobicContact CD2-CB 4.45Å; L269-V281 HydrophobicContact CD2-CG1 4.03Å; L269-V281 HydrophobicContact CD2-CG2 3.85Å; V281-A283 HydrophobicContact CG1-CB 4.42Å
282	I	85.9	Confident	81.8	Confident	10 Å²	10	44 Å²	44	5%	0.051	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	96	171.9	-51.5	168	0	0	0	107.2	E267 I268 F291 L303 Y341	E267-I282 CarbonylContact C-O 3.54Å; E267-I282 VanDerWaalsContact CA-O 3.32Å; E267-I282 WeakPolarHBondContact CA-O 3.37Å; I268-I282 HydrophobicContact CB-CB 4.05Å; I268-I282 HydrophobicContact CB-CD1 4.39Å; I268-I282 HydrophobicContact CD1-CB 4.33Å; I268-I282 HydrophobicContact CD1-CD1 4.2Å; I268-I282 HydrophobicContact CD1-CG2 4.48Å; I268-I282 HydrophobicContact CG1-CB 4.46Å; I268-I282 PolarHBondContact N-O 3.19Å; I268-I282 PolarHBondContact O-N 3.47Å; I282-F291 HydrophobicContact CG2-CZ 4.48Å; I282-L303 HydrophobicContact CD1-CD1 3.61Å; I282-Y341 HydrophobicContact CD1-CD2 3.89Å; I282-Y341 HydrophobicContact CD1-CG 3.84Å; I282-Y341 HydrophobicContact CG1-CD2 4.41Å
283	A	83.3	Confident	82.2	Confident	66 Å²	66	45.9 Å²	45.9	55%	0.545	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	143.3	177.8	0	0	0	0	0	111.4	V281	V281-A283 HydrophobicContact CG1-CB 4.42Å
284	I	80.8	Confident	82.7	Confident	29 Å²	29	44.4 Å²	44.4	15%	0.149	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-90.1	138.6	168.7	-55	-171.4	0	0	0	108.8	R266 G288 V289 F291	R266-I284 PolarHBondContact O-N 2.83Å; I284-G288 VanDerWaalsContact CG2-CA 3.49Å; I284-V289 WeakPolarHBondContact CD1-O 3.43Å; I284-F291 HydrophobicContact CD1-CD1 3.94Å; I284-F291 HydrophobicContact CD1-CD2 3.57Å; I284-F291 HydrophobicContact CD1-CE1 3.78Å; I284-F291 HydrophobicContact CD1-CE2 3.39Å; I284-F291 HydrophobicContact CD1-CG 3.84Å; I284-F291 HydrophobicContact CD1-CZ 3.5Å; I284-F291 HydrophobicContact CG1-CD2 3.97Å; I284-F291 HydrophobicContact CG1-CE1 4.3Å; I284-F291 HydrophobicContact CG1-CE2 3.34Å; I284-F291 HydrophobicContact CG1-CZ 3.54Å
285	E	78.3	Confident	83.4	Confident	150 Å²	150	44.2 Å²	44.2	70%	0.701	24%	0.238	S	C	*	.	P	Polyproline II helix	trans	-61.6	160.4	173.3	-63.4	-170.6	165.1	0	0	112.3	T287 G288	E285-T287 PolarHBondContact O-N 3.29Å; E285-G288 PolarHBondContact O-N 3.33Å
286	R	72.6	Confident	84.2	Confident	226 Å²	226	45 Å²	45	85%	0.853	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-30.5	-171.9	-165.8	173.9	-176	166.5	1.6	114	R266	R266-R286 PolarHBondContact NH1-O 3.22Å
287	T	77.3	Confident	84.9	Confident	131 Å²	131	43.6 Å²	43.6	80%	0.804	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-8.6	179.2	49.1	0	0	0	0	113.8	E285	E285-T287 PolarHBondContact O-N 3.29Å
288	G	79.6	Confident	85.4	Confident	26 Å²	26	45.5 Å²	45.5	27%	0.268	24%	0.244	S	C	.	.	S	Bend	trans	-77.1	158.9	-179.6	0	0	0	0	0	112.8	I284 E285	I284-G288 VanDerWaalsContact CG2-CA 3.49Å; E285-G288 PolarHBondContact O-N 3.33Å
289	V	87.9	Confident	85.6	Confident	52 Å²	52	46 Å²	46	32%	0.315	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-80.1	127.1	-176.6	-177.2	0	0	0	0	110.4	I284 H307 E308 N309	I284-V289 WeakPolarHBondContact CD1-O 3.43Å; V289-H307 HydrophobicContact CB-CB 4.43Å; V289-H307 HydrophobicContact CG1-CB 4.04Å; V289-H307 PolarHBondContact O-ND1 3.2Å; V289-E308 HydrophobicContact CG1-CB 3.92Å; V289-N309 HydrophobicContact CG1-CB 3.93Å; V289-N309 HydrophobicContact CG2-CB 4.39Å
290	P	90.8	Very high	85.8	Confident	19 Å²	19	47.1 Å²	47.1	12%	0.123	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-55.6	154.7	180	-26	35.3	0	0	0	114.3	P265 H307 E308	P265-P290 HydrophobicContact CB-CB 4.27Å; P265-P290 CarbonylContact O-C 3.56Å; P265-P290 WeakPolarHBondContact O-CA 3.48Å; P265-P290 WeakPolarHBondContact O-CB 3.47Å; P290-H307 CarbonylContact O-C 3.54Å; P290-H307 VanDerWaalsContact O-CA 3.28Å; P290-H307 WeakPolarHBondContact O-CA 3.45Å; P290-E308 HydrophobicContact CB-CG 4.02Å; P290-E308 WeakPolarHBondContact CG-OE2 3.31Å; P290-E308 PolarHBondContact O-N 3.42Å
291	F	92.4	Very high	86.1	Confident	1 Å²	1	48.1 Å²	48.1	0%	0.004	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	144.5	170.4	-61.9	-62.3	0	0	0	111.5	L248 L263 P265 I268 I282 I284 C305 L306 H307	L248-F291 WeakPolarHBondContact CD1-O 3.34Å; L263-F291 HydrophobicContact CD1-CB 3.79Å; L263-F291 HydrophobicContact CD1-CD2 4.19Å; L263-F291 HydrophobicContact CD1-CG 4.18Å; P265-F291 PolarHBondContact O-N 3.41Å; I268-F291 HydrophobicContact CD1-CD2 4.21Å; I268-F291 HydrophobicContact CD1-CE1 4.16Å; I268-F291 HydrophobicContact CD1-CE2 3.73Å; I268-F291 HydrophobicContact CD1-CZ 3.71Å; I268-F291 HydrophobicContact CG1-CD2 3.9Å; I268-F291 HydrophobicContact CG1-CE2 3.63Å; I268-F291 HydrophobicContact CG1-CZ 4.15Å; I282-F291 HydrophobicContact CG2-CZ 4.48Å; I284-F291 HydrophobicContact CD1-CD1 3.94Å; I284-F291 HydrophobicContact CD1-CD2 3.57Å; I284-F291 HydrophobicContact CD1-CE1 3.78Å; I284-F291 HydrophobicContact CD1-CE2 3.39Å; I284-F291 HydrophobicContact CD1-CG 3.84Å; I284-F291 HydrophobicContact CD1-CZ 3.5Å; I284-F291 HydrophobicContact CG1-CD2 3.97Å; I284-F291 HydrophobicContact CG1-CE1 4.3Å; I284-F291 HydrophobicContact CG1-CE2 3.34Å; I284-F291 HydrophobicContact CG1-CZ 3.54Å; F291-C305 HydrophobicContact CD1-CB 3.88Å; F291-C305 HydrophobicContact CE1-CB 3.69Å; F291-L306 CarbonylContact C-O 3.47Å; F291-L306 WeakPolarHBondContact CA-O 2.96Å; F291-H307 AromaticContact CD1-CE1 3.57Å; F291-H307 AromaticContact CD1-ND1 3.86Å; F291-H307 AromaticContact CE1-CE1 3.29Å; F291-H307 WeakPolarHBondContact CE1-CE1 3.28Å; F291-H307 AromaticContact CE1-NE2 3.74Å
292	L	91.9	Very high	86.4	Confident	30 Å²	30	46 Å²	46	16%	0.157	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	-39.1	174.4	-167.4	71.5	0	0	0	112.2	L306 P358	L292-L306 HydrophobicContact CB-CD2 4.27Å; L292-L306 HydrophobicContact CB-CG 4.18Å; L292-L306 HydrophobicContact CD2-CD2 3.74Å; L292-L306 HydrophobicContact CD2-CG 4.32Å; L292-L306 HydrophobicContact CG-CD2 4.44Å; L292-L306 PolarHBondContact N-O 2.87Å; L292-P358 HydrophobicContact CD2-CB 4.31Å; L292-P358 HydrophobicContact CD2-CG 4.2Å
293	Q	93.4	Very high	86.7	Confident	38 Å²	38	45.6 Å²	45.6	18%	0.178	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	149.6	-175.7	-172.7	-177.9	-5.9	0	0	110.2	L306 S360 M361	Q293-L306 HydrophobicContact CB-CB 4.25Å; Q293-L306 HydrophobicContact CB-CD2 4.41Å; Q293-L306 PolarHBondContact O-N 3.39Å; Q293-S360 PolarHBondContact OE1-OG 3.4Å; Q293-M361 PolarHBondContact NE2-O 3.23Å; Q293-M361 PolarHBondContact OE1-O 3.49Å
294	V	94.4	Very high	87.2	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	136.3	173.5	177.7	0	0	0	0	110.6	Q249 L261 L263 I268 L303 F304 C305	Q249-V294 PolarHBondContact NE2-O 3.25Å; Q249-V294 PolarHBondContact OE1-O 3.18Å; Q249-V294 VanDerWaalsContact OE1-O 3.12Å; L261-V294 HydrophobicContact CD1-CG1 3.93Å; L261-V294 HydrophobicContact CD2-CB 4.48Å; L263-V294 HydrophobicContact CD1-CG2 3.58Å; L263-V294 HydrophobicContact CD2-CB 4.42Å; L263-V294 HydrophobicContact CD2-CG2 4.03Å; L263-V294 HydrophobicContact CG-CG2 4.39Å; I268-V294 HydrophobicContact CD1-CG2 3.78Å; I268-V294 HydrophobicContact CG1-CG2 4.34Å; V294-L303 HydrophobicContact CG1-CB 4.16Å; V294-L303 HydrophobicContact CG1-CD2 4.25Å; V294-F304 CarbonylContact C-O 3.51Å; V294-F304 VanDerWaalsContact CA-O 3.3Å; V294-F304 WeakPolarHBondContact CA-O 3.36Å; V294-C305 HydrophobicContact CG2-CB 4.21Å
295	I	93.8	Very high	87.9	Confident	37 Å²	37	41 Å²	41	19%	0.19	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	115	174.8	-61.1	178.6	0	0	0	108.5	F304 M361 C363	I295-F304 HydrophobicContact CB-CB 4.39Å; I295-F304 PolarHBondContact N-O 3.02Å; I295-F304 PolarHBondContact O-N 3.02Å; I295-M361 HydrophobicContact CB-CE 4.39Å; I295-M361 HydrophobicContact CD1-CE 4Å; I295-M361 WeakPolarHBondContact CD1-O 3.36Å; I295-M361 HydrophobicContact CG1-CE 4.05Å; I295-C363 HydrophobicContact CD1-CB 4.39Å; I295-C363 HydrophobicContact CG2-CB 4.3Å
296	P	92.9	Very high	88.7	Confident	20 Å²	20	33.9 Å²	33.9	13%	0.13	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	139.2	174.5	34.1	-34.4	0	0	0	111.2	L253 P254 L303	L253-P296 HydrophobicContact CD2-CB 3.95Å; P254-P296 HydrophobicContact CG-CB 4.41Å; P254-P296 HydrophobicContact CG-CG 4.36Å; P296-L303 HydrophobicContact CB-CD2 3.79Å
297	C	90.6	Very high	89.7	Confident	2 Å²	2	23.9 Å²	23.9	1%	0.014	14%	0.135	C	C	.	.			trans	-84.6	144.3	179	-61.7	0	0	0	0	111.8	P254 R300 G302 F304 E368 L427	P254-C297 WeakPolarHBondContact CG-O 3.41Å; C297-R300 VanDerWaalsContact CB-O 3.25Å; C297-R300 WeakPolarHBondContact CB-O 3.43Å; C297-G302 PolarHBondContact N-O 3.2Å; C297-F304 VanDerWaalsContact SG-CD2 3.53Å; C297-F304 WeakPolarHBondContact SG-CE2 3.14Å; C297-E368 WeakPolarHBondContact CA-OE1 3.42Å; C297-E368 WeakPolarHBondContact CB-OE2 3.33Å; C297-L427 HydrophobicContact CB-CD2 4.14Å
298	F	86.9	Confident	90.3	Very high	53 Å²	53	22.3 Å²	22.3	23%	0.232	12%	0.119	C	C	.	.	S	Bend	trans	-85	-44.2	174.7	173.3	-104.3	0	0	0	112.2	P254 E368 H927 C966	P254-F298 HydrophobicContact CB-CB 4.15Å; P254-F298 HydrophobicContact CB-CD2 4.02Å; P254-F298 HydrophobicContact CG-CB 4.19Å; F298-E368 WeakPolarHBondContact CB-OE1 3.45Å; F298-E368 VanDerWaalsContact N-CD 3.35Å; F298-E368 PolarHBondContact N-OE1 3.49Å; F298-E368 PolarHBondContact N-OE2 3.26Å; F298-H927 AromaticContact CE1-NE2 3.42Å; F298-H927 WeakPolarHBondContact CE1-NE2 3.41Å; F298-H927 AromaticContact CZ-CD2 3.86Å; F298-H927 AromaticContact CZ-NE2 3.33Å; F298-H927 VanDerWaalsContact CZ-NE2 3.33Å; F298-H927 WeakPolarHBondContact CZ-NE2 3.48Å; F298-C966 HydrophobicContact CD2-CB 4.04Å; F298-C966 HydrophobicContact CE2-CB 3.73Å; F298-C966 HydrophobicContact CZ-CB 3.99Å; F298-C966 VanDerWaalsContact O-CB 3.31Å; F298-C966 WeakPolarHBondContact O-CB 3.37Å
299	Q	83.3	Confident	90.9	Very high	22 Å²	22	23 Å²	23	10%	0.103	12%	0.116	C	C	.	.	S	Bend	trans	-69.7	-38.9	-173.1	-64.1	-178.9	-4.8	0	0	112.5	V366 N367 E368 L427 D428	Q299-V366 PolarHBondContact NE2-O 3.07Å; Q299-N367 PolarHBondContact OE1-O 2.79Å; Q299-E368 VanDerWaalsContact CB-OE2 3.26Å; Q299-E368 WeakPolarHBondContact CB-OE2 3.44Å; Q299-E368 HydrophobicContact CG-CG 4.37Å; Q299-E368 WeakPolarHBondContact CG-OE2 3.08Å; Q299-E368 PolarHBondContact N-OE2 2.99Å; Q299-L427 VanDerWaalsContact OE1-N 3.11Å; Q299-D428 HydrophobicContact CB-CB 4.34Å; Q299-D428 VanDerWaalsContact OE1-N 3.12Å; Q299-D428 PolarHBondContact OE1-OD1 3.36Å
300	R	83.5	Confident	91	Very high	29 Å²	29	20.5 Å²	20.5	11%	0.109	10%	0.101	C	C	.	.	S	Bend	trans	-134.3	153.2	179.6	-64.4	-64.6	-174.8	-148.9	-6.2	109.6	C297 G302 L427 D428 I431 D964	C297-R300 VanDerWaalsContact CB-O 3.25Å; C297-R300 WeakPolarHBondContact CB-O 3.43Å; R300-G302 PolarHBondContact O-N 3.46Å; R300-L427 HydrophobicContact CB-CD2 3.88Å; R300-L427 HydrophobicContact CB-CG 4.21Å; R300-L427 HydrophobicContact CG-CD2 4.23Å; R300-L427 HydrophobicContact CG-CG 4.01Å; R300-D428 PolarHBondContact NH2-O 3.37Å; R300-I431 PolarHBondContact NE-O 3.38Å; R300-I431 PolarHBondContact NH2-O 3.5Å; R300-D964 IonicContact CZ-OD1 2.62Å; R300-D964 IonicContact NH1-OD1 3.21Å; R300-D964 PolarHBondContact NH1-OD1 3.35Å; R300-D964 IonicContact NH1-OD2 3.28Å
301	D	85.2	Confident	91.1	Very high	25 Å²	25	19.6 Å²	19.6	13%	0.134	10%	0.095	C	C	.	.	S	Bend	trans	-73.9	77.9	177.5	-159.9	18.2	0	0	0	111	S255 K256 R317 Y341	S255-D301 PolarHBondContact OG-OD1 3.45Å; K256-D301 WeakPolarHBondContact CE-OD2 3.18Å; K256-D301 IonicContact NZ-OD2 3.25Å; K256-D301 PolarHBondContact NZ-OD2 2.79Å; D301-R317 HydrophobicContact CB-CB 4.05Å; D301-R317 PolarHBondContact O-N 2.66Å; D301-R317 WeakPolarHBondContact OD2-CD 3.41Å; D301-Y341 PolarHBondContact OD1-OH 3.23Å; D301-Y341 VanDerWaalsContact OD1-OH 3.13Å
302	G	88.9	Confident	91.2	Very high	1 Å²	1	19.5 Å²	19.5	1%	0.01	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	156.5	-174.8	0	0	0	0	0	112.6	C297 R300 R315	C297-G302 PolarHBondContact N-O 3.2Å; R300-G302 PolarHBondContact O-N 3.46Å; G302-R315 CarbonylContact C-O 3.6Å; G302-R315 WeakPolarHBondContact CA-O 3.06Å
303	L	93.4	Very high	91.3	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	121.3	-177.6	-56.8	175.7	0	0	0	109.2	L253 L261 I282 V294 P296 R315 Y341	L253-L303 HydrophobicContact CD2-CD2 4.14Å; L261-L303 HydrophobicContact CD1-CD1 4.24Å; L261-L303 HydrophobicContact CD1-CD2 3.85Å; I282-L303 HydrophobicContact CD1-CD1 3.61Å; V294-L303 HydrophobicContact CG1-CB 4.16Å; V294-L303 HydrophobicContact CG1-CD2 4.25Å; P296-L303 HydrophobicContact CB-CD2 3.79Å; L303-R315 PolarHBondContact N-O 3.45Å; L303-R315 PolarHBondContact O-N 3.48Å; L303-Y341 HydrophobicContact CD1-CD1 3.8Å; L303-Y341 HydrophobicContact CD1-CE1 3.82Å; L303-Y341 HydrophobicContact CD1-CG 4.17Å; L303-Y341 HydrophobicContact CG-CD1 3.94Å; L303-Y341 HydrophobicContact CG-CE1 3.76Å
304	F	94.1	Very high	91.2	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	120.2	162.9	-75.2	-87.9	0	0	0	108.9	V294 I295 C297 I312 T313 L314 M361 A371 F454	V294-F304 CarbonylContact C-O 3.51Å; V294-F304 VanDerWaalsContact CA-O 3.3Å; V294-F304 WeakPolarHBondContact CA-O 3.36Å; I295-F304 HydrophobicContact CB-CB 4.39Å; I295-F304 PolarHBondContact N-O 3.02Å; I295-F304 PolarHBondContact O-N 3.02Å; C297-F304 VanDerWaalsContact SG-CD2 3.53Å; C297-F304 WeakPolarHBondContact SG-CE2 3.14Å; F304-I312 HydrophobicContact CD1-CG2 4.05Å; F304-T313 CarbonylContact C-O 3.55Å; F304-T313 WeakPolarHBondContact CA-O 3.48Å; F304-L314 HydrophobicContact CD1-CD1 4.21Å; F304-L314 HydrophobicContact CD2-CD1 4.08Å; F304-L314 HydrophobicContact CE1-CB 4.42Å; F304-L314 HydrophobicContact CE1-CD1 4.07Å; F304-L314 HydrophobicContact CE2-CD1 3.93Å; F304-L314 HydrophobicContact CG-CD1 4.22Å; F304-L314 HydrophobicContact CZ-CD1 3.93Å; F304-M361 HydrophobicContact CB-CE 3.61Å; F304-M361 HydrophobicContact CB-SD 4.25Å; F304-M361 WeakPolarHBondContact O-CE 3.49Å; F304-A371 HydrophobicContact CD1-CB 4.48Å; F304-A371 HydrophobicContact CE1-CB 4.48Å; F304-F454 HydrophobicContact CD1-CZ 4.1Å; F304-F454 AromaticContact CE1-CE1 3.84Å; F304-F454 HydrophobicContact CE1-CE1 3.84Å; F304-F454 AromaticContact CE1-CZ 3.69Å; F304-F454 HydrophobicContact CE1-CZ 3.69Å
305	C	94.7	Very high	91.1	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	124.3	179.9	-53.8	0	0	0	0	110.6	F291 V294 I312 T313	F291-C305 HydrophobicContact CD1-CB 3.88Å; F291-C305 HydrophobicContact CE1-CB 3.69Å; V294-C305 HydrophobicContact CG2-CB 4.21Å; C305-I312 WeakPolarHBondContact O-CA 3.43Å; C305-T313 WeakPolarHBondContact CB-OG1 3.13Å; C305-T313 PolarHBondContact N-O 3.39Å; C305-T313 PolarHBondContact O-N 3.32Å
306	L	94.7	Very high	90.8	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	131.2	171.9	178.4	62.8	0	0	0	110	F291 L292 Q293 I312 M361 L373	F291-L306 CarbonylContact C-O 3.47Å; F291-L306 WeakPolarHBondContact CA-O 2.96Å; L292-L306 HydrophobicContact CB-CD2 4.27Å; L292-L306 HydrophobicContact CB-CG 4.18Å; L292-L306 HydrophobicContact CD2-CD2 3.74Å; L292-L306 HydrophobicContact CD2-CG 4.32Å; L292-L306 HydrophobicContact CG-CD2 4.44Å; L292-L306 PolarHBondContact N-O 2.87Å; Q293-L306 HydrophobicContact CB-CB 4.25Å; Q293-L306 HydrophobicContact CB-CD2 4.41Å; Q293-L306 PolarHBondContact O-N 3.39Å; L306-I312 HydrophobicContact CD1-CG1 4.04Å; L306-M361 HydrophobicContact CB-CB 4.19Å; L306-M361 HydrophobicContact CB-CE 4.22Å; L306-M361 HydrophobicContact CB-SD 4.3Å; L306-M361 HydrophobicContact CD2-CB 3.86Å; L306-M361 HydrophobicContact CG-CB 4.42Å; L306-L373 HydrophobicContact CD1-CD1 3.62Å; L306-L373 HydrophobicContact CD2-CD1 4.1Å
307	H	93.8	Very high	90.4	Very high	16 Å²	16	17.8 Å²	17.8	7%	0.074	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	158.7	176.9	-65.4	-92.4	0	0	0	112.1	V289 P290 F291 N309 G310 C311 T313	V289-H307 HydrophobicContact CB-CB 4.43Å; V289-H307 HydrophobicContact CG1-CB 4.04Å; V289-H307 PolarHBondContact O-ND1 3.2Å; P290-H307 CarbonylContact O-C 3.54Å; P290-H307 VanDerWaalsContact O-CA 3.28Å; P290-H307 WeakPolarHBondContact O-CA 3.45Å; F291-H307 AromaticContact CD1-CE1 3.57Å; F291-H307 AromaticContact CD1-ND1 3.86Å; F291-H307 AromaticContact CE1-CE1 3.29Å; F291-H307 WeakPolarHBondContact CE1-CE1 3.28Å; F291-H307 AromaticContact CE1-NE2 3.74Å; H307-N309 WeakPolarHBondContact CB-OD1 3.39Å; H307-N309 PolarHBondContact O-N 3.06Å; H307-N309 VanDerWaalsContact O-N 3.14Å; H307-G310 WeakPolarHBondContact O-CA 3.49Å; H307-G310 PolarHBondContact O-N 3.37Å; H307-C311 HydrophobicContact CB-CB 4.34Å; H307-C311 PolarHBondContact CD2-O 3.13Å; H307-C311 PolarHBondContact N-O 2.97Å; H307-T313 PolarHBondContact NE2-OG1 3.28Å; H307-T313 VanDerWaalsContact NE2-OG1 3.07Å
308	E	91	Very high	89.8	Confident	97 Å²	97	21.2 Å²	21.2	45%	0.453	9%	0.094	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-22	179.3	-73.3	-172.5	157.3	0	0	114.4	V289 P290 G310 P358	V289-E308 HydrophobicContact CG1-CB 3.92Å; P290-E308 HydrophobicContact CB-CG 4.02Å; P290-E308 WeakPolarHBondContact CG-OE2 3.31Å; P290-E308 PolarHBondContact O-N 3.42Å; E308-G310 PolarHBondContact O-N 2.96Å; E308-P358 VanDerWaalsContact O-CD 3.31Å; E308-P358 WeakPolarHBondContact O-CD 3.4Å; E308-P358 VanDerWaalsContact O-CG 3.22Å; E308-P358 WeakPolarHBondContact O-CG 3.43Å
309	N	90.9	Very high	88.6	Confident	40 Å²	40	20.1 Å²	20.1	21%	0.214	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	5.8	172.9	67.9	-11.4	0	0	0	113.3	V289 H307 C311 A349 I350	V289-N309 HydrophobicContact CG1-CB 3.93Å; V289-N309 HydrophobicContact CG2-CB 4.39Å; H307-N309 WeakPolarHBondContact CB-OD1 3.39Å; H307-N309 PolarHBondContact O-N 3.06Å; H307-N309 VanDerWaalsContact O-N 3.14Å; N309-C311 PolarHBondContact O-N 2.91Å; N309-C311 WeakPolarHBondContact OD1-CB 3.32Å; N309-C311 PolarHBondContact OD1-N 3.23Å; N309-C311 VanDerWaalsContact OD1-N 3.09Å; N309-A349 HydrophobicContact CB-CB 4.35Å; N309-I350 VanDerWaalsContact O-CG1 3.24Å; N309-I350 WeakPolarHBondContact O-CG1 3.36Å; N309-I350 PolarHBondContact O-N 2.86Å
310	G	89.6	Confident	87.4	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	10%	0.098	C	C	.	.	S	Bend	trans	71.2	14.7	-177.1	0	0	0	0	0	114.3	H307 E308 L373	H307-G310 WeakPolarHBondContact O-CA 3.49Å; H307-G310 PolarHBondContact O-N 3.37Å; E308-G310 PolarHBondContact O-N 2.96Å; G310-L373 WeakPolarHBondContact O-CD2 3.27Å
311	C	93.3	Very high	85.5	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.106	C	C	.	.			trans	-78	135.3	171.1	-175	0	0	0	0	110.5	H307 N309 Q346 C347 A349	H307-C311 HydrophobicContact CB-CB 4.34Å; H307-C311 PolarHBondContact CD2-O 3.13Å; H307-C311 PolarHBondContact N-O 2.97Å; N309-C311 PolarHBondContact O-N 2.91Å; N309-C311 WeakPolarHBondContact OD1-CB 3.32Å; N309-C311 PolarHBondContact OD1-N 3.23Å; N309-C311 VanDerWaalsContact OD1-N 3.09Å; C311-Q346 WeakPolarHBondContact SG-CG 3.5Å; C311-Q346 PolarHBondContact SG-NE2 2.95Å; C311-C347 PolarHBondContact SG-O 2.99Å; C311-A349 HydrophobicContact CB-CB 4.08Å
312	I	94.5	Very high	83.1	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	128.1	172.7	-60	172.2	0	0	0	108.1	F304 C305 L306 Q346 C347 M361 A371 L373 F454	F304-I312 HydrophobicContact CD1-CG2 4.05Å; C305-I312 WeakPolarHBondContact O-CA 3.43Å; L306-I312 HydrophobicContact CD1-CG1 4.04Å; I312-Q346 WeakPolarHBondContact O-CA 3.35Å; I312-C347 PolarHBondContact N-SG 3.11Å; I312-C347 PolarHBondContact O-N 3.22Å; I312-M361 HydrophobicContact CB-SD 4.23Å; I312-M361 HydrophobicContact CD1-CG 4.04Å; I312-M361 HydrophobicContact CD1-SD 3.68Å; I312-M361 HydrophobicContact CG1-SD 3.68Å; I312-M361 HydrophobicContact CG2-SD 3.57Å; I312-M361 VanDerWaalsContact CG2-SD 3.57Å; I312-A371 HydrophobicContact CD1-CB 4.29Å; I312-L373 HydrophobicContact CD1-CB 4.11Å; I312-F454 HydrophobicContact CG2-CZ 4.03Å
313	T	93.4	Very high	80.5	Confident	3 Å²	3	33.6 Å²	33.6	2%	0.018	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	140.8	172.9	57.9	0	0	0	0	110.8	F304 C305 H307 L343 S345 Q346	F304-T313 CarbonylContact C-O 3.55Å; F304-T313 WeakPolarHBondContact CA-O 3.48Å; C305-T313 WeakPolarHBondContact CB-OG1 3.13Å; C305-T313 PolarHBondContact N-O 3.39Å; C305-T313 PolarHBondContact O-N 3.32Å; H307-T313 PolarHBondContact NE2-OG1 3.28Å; H307-T313 VanDerWaalsContact NE2-OG1 3.07Å; T313-L343 HydrophobicContact CG2-CD1 3.79Å; T313-S345 WeakPolarHBondContact CA-O 3.4Å; T313-Q346 HydrophobicContact CG2-CB 4.08Å; T313-Q346 HydrophobicContact CG2-CG 3.74Å
314	L	92.8	Very high	77.7	Confident	0 Å²	0	41 Å²	41	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	122.2	168.9	177.8	64.4	0	0	0	108.8	F304 V316 R344 S345 L385 L452 F454	F304-L314 HydrophobicContact CD1-CD1 4.21Å; F304-L314 HydrophobicContact CD2-CD1 4.08Å; F304-L314 HydrophobicContact CE1-CB 4.42Å; F304-L314 HydrophobicContact CE1-CD1 4.07Å; F304-L314 HydrophobicContact CE2-CD1 3.93Å; F304-L314 HydrophobicContact CG-CD1 4.22Å; F304-L314 HydrophobicContact CZ-CD1 3.93Å; L314-V316 HydrophobicContact CG-CG2 4.26Å; L314-R344 PolarHBondContact O-N 2.91Å; L314-S345 WeakPolarHBondContact CB-OG 3.47Å; L314-S345 PolarHBondContact N-O 3.44Å; L314-S345 PolarHBondContact O-N 3.11Å; L314-L385 HydrophobicContact CD2-CD1 4.15Å; L314-L385 HydrophobicContact CD2-CD2 3.57Å; L314-L452 HydrophobicContact CD2-CD1 3.81Å; L314-F454 HydrophobicContact CB-CE2 4.28Å; L314-F454 HydrophobicContact CB-CZ 4.13Å
315	R	90.8	Very high	74.6	Confident	43 Å²	43	46.5 Å²	46.5	16%	0.162	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	131.3	175.4	-59.4	-179.6	172.5	-118.7	3.4	109.7	G302 L303 D342 L343	G302-R315 CarbonylContact C-O 3.6Å; G302-R315 WeakPolarHBondContact CA-O 3.06Å; L303-R315 PolarHBondContact N-O 3.45Å; L303-R315 PolarHBondContact O-N 3.48Å; R315-D342 CarbonylContact C-O 3.58Å; R315-D342 WeakPolarHBondContact CA-O 3.34Å; R315-L343 HydrophobicContact CG-CD1 4.29Å
316	V	87.6	Confident	71.6	Confident	5 Å²	5	52.9 Å²	52.9	3%	0.03	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	140.6	-179	179.7	0	0	0	0	108.9	L314 R318 D342 R344 L404 I431	L314-V316 HydrophobicContact CG-CG2 4.26Å; V316-R318 PolarHBondContact O-N 2.92Å; V316-D342 PolarHBondContact N-O 3.26Å; V316-D342 PolarHBondContact O-N 3.24Å; V316-R344 HydrophobicContact CB-CG 3.77Å; V316-R344 HydrophobicContact CG2-CB 4.48Å; V316-R344 HydrophobicContact CG2-CG 3.66Å; V316-L404 HydrophobicContact CG1-CD2 4.43Å; V316-I431 HydrophobicContact CG2-CD1 4.34Å
317	R	84.4	Confident	68.6	Low	38 Å²	38	56.5 Å²	56.5	14%	0.143	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.6	137.4	177.4	177	175.1	176.8	-150.7	6.8	110.9	K256 D301 L339 T340 Y341 E982	K256-R317 VanDerWaalsContact NZ-CD 3.25Å; K256-R317 VanDerWaalsContact NZ-CZ 3.25Å; D301-R317 HydrophobicContact CB-CB 4.05Å; D301-R317 PolarHBondContact O-N 2.66Å; D301-R317 WeakPolarHBondContact OD2-CD 3.41Å; R317-L339 HydrophobicContact CG-CD2 4.46Å; R317-T340 WeakPolarHBondContact CA-O 3.45Å; R317-Y341 HydrophobicContact CB-CD1 4.37Å; R317-Y341 HydrophobicContact CB-CE1 4.16Å; R317-E982 IonicContact CZ-OE1 2.78Å; R317-E982 IonicContact NH1-OE1 3.76Å; R317-E982 IonicContact NH2-OE1 3.36Å; R317-E982 PolarHBondContact NH2-OE1 3.32Å
318	R	78.4	Confident	65.7	Low	74 Å²	74	64.5 Å²	64.5	28%	0.279	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-74.1	128.9	171.7	-177.1	177.5	-69.2	-160.7	-4.5	110.4	V316 T340 D342 G400	V316-R318 PolarHBondContact O-N 2.92Å; R318-T340 WeakPolarHBondContact CB-OG1 3.27Å; R318-T340 PolarHBondContact N-O 2.93Å; R318-D342 IonicContact CZ-OD1 3.13Å; R318-D342 VanDerWaalsContact CZ-OD1 3.28Å; R318-D342 IonicContact CZ-OD2 3.86Å; R318-D342 IonicContact NE-OD1 2.57Å; R318-D342 PolarHBondContact NE-OD1 2.69Å; R318-D342 VanDerWaalsContact NE-OD1 3.07Å; R318-D342 IonicContact NE-OD2 2.87Å; R318-D342 PolarHBondContact NE-OD2 3.47Å; R318-D342 IonicContact NH2-OD1 3.12Å; R318-D342 PolarHBondContact NH2-OD1 2.72Å; R318-D342 IonicContact NH2-OD2 3.46Å; R318-G400 PolarHBondContact NH2-O 3.04Å
319	S	63.2	Low	63	Low	29 Å²	29	67.7 Å²	67.7	20%	0.203	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-80.4	122.6	165.7	-129.8	0	0	0	0	109	N321 S434 A435	S319-N321 PolarHBondContact O-N 3.48Å; S319-S434 WeakPolarHBondContact OG-CB 3.48Å; S319-A435 PolarHBondContact OG-O 3.29Å
320	Y	56.5	Low	60.1	Low	59 Å²	59	74.7 Å²	74.7	23%	0.231	38%	0.382	C	S	.	.			trans	-82.2	95.6	172.7	-75.5	-91.2	0	0	0	109.2	E338 T340 A437	Y320-E338 WeakPolarHBondContact CE2-O 3.23Å; Y320-E338 PolarHBondContact OH-O 3.33Å; Y320-T340 WeakPolarHBondContact OH-CG2 3.43Å; Y320-T340 PolarHBondContact OH-OG1 3.16Å; Y320-T340 VanDerWaalsContact OH-OG1 3.08Å; Y320-A437 WeakPolarHBondContact O-CA 3.43Å; Y320-A437 VanDerWaalsContact O-CB 3.25Å; Y320-A437 WeakPolarHBondContact O-CB 3.06Å
321	N	43.7	Very low	57.6	Low	51 Å²	51	80.3 Å²	80.3	27%	0.273	42%	0.418	S	S	.	.			trans	-94.6	122.3	163.6	-80.7	-10.9	0	0	0	108.4	S319 I323 H441	S319-N321 PolarHBondContact O-N 3.48Å; N321-I323 PolarHBondContact O-N 3.11Å; N321-H441 PolarHBondContact ND2-CE1 2.99Å
322	N	36	Very low	54.6	Low	140 Å²	140	87.1 Å²	87.1	75%	0.749	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	14.7	177.7	-87.3	-6	0	0	0	115.1
323	I	34.5	Very low	51.8	Low	111 Å²	111	92.6 Å²	92.6	57%	0.569	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.1	-8.3	-165.2	-62.9	172.6	0	0	0	113.7	N321	N321-I323 PolarHBondContact O-N 3.11Å
324	F	34	Very low	49.3	Very low	156 Å²	156	99 Å²	99	68%	0.684	53%	0.525	S	S	*	.			trans	-116.3	66.3	179.9	-71	-76.3	0	0	0	113.8
325	T	29.2	Very low	47	Very low	115 Å²	115	103.7 Å²	103.7	71%	0.706	56%	0.555	S	S	*	*			trans	-115.1	74.5	150.7	57	0	0	0	0	108.6
326	T	31	Very low	45.1	Very low	133 Å²	133	105.5 Å²	105.5	82%	0.816	57%	0.571	S	S	*	*			trans	-106.8	63.7	160.4	58.9	0	0	0	0	108.8
327	S	31.9	Very low	43.8	Very low	76 Å²	76	107.4 Å²	107.4	53%	0.531	58%	0.579	S	S	.	*	S	Bend	trans	-129	133.3	152.5	49	0	0	0	0	105.5	E329	S327-E329 PolarHBondContact O-N 2.95Å
328	N	32.3	Very low	42.9	Very low	185 Å²	185	107.7 Å²	107.7	99%	0.989	58%	0.582	S	S	*	*	S	Bend	trans	-66.1	46.6	-179.4	-79.3	-15.9	0	0	0	113.1
329	E	35.7	Very low	42.8	Very low	164 Å²	164	104.3 Å²	104.3	77%	0.766	57%	0.57	S	S	*	*	S	Bend	trans	-107	134.6	167	-68.9	-173.7	162.7	0	0	107	S327	S327-E329 PolarHBondContact O-N 2.95Å
330	E	30.4	Very low	43.6	Very low	187 Å²	187	104.7 Å²	104.7	87%	0.874	57%	0.571	S	S	*	*			trans	-47.8	137.9	-179.4	-65.4	-173.6	154.2	0	0	110.7	D332	E330-D332 PolarHBondContact O-N 3.33Å
331	P	35.2	Very low	45	Very low	117 Å²	117	102.5 Å²	102.5	76%	0.76	56%	0.562	S	S	*	*			trans	-61.3	112.3	175.7	24.8	-31.1	0	0	0	108.7
332	D	31.2	Very low	46.9	Very low	143 Å²	143	100.7 Å²	100.7	77%	0.765	55%	0.552	S	S	*	*			trans	-51.1	130.1	167.9	-108.6	-24.8	0	0	0	107.8	E330 D334	E330-D332 PolarHBondContact O-N 3.33Å; D332-D334 PolarHBondContact O-N 2.97Å
333	P	36.2	Very low	49.3	Very low	116 Å²	116	97.6 Å²	97.6	75%	0.753	54%	0.536	S	S	*	.	S	Bend	trans	-70.3	0.4	-164	22.9	-31	0	0	0	115.8
334	D	40.8	Very low	51.8	Low	138 Å²	138	94.5 Å²	94.5	74%	0.738	52%	0.517	S	S	*	.			trans	-160.2	108.2	168.1	-82.8	-47.1	0	0	0	110.2	D332 V336	D332-D334 PolarHBondContact O-N 2.97Å; D334-V336 PolarHBondContact O-N 3.27Å
335	P	44.9	Very low	54.4	Low	97 Å²	97	87.6 Å²	87.6	63%	0.63	49%	0.488	S	S	*	.			trans	-69	106.4	170.6	27.9	-30.8	0	0	0	108.4	Q337	P335-Q337 PolarHBondContact O-N 3.12Å
336	V	50.7	Low	57.3	Low	81 Å²	81	87.5 Å²	87.5	49%	0.491	48%	0.479	S	S	.	.			trans	-54.4	110.1	175.1	-174.8	0	0	0	0	108.6	D334 E338 V989	D334-V336 PolarHBondContact O-N 3.27Å; V336-E338 HydrophobicContact CB-CG 4.36Å; V336-E338 HydrophobicContact CG1-CG 3.65Å; V336-E338 PolarHBondContact O-N 3.22Å; V336-V989 HydrophobicContact CG1-CG1 3.69Å
337	Q	58.7	Low	60.2	Low	45 Å²	45	81.4 Å²	81.4	21%	0.21	44%	0.442	C	S	.	.			trans	-75.2	89.2	-177.1	-159.1	170.6	14.4	0	0	109	P335	P335-Q337 PolarHBondContact O-N 3.12Å
338	E	66.8	Low	62.9	Low	44 Å²	44	83.8 Å²	83.8	21%	0.206	45%	0.449	C	S	.	.			trans	-103.1	148.7	180	-59.5	-168.3	151.6	0	0	111.9	L225 Y320 V336 T340 K990	L225-E338 WeakPolarHBondContact CD2-OE1 3.18Å; L225-E338 WeakPolarHBondContact CD2-OE2 3.5Å; Y320-E338 WeakPolarHBondContact CE2-O 3.23Å; Y320-E338 PolarHBondContact OH-O 3.33Å; V336-E338 HydrophobicContact CB-CG 4.36Å; V336-E338 HydrophobicContact CG1-CG 3.65Å; V336-E338 PolarHBondContact O-N 3.22Å; E338-T340 HydrophobicContact CB-CG2 4.35Å; E338-T340 PolarHBondContact O-N 3.35Å; E338-K990 IonicContact OE1-NZ 2.91Å; E338-K990 PolarHBondContact OE1-NZ 2.75Å
339	L	75.5	Confident	65.5	Low	4 Å²	4	77.6 Å²	77.6	2%	0.021	42%	0.423	C	S	.	.			trans	-71.6	100.5	169.7	-84.3	169.2	0	0	0	109.6	I270 V279 R317 L986	I270-L339 HydrophobicContact CG2-CD1 4.2Å; V279-L339 HydrophobicContact CB-CD1 4.08Å; V279-L339 HydrophobicContact CG1-CB 4.06Å; V279-L339 HydrophobicContact CG1-CD1 3.36Å; V279-L339 HydrophobicContact CG1-CG 3.72Å; V279-L339 PolarHBondContact O-N 3.36Å; R317-L339 HydrophobicContact CG-CD2 4.46Å; L339-L986 HydrophobicContact CD1-CD1 4.3Å; L339-L986 HydrophobicContact CG-CD1 3.83Å
340	T	80.4	Confident	67.9	Low	36 Å²	36	70.9 Å²	70.9	22%	0.221	39%	0.392	C	S	.	.			trans	-106.4	137.6	177.8	50	0	0	0	0	111.3	R317 R318 Y320 E338	R317-T340 WeakPolarHBondContact CA-O 3.45Å; R318-T340 WeakPolarHBondContact CB-OG1 3.27Å; R318-T340 PolarHBondContact N-O 2.93Å; Y320-T340 WeakPolarHBondContact OH-CG2 3.43Å; Y320-T340 PolarHBondContact OH-OG1 3.16Å; Y320-T340 VanDerWaalsContact OH-OG1 3.08Å; E338-T340 HydrophobicContact CB-CG2 4.35Å; E338-T340 PolarHBondContact O-N 3.35Å
341	Y	85.1	Confident	70.5	Confident	13 Å²	13	72.4 Å²	72.4	5%	0.051	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	115.4	178.1	-74.7	-104.1	0	0	0	109.7	I270 I282 D301 L303 R317	I270-Y341 HydrophobicContact CD1-CD2 3.82Å; I270-Y341 HydrophobicContact CD1-CE2 3.11Å; I282-Y341 HydrophobicContact CD1-CD2 3.89Å; I282-Y341 HydrophobicContact CD1-CG 3.84Å; I282-Y341 HydrophobicContact CG1-CD2 4.41Å; D301-Y341 PolarHBondContact OD1-OH 3.23Å; D301-Y341 VanDerWaalsContact OD1-OH 3.13Å; L303-Y341 HydrophobicContact CD1-CD1 3.8Å; L303-Y341 HydrophobicContact CD1-CE1 3.82Å; L303-Y341 HydrophobicContact CD1-CG 4.17Å; L303-Y341 HydrophobicContact CG-CD1 3.94Å; L303-Y341 HydrophobicContact CG-CE1 3.76Å; R317-Y341 HydrophobicContact CB-CD1 4.37Å; R317-Y341 HydrophobicContact CB-CE1 4.16Å
342	D	84.3	Confident	72.7	Confident	13 Å²	13	70 Å²	70	7%	0.07	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	135.2	-178.7	-71.4	-27.1	0	0	0	110.3	R315 V316 R318 R344 V401 S402	R315-D342 CarbonylContact C-O 3.58Å; R315-D342 WeakPolarHBondContact CA-O 3.34Å; V316-D342 PolarHBondContact N-O 3.26Å; V316-D342 PolarHBondContact O-N 3.24Å; R318-D342 IonicContact CZ-OD1 3.13Å; R318-D342 VanDerWaalsContact CZ-OD1 3.28Å; R318-D342 IonicContact CZ-OD2 3.86Å; R318-D342 IonicContact NE-OD1 2.57Å; R318-D342 PolarHBondContact NE-OD1 2.69Å; R318-D342 VanDerWaalsContact NE-OD1 3.07Å; R318-D342 IonicContact NE-OD2 2.87Å; R318-D342 PolarHBondContact NE-OD2 3.47Å; R318-D342 IonicContact NH2-OD1 3.12Å; R318-D342 PolarHBondContact NH2-OD1 2.72Å; R318-D342 IonicContact NH2-OD2 3.46Å; D342-R344 PolarHBondContact O-N 2.65Å; D342-R344 IonicContact OD2-NH2 3.8Å; D342-V401 HydrophobicContact CB-CG1 3.92Å; D342-S402 PolarHBondContact OD2-OG 2.7Å
343	L	87.1	Confident	75.2	Confident	76 Å²	76	66.2 Å²	66.2	40%	0.398	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	122.9	171.4	177.1	64.2	0	0	0	109.8	T313 R315	T313-L343 HydrophobicContact CG2-CD1 3.79Å; R315-L343 HydrophobicContact CG-CD1 4.29Å
344	R	86.7	Confident	77	Confident	46 Å²	46	70.9 Å²	70.9	17%	0.174	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	-41.2	-176.2	-60.5	-52.7	-171.1	160.2	-1.7	113.8	L314 V316 D342 S402 L404 L452	L314-R344 PolarHBondContact O-N 2.91Å; V316-R344 HydrophobicContact CB-CG 3.77Å; V316-R344 HydrophobicContact CG2-CB 4.48Å; V316-R344 HydrophobicContact CG2-CG 3.66Å; D342-R344 PolarHBondContact O-N 2.65Å; D342-R344 IonicContact OD2-NH2 3.8Å; R344-S402 PolarHBondContact NH1-O 3.11Å; R344-S402 PolarHBondContact NH2-O 3.1Å; R344-S402 PolarHBondContact NH2-OG 2.55Å; R344-L404 HydrophobicContact CG-CD1 4.06Å; R344-L452 HydrophobicContact CB-CD1 4.19Å
345	S	87.6	Confident	78.7	Confident	10 Å²	10	69.2 Å²	69.2	7%	0.07	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	156.1	178.4	61.9	0	0	0	0	110.6	T313 L314 L385 L452 F454	T313-S345 WeakPolarHBondContact CA-O 3.4Å; L314-S345 WeakPolarHBondContact CB-OG 3.47Å; L314-S345 PolarHBondContact N-O 3.44Å; L314-S345 PolarHBondContact O-N 3.11Å; S345-L385 WeakPolarHBondContact OG-CD1 3.39Å; S345-L452 WeakPolarHBondContact CB-O 3.36Å; S345-F454 WeakPolarHBondContact OG-CE2 3.19Å
346	Q	91.8	Very high	80.6	Confident	113 Å²	113	65.5 Å²	65.5	53%	0.528	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	136.1	-178.7	-178.4	171.3	1.1	0	0	108.4	C311 I312 T313	C311-Q346 WeakPolarHBondContact SG-CG 3.5Å; C311-Q346 PolarHBondContact SG-NE2 2.95Å; I312-Q346 WeakPolarHBondContact O-CA 3.35Å; T313-Q346 HydrophobicContact CG2-CB 4.08Å; T313-Q346 HydrophobicContact CG2-CG 3.74Å
347	C	91.6	Very high	82.5	Confident	6 Å²	6	67.4 Å²	67.4	4%	0.041	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-89.5	168.7	172.9	83.1	0	0	0	0	111.2	C311 I312 W383 F454	C311-C347 PolarHBondContact SG-O 2.99Å; I312-C347 PolarHBondContact N-SG 3.11Å; I312-C347 PolarHBondContact O-N 3.22Å; C347-W383 HydrophobicContact CB-CD2 4Å; C347-W383 HydrophobicContact CB-CE3 3.91Å; C347-W383 HydrophobicContact CB-CH2 4.19Å; C347-W383 HydrophobicContact CB-CZ2 4.28Å; C347-W383 HydrophobicContact CB-CZ3 4Å; C347-F454 HydrophobicContact CB-CB 3.93Å; C347-F454 HydrophobicContact CB-CD2 4.01Å; C347-F454 HydrophobicContact CB-CG 4.03Å
348	D	87.6	Confident	84.1	Confident	125 Å²	125	65.7 Å²	65.7	67%	0.668	33%	0.325	S	S	*	.	P	Polyproline II helix	trans	-66.1	140.9	175.9	-66	-35.4	0	0	0	111.2	W383	D348-W383 HydrophobicContact CB-CH2 4.27Å
349	A	86.4	Confident	85.3	Confident	55 Å²	55	64 Å²	64	46%	0.455	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-79.5	146.7	176.1	0	0	0	0	0	110.8	N309 C311	N309-A349 HydrophobicContact CB-CB 4.35Å; C311-A349 HydrophobicContact CB-CB 4.08Å
350	I	87.6	Confident	86.2	Confident	23 Å²	23	64.2 Å²	64.2	12%	0.118	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-86.6	153.2	172.9	61.6	173.5	0	0	0	111.2	N309 V352 V375 M381	N309-I350 VanDerWaalsContact O-CG1 3.24Å; N309-I350 WeakPolarHBondContact O-CG1 3.36Å; N309-I350 PolarHBondContact O-N 2.86Å; I350-V352 HydrophobicContact CG1-CG2 4.29Å; I350-V352 PolarHBondContact O-N 3.43Å; I350-V375 HydrophobicContact CD1-CG1 3.93Å; I350-V375 HydrophobicContact CD1-CG2 3.91Å; I350-M381 HydrophobicContact CG2-CE 3.54Å; I350-M381 HydrophobicContact CG2-SD 4.06Å
351	R	83.9	Confident	86.8	Confident	219 Å²	219	62.5 Å²	62.5	83%	0.826	31%	0.309	S	S	*	.			trans	-73.1	100.5	171	-172	178.8	-177.1	-174.7	1.1	109.8	T353	R351-T353 HydrophobicContact CG-CG2 4.45Å
352	V	82.7	Confident	87.3	Confident	68 Å²	68	62.4 Å²	62.4	41%	0.412	31%	0.309	S	S	.	.			trans	-73.2	131.7	175.7	-178.7	0	0	0	0	110.4	I350 V356 R357	I350-V352 HydrophobicContact CG1-CG2 4.29Å; I350-V352 PolarHBondContact O-N 3.43Å; V352-V356 CarbonylContact C-O 3.47Å; V352-V356 WeakPolarHBondContact CA-O 3.36Å; V352-V356 WeakPolarHBondContact CG1-O 3.48Å; V352-R357 HydrophobicContact CG1-CB 4.34Å
353	T	82.3	Confident	87.7	Confident	63 Å²	63	62.6 Å²	62.6	39%	0.387	31%	0.312	S	S	.	.			trans	-133.6	-179.1	174.7	66.7	0	0	0	0	109.3	R351 T355 V356	R351-T353 HydrophobicContact CG-CG2 4.45Å; T353-T355 PolarHBondContact O-N 2.84Å; T353-T355 PolarHBondContact OG1-N 3.32Å; T353-T355 PolarHBondContact OG1-OG1 3.34Å; T353-V356 PolarHBondContact N-O 2.99Å; T353-V356 PolarHBondContact O-N 2.81Å; T353-V356 WeakPolarHBondContact OG1-CB 3.49Å; T353-V356 PolarHBondContact OG1-N 3.39Å; T353-V356 VanDerWaalsContact OG1-N 3.13Å
354	K	75.4	Confident	88	Confident	214 Å²	214	59.5 Å²	59.5	93%	0.93	30%	0.296	S	S	*	.	S	Bend	trans	-60.8	-29.6	176.1	-71.8	-174.7	177.9	-179.5	0	113
355	T	74.6	Confident	88	Confident	102 Å²	102	59 Å²	59	63%	0.626	30%	0.299	S	S	*	.	S	Bend	trans	-102.1	-19.2	-176.6	51.4	0	0	0	0	113.2	T353 S376	T353-T355 PolarHBondContact O-N 2.84Å; T353-T355 PolarHBondContact OG1-N 3.32Å; T353-T355 PolarHBondContact OG1-OG1 3.34Å; T355-S376 PolarHBondContact O-OG 3.1Å
356	V	86	Confident	88	Confident	19 Å²	19	58.9 Å²	58.9	12%	0.115	30%	0.297	C	S	.	.			trans	-118.6	110	-177.4	-176.5	0	0	0	0	109.4	V352 T353 V375 S376 D377 R379	V352-V356 CarbonylContact C-O 3.47Å; V352-V356 WeakPolarHBondContact CA-O 3.36Å; V352-V356 WeakPolarHBondContact CG1-O 3.48Å; T353-V356 PolarHBondContact N-O 2.99Å; T353-V356 PolarHBondContact O-N 2.81Å; T353-V356 WeakPolarHBondContact OG1-CB 3.49Å; T353-V356 PolarHBondContact OG1-N 3.39Å; T353-V356 VanDerWaalsContact OG1-N 3.13Å; V356-V375 HydrophobicContact CG1-CG1 3.58Å; V356-S376 WeakPolarHBondContact CA-OG 3.39Å; V356-D377 HydrophobicContact CG2-CB 4.18Å; V356-D377 WeakPolarHBondContact CG2-OD2 3.45Å; V356-R379 VanDerWaalsContact CG1-NH2 3.34Å
357	R	90.3	Very high	87.7	Confident	122 Å²	122	55.6 Å²	55.6	46%	0.46	28%	0.283	S	S	.	.			trans	-145.7	150	176.2	58.7	-178.9	175	169.6	5.8	110.5	V352 F359 V375 S376	V352-R357 HydrophobicContact CG1-CB 4.34Å; R357-F359 HydrophobicContact CG-CD1 4.21Å; R357-F359 HydrophobicContact CG-CE1 3.9Å; R357-V375 WeakPolarHBondContact O-CG1 3.5Å; R357-S376 PolarHBondContact N-OG 2.85Å; R357-S376 WeakPolarHBondContact O-CB 3.41Å; R357-S376 PolarHBondContact O-N 2.76Å; R357-S376 PolarHBondContact O-OG 3.36Å
358	P	92.6	Very high	87.6	Confident	8 Å²	8	56.1 Å²	56.1	5%	0.052	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	138.1	175.1	31	-36.6	0	0	0	110.4	L292 E308 L373	L292-P358 HydrophobicContact CD2-CB 4.31Å; L292-P358 HydrophobicContact CD2-CG 4.2Å; E308-P358 VanDerWaalsContact O-CD 3.31Å; E308-P358 WeakPolarHBondContact O-CD 3.4Å; E308-P358 VanDerWaalsContact O-CG 3.22Å; E308-P358 WeakPolarHBondContact O-CG 3.43Å; P358-L373 HydrophobicContact CB-CD1 4.09Å
359	F	92.3	Very high	87.7	Confident	9 Å²	9	50.6 Å²	50.6	4%	0.039	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	-58.7	177	-86.9	8.7	0	0	0	111.8	L19 N20 K24 R357 I374 S376	L19-F359 HydrophobicContact CB-CD2 4.02Å; L19-F359 HydrophobicContact CB-CE2 3.51Å; L19-F359 HydrophobicContact CB-CZ 4.46Å; L19-F359 HydrophobicContact CD1-CD2 3.89Å; L19-F359 HydrophobicContact CD1-CE2 4.26Å; N20-F359 VanDerWaalsContact O-CE2 3.26Å; N20-F359 WeakPolarHBondContact O-CE2 3.34Å; K24-F359 HydrophobicContact CB-CG 4.41Å; K24-F359 HydrophobicContact CG-CB 4.24Å; K24-F359 HydrophobicContact CG-CG 4.34Å; K24-F359 WeakPolarHBondContact CG-O 3.44Å; R357-F359 HydrophobicContact CG-CD1 4.21Å; R357-F359 HydrophobicContact CG-CE1 3.9Å; F359-I374 PolarHBondContact N-O 2.79Å; F359-S376 VanDerWaalsContact CZ-CB 3.46Å
360	S	93.1	Very high	88	Confident	9 Å²	9	48.5 Å²	48.5	6%	0.063	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	157.6	-178.5	-179	0	0	0	0	110.9	K24 V27 Q293 I374	K24-S360 VanDerWaalsContact O-CB 3.23Å; K24-S360 WeakPolarHBondContact O-CB 3.41Å; V27-S360 VanDerWaalsContact CG1-OG 3.26Å; V27-S360 WeakPolarHBondContact CG1-OG 3.5Å; Q293-S360 PolarHBondContact OE1-OG 3.4Å; S360-I374 PolarHBondContact O-N 3.41Å
361	M	94.6	Very high	88.3	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	145.1	172.8	171.4	-173.1	73.6	0	0	109	Q293 I295 F304 L306 I312 A371 A372	Q293-M361 PolarHBondContact NE2-O 3.23Å; Q293-M361 PolarHBondContact OE1-O 3.49Å; I295-M361 HydrophobicContact CB-CE 4.39Å; I295-M361 HydrophobicContact CD1-CE 4Å; I295-M361 WeakPolarHBondContact CD1-O 3.36Å; I295-M361 HydrophobicContact CG1-CE 4.05Å; F304-M361 HydrophobicContact CB-CE 3.61Å; F304-M361 HydrophobicContact CB-SD 4.25Å; F304-M361 WeakPolarHBondContact O-CE 3.49Å; L306-M361 HydrophobicContact CB-CB 4.19Å; L306-M361 HydrophobicContact CB-CE 4.22Å; L306-M361 HydrophobicContact CB-SD 4.3Å; L306-M361 HydrophobicContact CD2-CB 3.86Å; L306-M361 HydrophobicContact CG-CB 4.42Å; I312-M361 HydrophobicContact CB-SD 4.23Å; I312-M361 HydrophobicContact CD1-CG 4.04Å; I312-M361 HydrophobicContact CD1-SD 3.68Å; I312-M361 HydrophobicContact CG1-SD 3.68Å; I312-M361 HydrophobicContact CG2-SD 3.57Å; I312-M361 VanDerWaalsContact CG2-SD 3.57Å; M361-A371 HydrophobicContact CG-CB 4.34Å; M361-A371 HydrophobicContact SD-CB 4.41Å; M361-A372 VanDerWaalsContact CA-O 3.27Å; M361-A372 WeakPolarHBondContact CA-O 3.19Å
362	V	94.9	Very high	88.8	Confident	11 Å²	11	37 Å²	37	7%	0.067	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	151.1	168.8	-70.8	0	0	0	0	110.2	V27 W29 I35 A371 A372	V27-V362 HydrophobicContact CB-CG1 4.22Å; V27-V362 HydrophobicContact CG1-CG1 3.74Å; V27-V362 HydrophobicContact CG2-CB 4.3Å; V27-V362 HydrophobicContact CG2-CG1 3.56Å; V27-V362 HydrophobicContact CG2-CG2 3.72Å; W29-V362 HydrophobicContact CB-CB 4.07Å; W29-V362 HydrophobicContact CB-CG2 4.02Å; W29-V362 HydrophobicContact CE3-CG2 4.1Å; I35-V362 HydrophobicContact CG2-CG2 4.43Å; V362-A371 CarbonylContact O-C 3.53Å; V362-A371 VanDerWaalsContact O-CA 3.25Å; V362-A371 WeakPolarHBondContact O-CA 3.46Å; V362-A372 HydrophobicContact CG2-CB 4.02Å; V362-A372 PolarHBondContact N-O 2.93Å; V362-A372 PolarHBondContact O-N 2.87Å
363	C	93.4	Very high	89.4	Confident	17 Å²	17	33.8 Å²	33.8	12%	0.115	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	150.5	179.3	-63.9	0	0	0	0	110	I295 P365 A370	I295-C363 HydrophobicContact CD1-CB 4.39Å; I295-C363 HydrophobicContact CG2-CB 4.3Å; C363-P365 VanDerWaalsContact O-CD 3.31Å; C363-P365 WeakPolarHBondContact O-CD 3.46Å; C363-A370 WeakPolarHBondContact CA-O 3.39Å
364	C	91.7	Very high	90	Very high	11 Å²	11	31 Å²	31	7%	0.074	16%	0.157	C	C	.	.			trans	-63.7	116.4	173.9	178.3	0	0	0	0	109.6	W29 V366 E368 A370	W29-C364 HydrophobicContact CD2-CB 4.19Å; W29-C364 HydrophobicContact CE3-CB 4.43Å; W29-C364 HydrophobicContact CH2-CB 4.08Å; W29-C364 HydrophobicContact CZ2-CB 3.77Å; W29-C364 HydrophobicContact CZ3-CB 4.38Å; C364-V366 VanDerWaalsContact C-N 3.28Å; C364-V366 PolarHBondContact O-N 3.13Å; C364-E368 WeakPolarHBondContact O-CA 3.27Å; C364-E368 PolarHBondContact O-N 2.87Å; C364-A370 HydrophobicContact CB-CB 4.36Å; C364-A370 PolarHBondContact N-O 3.37Å
365	P	88.5	Confident	90.8	Very high	35 Å²	35	20.9 Å²	20.9	23%	0.227	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-23.3	-175.3	28.5	-35.2	0	0	0	113.2	W31 C363	W31-P365 HydrophobicContact CD2-CB 4.38Å; W31-P365 HydrophobicContact CD2-CG 4.32Å; W31-P365 HydrophobicContact CG-CG 4.11Å; W31-P365 HydrophobicContact CZ2-CB 4.26Å; C363-P365 VanDerWaalsContact O-CD 3.31Å; C363-P365 WeakPolarHBondContact O-CD 3.46Å
366	V	87	Confident	91.6	Very high	7 Å²	7	16.4 Å²	16.4	4%	0.042	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-47.3	-177.3	-171	0	0	0	0	111.5	W31 Q299 C364 R918	W31-V366 HydrophobicContact CB-CG2 4.44Å; W31-V366 HydrophobicContact CD2-CG2 4.24Å; W31-V366 HydrophobicContact CE3-CG2 3.69Å; W31-V366 HydrophobicContact CZ3-CG2 4.25Å; W31-V366 VanDerWaalsContact O-CG2 3.3Å; W31-V366 WeakPolarHBondContact O-CG2 3.13Å; Q299-V366 PolarHBondContact NE2-O 3.07Å; C364-V366 VanDerWaalsContact C-N 3.28Å; C364-V366 PolarHBondContact O-N 3.13Å; V366-R918 HydrophobicContact CG1-CB 4.2Å; V366-R918 HydrophobicContact CG1-CG 4.33Å
367	N	86.2	Confident	91.6	Very high	44 Å²	44	16.7 Å²	16.7	24%	0.235	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.3	-25.6	-168.8	-66	-9.6	0	0	0	113.3	Q299 N369 L425 S426 L427	Q299-N367 PolarHBondContact OE1-O 2.79Å; N367-N369 WeakPolarHBondContact CB-OD1 3.33Å; N367-N369 PolarHBondContact O-N 3Å; N367-L425 VanDerWaalsContact CB-O 3.28Å; N367-L425 WeakPolarHBondContact CB-O 3.22Å; N367-L425 PolarHBondContact ND2-O 3.11Å; N367-S426 CarbonylContact O-C 3.6Å; N367-S426 WeakPolarHBondContact O-CA 3.15Å; N367-S426 WeakPolarHBondContact O-CB 3.3Å; N367-L427 PolarHBondContact O-N 2.93Å
368	E	88	Confident	91.4	Very high	17 Å²	17	11 Å²	11	8%	0.079	7%	0.065	C	C	.	.	S	Bend	trans	53.1	19.7	-176.6	-54.6	-167.3	143.2	0	0	115.1	C297 F298 Q299 C364 L427	C297-E368 WeakPolarHBondContact CA-OE1 3.42Å; C297-E368 WeakPolarHBondContact CB-OE2 3.33Å; F298-E368 WeakPolarHBondContact CB-OE1 3.45Å; F298-E368 VanDerWaalsContact N-CD 3.35Å; F298-E368 PolarHBondContact N-OE1 3.49Å; F298-E368 PolarHBondContact N-OE2 3.26Å; Q299-E368 VanDerWaalsContact CB-OE2 3.26Å; Q299-E368 WeakPolarHBondContact CB-OE2 3.44Å; Q299-E368 HydrophobicContact CG-CG 4.37Å; Q299-E368 WeakPolarHBondContact CG-OE2 3.08Å; Q299-E368 PolarHBondContact N-OE2 2.99Å; C364-E368 WeakPolarHBondContact O-CA 3.27Å; C364-E368 PolarHBondContact O-N 2.87Å; E368-L427 HydrophobicContact CB-CB 4.04Å; E368-L427 HydrophobicContact CB-CD2 4.28Å
369	N	90.1	Very high	91.3	Very high	10 Å²	10	14.2 Å²	14.2	5%	0.053	8%	0.077	C	C	.	.	S	Bend	trans	-105	-5.7	178.2	69.6	-15.2	0	0	0	112.9	N367 L385 D424 L425 M430	N367-N369 WeakPolarHBondContact CB-OD1 3.33Å; N367-N369 PolarHBondContact O-N 3Å; N369-L385 WeakPolarHBondContact O-CA 3.22Å; N369-L385 WeakPolarHBondContact O-CB 3.38Å; N369-L385 PolarHBondContact O-N 3.43Å; N369-D424 PolarHBondContact ND2-O 3.39Å; N369-D424 VanDerWaalsContact ND2-O 3.07Å; N369-L425 PolarHBondContact ND2-O 2.85Å; N369-M430 HydrophobicContact CB-SD 4.06Å
370	A	91.9	Very high	91.3	Very high	11 Å²	11	13.9 Å²	13.9	9%	0.091	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	145.6	-178.9	0	0	0	0	0	111.7	W29 C363 C364 W383	W29-A370 HydrophobicContact CH2-CB 3.72Å; W29-A370 HydrophobicContact CZ3-CB 4.32Å; C363-A370 WeakPolarHBondContact CA-O 3.39Å; C364-A370 HydrophobicContact CB-CB 4.36Å; C364-A370 PolarHBondContact N-O 3.37Å; A370-W383 CarbonylContact C-O 3.59Å; A370-W383 VanDerWaalsContact CA-O 3.22Å; A370-W383 WeakPolarHBondContact CA-O 3.4Å
371	A	94.6	Very high	91.3	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	135	177.5	0	0	0	0	0	110.7	F304 I312 M361 V362 W383	F304-A371 HydrophobicContact CD1-CB 4.48Å; F304-A371 HydrophobicContact CE1-CB 4.48Å; I312-A371 HydrophobicContact CD1-CB 4.29Å; M361-A371 HydrophobicContact CG-CB 4.34Å; M361-A371 HydrophobicContact SD-CB 4.41Å; V362-A371 CarbonylContact O-C 3.53Å; V362-A371 VanDerWaalsContact O-CA 3.25Å; V362-A371 WeakPolarHBondContact O-CA 3.46Å; A371-W383 PolarHBondContact N-O 3.07Å; A371-W383 PolarHBondContact O-N 3.37Å
372	A	95.2	Very high	91.3	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	132.7	175.9	0	0	0	0	0	110.2	W29 I35 M361 V362 M381 I382	W29-A372 HydrophobicContact CE3-CB 4.14Å; W29-A372 HydrophobicContact CZ3-CB 3.86Å; I35-A372 HydrophobicContact CD1-CB 3.62Å; M361-A372 VanDerWaalsContact CA-O 3.27Å; M361-A372 WeakPolarHBondContact CA-O 3.19Å; V362-A372 HydrophobicContact CG2-CB 4.02Å; V362-A372 PolarHBondContact N-O 2.93Å; V362-A372 PolarHBondContact O-N 2.87Å; A372-M381 CarbonylContact C-O 3.58Å; A372-M381 VanDerWaalsContact CA-O 3.3Å; A372-M381 WeakPolarHBondContact CA-O 3.42Å; A372-I382 HydrophobicContact CB-CG1 4.32Å
373	L	95.1	Very high	91.3	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	125.5	177.8	177.6	57.9	0	0	0	110	L306 G310 I312 P358 V375 V380 M381	L306-L373 HydrophobicContact CD1-CD1 3.62Å; L306-L373 HydrophobicContact CD2-CD1 4.1Å; G310-L373 WeakPolarHBondContact O-CD2 3.27Å; I312-L373 HydrophobicContact CD1-CB 4.11Å; P358-L373 HydrophobicContact CB-CD1 4.09Å; L373-V375 HydrophobicContact CG-CG2 4.35Å; L373-V380 WeakPolarHBondContact O-CA 3.44Å; L373-M381 HydrophobicContact CB-CB 4.44Å; L373-M381 HydrophobicContact CB-CE 4.3Å; L373-M381 HydrophobicContact CD2-CE 3.5Å; L373-M381 VanDerWaalsContact CD2-CE 3.5Å; L373-M381 HydrophobicContact CG-CE 3.92Å; L373-M381 PolarHBondContact N-O 3.41Å; L373-M381 PolarHBondContact O-N 3.45Å
374	I	94.3	Very high	91.2	Very high	6 Å²	6	16 Å²	16	3%	0.031	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	130.7	175.9	-64.7	155.2	0	0	0	109.6	L19 V27 Y37 F359 S360 V380	L19-I374 HydrophobicContact CD1-CG2 3.31Å; V27-I374 HydrophobicContact CB-CD1 3.45Å; V27-I374 VanDerWaalsContact CB-CD1 3.45Å; V27-I374 HydrophobicContact CG1-CD1 4.03Å; V27-I374 HydrophobicContact CG2-CD1 3.12Å; Y37-I374 HydrophobicContact CG-CD1 4.34Å; F359-I374 PolarHBondContact N-O 2.79Å; S360-I374 PolarHBondContact O-N 3.41Å; I374-V380 HydrophobicContact CG1-CG1 4.21Å; I374-V380 HydrophobicContact CG1-CG2 4.24Å
375	V	93.1	Very high	91.2	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	149.2	-178	-171.6	0	0	0	0	110	L19 I350 V356 R357 L373 D377 G378 R379 M381	L19-V375 WeakPolarHBondContact CD1-O 3.39Å; I350-V375 HydrophobicContact CD1-CG1 3.93Å; I350-V375 HydrophobicContact CD1-CG2 3.91Å; V356-V375 HydrophobicContact CG1-CG1 3.58Å; R357-V375 WeakPolarHBondContact O-CG1 3.5Å; L373-V375 HydrophobicContact CG-CG2 4.35Å; V375-D377 WeakPolarHBondContact CB-OD1 3.5Å; V375-D377 VanDerWaalsContact CG1-OD1 3.27Å; V375-D377 WeakPolarHBondContact CG1-OD1 3.25Å; V375-D377 PolarHBondContact O-N 3.01Å; V375-D377 VanDerWaalsContact O-N 3.1Å; V375-G378 PolarHBondContact O-N 3.3Å; V375-R379 HydrophobicContact CB-CB 4.3Å; V375-R379 PolarHBondContact N-O 3.45Å; V375-M381 HydrophobicContact CG2-CE 3.52Å
376	S	90.6	Very high	91.1	Very high	8 Å²	8	17.4 Å²	17.4	6%	0.056	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-19.6	-177.3	63.6	0	0	0	0	115.3	A18 L19 T355 V356 R357 F359 G378	A18-S376 WeakPolarHBondContact CA-O 3.27Å; L19-S376 PolarHBondContact N-O 2.94Å; T355-S376 PolarHBondContact O-OG 3.1Å; V356-S376 WeakPolarHBondContact CA-OG 3.39Å; R357-S376 PolarHBondContact N-OG 2.85Å; R357-S376 WeakPolarHBondContact O-CB 3.41Å; R357-S376 PolarHBondContact O-N 2.76Å; R357-S376 PolarHBondContact O-OG 3.36Å; F359-S376 VanDerWaalsContact CZ-CB 3.46Å; S376-G378 PolarHBondContact O-N 2.93Å
377	D	86	Confident	91.1	Very high	26 Å²	26	17.5 Å²	17.5	14%	0.139	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	8.5	175.2	61.3	2.9	0	0	0	113.1	V356 V375 R379	V356-D377 HydrophobicContact CG2-CB 4.18Å; V356-D377 WeakPolarHBondContact CG2-OD2 3.45Å; V375-D377 WeakPolarHBondContact CB-OD1 3.5Å; V375-D377 VanDerWaalsContact CG1-OD1 3.27Å; V375-D377 WeakPolarHBondContact CG1-OD1 3.25Å; V375-D377 PolarHBondContact O-N 3.01Å; V375-D377 VanDerWaalsContact O-N 3.1Å; D377-R379 VanDerWaalsContact C-N 3.33Å; D377-R379 WeakPolarHBondContact OD1-CB 3.3Å; D377-R379 PolarHBondContact OD1-N 3.19Å; D377-R379 IonicContact OD1-NE 2.61Å; D377-R379 PolarHBondContact OD1-NE 3.19Å; D377-R379 IonicContact OD2-CZ 2.78Å; D377-R379 IonicContact OD2-NE 3.06Å; D377-R379 PolarHBondContact OD2-NE 3.26Å; D377-R379 IonicContact OD2-NH2 3.56Å; D377-R379 PolarHBondContact OD2-NH2 3.46Å
378	G	86.4	Confident	90.8	Very high	1 Å²	1	18 Å²	18	1%	0.01	9%	0.088	C	C	.	.	S	Bend	trans	85	2.9	178.9	0	0	0	0	0	113.7	G17 V375 S376 G462	G17-G378 WeakPolarHBondContact O-CA 3.5Å; V375-G378 PolarHBondContact O-N 3.3Å; S376-G378 PolarHBondContact O-N 2.93Å; G378-G462 PolarHBondContact O-N 2.94Å
379	R	89.8	Confident	90.1	Very high	77 Å²	77	19.8 Å²	19.8	29%	0.291	10%	0.1	S	C	.	.			trans	-71.9	137.2	173.1	-71.7	-176	-69.8	174.1	-6.2	111.6	V356 V375 D377 L460	V356-R379 VanDerWaalsContact CG1-NH2 3.34Å; V375-R379 HydrophobicContact CB-CB 4.3Å; V375-R379 PolarHBondContact N-O 3.45Å; D377-R379 VanDerWaalsContact C-N 3.33Å; D377-R379 WeakPolarHBondContact OD1-CB 3.3Å; D377-R379 PolarHBondContact OD1-N 3.19Å; D377-R379 IonicContact OD1-NE 2.61Å; D377-R379 PolarHBondContact OD1-NE 3.19Å; D377-R379 IonicContact OD2-CZ 2.78Å; D377-R379 IonicContact OD2-NE 3.06Å; D377-R379 PolarHBondContact OD2-NE 3.26Å; D377-R379 IonicContact OD2-NH2 3.56Å; D377-R379 PolarHBondContact OD2-NH2 3.46Å; R379-L460 VanDerWaalsContact CA-O 3.25Å; R379-L460 WeakPolarHBondContact CA-O 3.48Å
380	V	93	Very high	88.8	Confident	1 Å²	1	21.3 Å²	21.3	1%	0.006	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	119.5	169.8	-170.2	0	0	0	0	108.7	Y37 I46 L373 I374 L459 L460	Y37-V380 HydrophobicContact CD1-CG2 4.36Å; Y37-V380 HydrophobicContact CE1-CG2 3.86Å; I46-V380 HydrophobicContact CD1-CB 4.2Å; I46-V380 HydrophobicContact CD1-CG1 3.68Å; I46-V380 HydrophobicContact CD1-CG2 4.36Å; L373-V380 WeakPolarHBondContact O-CA 3.44Å; I374-V380 HydrophobicContact CG1-CG1 4.21Å; I374-V380 HydrophobicContact CG1-CG2 4.24Å; V380-L459 WeakPolarHBondContact O-CA 3.38Å; V380-L460 HydrophobicContact CB-CB 4.17Å; V380-L460 HydrophobicContact CG2-CD2 4.43Å; V380-L460 PolarHBondContact N-O 3.38Å; V380-L460 PolarHBondContact O-N 3.32Å
381	M	93.1	Very high	87.1	Confident	12 Å²	12	27.1 Å²	27.1	6%	0.059	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	125.2	178.9	-68.4	176.7	-75.2	0	0	109.8	I350 A372 L373 V375 W383 L456 L459	I350-M381 HydrophobicContact CG2-CE 3.54Å; I350-M381 HydrophobicContact CG2-SD 4.06Å; A372-M381 CarbonylContact C-O 3.58Å; A372-M381 VanDerWaalsContact CA-O 3.3Å; A372-M381 WeakPolarHBondContact CA-O 3.42Å; L373-M381 HydrophobicContact CB-CB 4.44Å; L373-M381 HydrophobicContact CB-CE 4.3Å; L373-M381 HydrophobicContact CD2-CE 3.5Å; L373-M381 VanDerWaalsContact CD2-CE 3.5Å; L373-M381 HydrophobicContact CG-CE 3.92Å; L373-M381 PolarHBondContact N-O 3.41Å; L373-M381 PolarHBondContact O-N 3.45Å; V375-M381 HydrophobicContact CG2-CE 3.52Å; M381-W383 HydrophobicContact SD-CZ2 4.32Å; M381-L456 HydrophobicContact CB-CD1 3.75Å; M381-L456 HydrophobicContact CG-CD1 4.13Å; M381-L459 HydrophobicContact CG-CD1 3.71Å
382	I	94.7	Very high	85.1	Confident	3 Å²	3	38.2 Å²	38.2	2%	0.015	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	118.9	179.4	-52	-179.5	0	0	0	108.3	W29 I35 S48 A51 A372 T457 G458	W29-I382 HydrophobicContact CH2-CG2 4.3Å; I35-I382 HydrophobicContact CD1-CD1 4.19Å; S48-I382 WeakPolarHBondContact O-CD1 3.49Å; A51-I382 HydrophobicContact CB-CD1 4.12Å; A372-I382 HydrophobicContact CB-CG1 4.32Å; I382-T457 PolarHBondContact O-N 2.76Å; I382-T457 PolarHBondContact O-OG1 3.15Å; I382-G458 PolarHBondContact N-O 2.68Å; I382-G458 PolarHBondContact O-N 3.36Å
383	W	93.8	Very high	82.6	Confident	16 Å²	16	45.8 Å²	45.8	6%	0.061	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	124.6	-179.2	-61.1	92.1	0	0	0	109.8	C347 D348 A370 A371 M381 F454 L455 L456	C347-W383 HydrophobicContact CB-CD2 4Å; C347-W383 HydrophobicContact CB-CE3 3.91Å; C347-W383 HydrophobicContact CB-CH2 4.19Å; C347-W383 HydrophobicContact CB-CZ2 4.28Å; C347-W383 HydrophobicContact CB-CZ3 4Å; D348-W383 HydrophobicContact CB-CH2 4.27Å; A370-W383 CarbonylContact C-O 3.59Å; A370-W383 VanDerWaalsContact CA-O 3.22Å; A370-W383 WeakPolarHBondContact CA-O 3.4Å; A371-W383 PolarHBondContact N-O 3.07Å; A371-W383 PolarHBondContact O-N 3.37Å; M381-W383 HydrophobicContact SD-CZ2 4.32Å; W383-F454 HydrophobicContact CB-CD1 4.02Å; W383-F454 HydrophobicContact CE3-CB 4.08Å; W383-L455 CarbonylContact C-O 3.55Å; W383-L455 WeakPolarHBondContact CA-O 3.45Å; W383-L456 HydrophobicContact CD2-CB 4.47Å; W383-L456 HydrophobicContact CD2-CD1 4.11Å; W383-L456 HydrophobicContact CE3-CB 3.93Å; W383-L456 HydrophobicContact CE3-CD1 4.4Å; W383-L456 HydrophobicContact CH2-CB 4.1Å; W383-L456 HydrophobicContact CH2-CD1 4.37Å; W383-L456 HydrophobicContact CZ2-CD1 4.05Å; W383-L456 HydrophobicContact CZ3-CB 3.74Å
384	E	92	Very high	80.2	Confident	51 Å²	51	52.5 Å²	52.5	24%	0.238	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	135.2	173.4	-168.5	-173.6	-167.7	0	0	109.7	K386 F454 L455 T457	E384-K386 VanDerWaalsContact CD-CE 3.45Å; E384-K386 WeakPolarHBondContact OE2-CE 3.49Å; E384-K386 IonicContact OE2-NZ 3.83Å; E384-K386 PolarHBondContact OE2-NZ 2.62Å; E384-F454 CarbonylContact O-C 3.59Å; E384-F454 WeakPolarHBondContact O-CA 3.42Å; E384-L455 PolarHBondContact N-O 2.65Å; E384-L455 PolarHBondContact O-N 2.65Å; E384-T457 HydrophobicContact CB-CG2 3.6Å; E384-T457 WeakPolarHBondContact OE2-CG2 2.94Å
385	L	91.3	Very high	77.8	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	126.1	174.3	-164.3	75.9	0	0	0	108.6	L314 S345 N369 L427 M430 L452 K453 F454	L314-L385 HydrophobicContact CD2-CD1 4.15Å; L314-L385 HydrophobicContact CD2-CD2 3.57Å; S345-L385 WeakPolarHBondContact OG-CD1 3.39Å; N369-L385 WeakPolarHBondContact O-CA 3.22Å; N369-L385 WeakPolarHBondContact O-CB 3.38Å; N369-L385 PolarHBondContact O-N 3.43Å; L385-L427 HydrophobicContact CD2-CD1 3.96Å; L385-M430 HydrophobicContact CB-CE 4.09Å; L385-M430 HydrophobicContact CD2-CE 3.9Å; L385-M430 HydrophobicContact CD2-SD 4.2Å; L385-M430 HydrophobicContact CG-CE 3.79Å; L385-M430 WeakPolarHBondContact O-CE 3.37Å; L385-L452 HydrophobicContact CD1-CB 3.98Å; L385-L452 HydrophobicContact CD2-CB 4.39Å; L385-L452 HydrophobicContact CD2-CD1 4.21Å; L385-L452 HydrophobicContact CD2-CD2 4.09Å; L385-L452 HydrophobicContact CD2-CG 4.45Å; L385-L452 HydrophobicContact CG-CB 4.24Å; L385-L452 HydrophobicContact CG-CD2 4.41Å; L385-K453 CarbonylContact C-O 3.54Å; L385-K453 WeakPolarHBondContact CA-O 3.44Å; L385-F454 HydrophobicContact CD1-CD1 3.99Å; L385-F454 HydrophobicContact CD1-CD2 4.39Å; L385-F454 HydrophobicContact CD1-CE1 3.86Å; L385-F454 HydrophobicContact CD1-CE2 4.28Å; L385-F454 HydrophobicContact CD1-CG 4.27Å; L385-F454 HydrophobicContact CD1-CZ 4.02Å
386	K	87.9	Confident	75.1	Confident	76 Å²	76	69.8 Å²	69.8	33%	0.33	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	148.2	172.7	-64.5	-155.5	-176.2	-171.2	0	112.4	E384 L452 K453 L455	E384-K386 VanDerWaalsContact CD-CE 3.45Å; E384-K386 WeakPolarHBondContact OE2-CE 3.49Å; E384-K386 IonicContact OE2-NZ 3.83Å; E384-K386 PolarHBondContact OE2-NZ 2.62Å; K386-L452 WeakPolarHBondContact O-CA 3.46Å; K386-K453 PolarHBondContact N-O 2.79Å; K386-K453 PolarHBondContact O-N 2.75Å; K386-L455 HydrophobicContact CB-CD1 4.12Å; K386-L455 HydrophobicContact CD-CD1 3.53Å; K386-L455 HydrophobicContact CG-CD1 3.73Å
387	S	85.2	Confident	72.6	Confident	8 Å²	8	74.1 Å²	74.1	6%	0.056	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	126.5	-177.2	92.6	0	0	0	0	109.4	K421 D424 M430	S387-K421 PolarHBondContact O-NZ 3.37Å; S387-K421 WeakPolarHBondContact OG-CE 3.3Å; S387-K421 PolarHBondContact OG-NZ 2.63Å; S387-D424 WeakPolarHBondContact CB-OD1 3.48Å; S387-D424 PolarHBondContact N-OD2 3Å; S387-D424 VanDerWaalsContact OG-CG 3.23Å; S387-D424 PolarHBondContact OG-OD1 3.01Å; S387-D424 PolarHBondContact OG-OD2 3.13Å; S387-M430 VanDerWaalsContact N-CE 3.32Å
388	T	80.9	Confident	70.4	Confident	55 Å²	55	79 Å²	79	34%	0.337	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	127	177.9	53.1	0	0	0	0	109.3	H451	T388-H451 PolarHBondContact N-O 3.04Å; T388-H451 PolarHBondContact O-N 3.46Å; T388-H451 PolarHBondContact OG1-O 3.49Å
389	V	72.3	Confident	68.5	Low	54 Å²	54	83 Å²	83	33%	0.327	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	127.3	177.9	175.1	0	0	0	0	108.7	N391 R448	V389-N391 PolarHBondContact O-N 3.43Å; V389-R448 HydrophobicContact CG1-CB 3.97Å; V389-R448 HydrophobicContact CG1-CG 4.33Å
390	C	64	Low	66.9	Low	43 Å²	43	82.8 Å²	82.8	29%	0.291	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-76.6	122.2	176	-88.3	0	0	0	0	111.6	E449 H451	C390-E449 PolarHBondContact N-O 3.29Å; C390-H451 PolarHBondContact SG-CE1 3.09Å; C390-H451 PolarHBondContact SG-ND1 3.42Å
391	N	56.1	Low	65.5	Low	132 Å²	132	85.3 Å²	85.3	71%	0.706	46%	0.462	S	S	*	.	P	Polyproline II helix	trans	-73.7	138.5	163.9	-85.4	-16.3	0	0	0	109.2	V389 N393 M394	V389-N391 PolarHBondContact O-N 3.43Å; N391-N393 PolarHBondContact O-N 2.75Å; N391-M394 PolarHBondContact O-N 3.23Å; N391-M394 VanDerWaalsContact O-N 3.13Å
392	R	53.4	Low	64.3	Low	233 Å²	233	85.8 Å²	85.8	88%	0.879	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.5	-14.7	-176.6	-82.7	-178.7	170.6	179.5	-3	115.7
393	N	42.8	Very low	63.2	Low	159 Å²	159	88 Å²	88	85%	0.85	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-1.2	-177.2	-67.2	-4.9	0	0	0	115.2	N391	N391-N393 PolarHBondContact O-N 2.75Å
394	M	44.7	Very low	62.4	Low	142 Å²	142	87.9 Å²	87.9	70%	0.7	48%	0.482	S	S	*	.			trans	-101.9	34.2	176.5	-75.3	-106.2	78.2	0	0	113.1	N391 N396	N391-M394 PolarHBondContact O-N 3.23Å; N391-M394 VanDerWaalsContact O-N 3.13Å; M394-N396 PolarHBondContact O-N 3.23Å
395	R	43.7	Very low	61.6	Low	231 Å²	231	88.9 Å²	88.9	87%	0.872	48%	0.484	S	S	*	.			trans	-75.4	72.5	167.6	-75.2	-174.7	175	-177.2	-2	110.1
396	N	35.4	Very low	60.7	Low	138 Å²	138	90.3 Å²	90.3	74%	0.738	50%	0.495	S	S	*	.			trans	-116.5	129.4	164.2	-99	-4.4	0	0	0	110.1	M394	M394-N396 PolarHBondContact O-N 3.23Å
397	S	38.3	Very low	59.9	Low	98 Å²	98	88 Å²	88	69%	0.685	49%	0.487	S	S	*	.			trans	81.6	98.6	160.4	66	0	0	0	0	120.2	S399	S397-S399 PolarHBondContact O-N 3.13Å; S397-S399 VanDerWaalsContact O-N 3.09Å
398	S	39	Very low	58.7	Low	130 Å²	130	90.6 Å²	90.6	91%	0.909	50%	0.502	S	S	*	.				44.6	49.5	114.8	69.9	0	0	0	0	119.9
399	S	48.1	Very low	57.8	Low	85 Å²	85	89.3 Å²	89.3	59%	0.594	50%	0.496	S	S	*	.			trans	-129.2	126.2	161.3	71.4	0	0	0	0	110	S397 V401	S397-S399 PolarHBondContact O-N 3.13Å; S397-S399 VanDerWaalsContact O-N 3.09Å; S399-V401 PolarHBondContact O-N 3.07Å
400	G	55.2	Low	57.4	Low	72 Å²	72	87 Å²	87	74%	0.742	48%	0.482	S	S	*	.			trans	-73	46.4	176.4	0	0	0	0	0	112.5	R318	R318-G400 PolarHBondContact NH2-O 3.04Å
401	V	64.4	Low	57	Low	53 Å²	53	85.9 Å²	85.9	32%	0.321	47%	0.474	S	S	.	.			trans	-105.3	134.4	-174.2	177.8	0	0	0	0	108.8	D342 S399	D342-V401 HydrophobicContact CB-CG1 3.92Å; S399-V401 PolarHBondContact O-N 3.07Å
402	S	67.8	Low	56.8	Low	23 Å²	23	80.6 Å²	80.6	16%	0.161	45%	0.451	C	S	.	.	P	Polyproline II helix	trans	-66.4	137.1	-179.1	52.4	0	0	0	0	111.7	D342 R344	D342-S402 PolarHBondContact OD2-OG 2.7Å; R344-S402 PolarHBondContact NH1-O 3.11Å; R344-S402 PolarHBondContact NH2-O 3.1Å; R344-S402 PolarHBondContact NH2-OG 2.55Å
403	P	70.8	Confident	57	Low	50 Å²	50	70.8 Å²	70.8	33%	0.325	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-67.2	145.2	-180	27.1	-34	0	0	0	112	Y405 E449	P403-Y405 HydrophobicContact CB-CE1 4.49Å; P403-Y405 HydrophobicContact CB-CE2 4.3Å; P403-Y405 HydrophobicContact CG-CE2 3.98Å; P403-Y405 VanDerWaalsContact CG-OH 3.31Å; P403-Y405 WeakPolarHBondContact CG-OH 2.84Å; P403-E449 HydrophobicContact CB-CG 4.28Å
404	L	77.1	Confident	57.7	Low	12 Å²	12	66.6 Å²	66.6	6%	0.063	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-99.7	140.6	169.8	-64.2	178.5	0	0	0	109.7	V316 R344 I431 E449 V450 L452	V316-L404 HydrophobicContact CG1-CD2 4.43Å; R344-L404 HydrophobicContact CG-CD1 4.06Å; L404-I431 HydrophobicContact CB-CG2 4.43Å; L404-I431 HydrophobicContact CD1-CD1 4.25Å; L404-I431 HydrophobicContact CD1-CG2 4.47Å; L404-I431 HydrophobicContact CD2-CG2 3.97Å; L404-E449 CarbonylContact O-C 3.58Å; L404-E449 VanDerWaalsContact O-CA 3.29Å; L404-E449 WeakPolarHBondContact O-CA 3.47Å; L404-V450 PolarHBondContact O-N 3.36Å; L404-L452 HydrophobicContact CD1-CD1 3.94Å; L404-L452 HydrophobicContact CD1-CG 4.45Å
405	Y	76.3	Confident	58.3	Low	72 Å²	72	61.9 Å²	61.9	28%	0.282	38%	0.376	S	S	.	.	B	Isolated β-bridge	trans	-115.3	148.6	179.9	-61.6	-71.6	0	0	0	111.4	P403 G432 L447	P403-Y405 HydrophobicContact CB-CE1 4.49Å; P403-Y405 HydrophobicContact CB-CE2 4.3Å; P403-Y405 HydrophobicContact CG-CE2 3.98Å; P403-Y405 VanDerWaalsContact CG-OH 3.31Å; P403-Y405 WeakPolarHBondContact CG-OH 2.84Å; Y405-G432 PolarHBondContact O-N 3.22Å; Y405-L447 HydrophobicContact CD1-CB 3.67Å; Y405-L447 HydrophobicContact CE1-CB 4.17Å; Y405-L447 HydrophobicContact CG-CB 4.14Å
406	S	72.1	Confident	58.7	Low	31 Å²	31	52.6 Å²	52.6	22%	0.217	35%	0.352	C	S	.	.			trans	-62.7	147.2	168.5	44.6	0	0	0	0	111	R448	S406-R448 PolarHBondContact N-O 2.97Å; S406-R448 PolarHBondContact OG-O 3.37Å; S406-R448 VanDerWaalsContact OG-O 3.05Å
407	P	70.4	Confident	59.2	Low	26 Å²	26	53.6 Å²	53.6	17%	0.169	36%	0.363	C	S	.	.			trans	-66.1	144.6	176	27.7	-33.7	0	0	0	111.2	N429	P407-N429 VanDerWaalsContact CD-O 3.25Å; P407-N429 WeakPolarHBondContact CD-O 3.37Å; P407-N429 WeakPolarHBondContact CG-O 3.45Å
408	V	60.7	Low	59.1	Low	63 Å²	63	56.9 Å²	56.9	38%	0.382	37%	0.372	S	S	.	.	S	Bend	trans	-87.7	-17.9	-178.5	-170.2	0	0	0	0	111.7	V415 L447	V408-V415 PolarHBondContact O-N 2.83Å; V408-L447 HydrophobicContact CG2-CD2 3.53Å
409	S	62	Low	59.7	Low	29 Å²	29	53.2 Å²	53.2	20%	0.203	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	148.2	-174.9	54	0	0	0	0	111.4	I413 N961	S409-I413 CarbonylContact C-O 3.6Å; S409-I413 WeakPolarHBondContact CA-O 3.31Å; S409-I413 VanDerWaalsContact CB-O 3.31Å; S409-I413 WeakPolarHBondContact CB-O 3.4Å; S409-N961 PolarHBondContact OG-ND2 2.98Å
410	F	63.5	Low	59.7	Low	6 Å²	6	56.7 Å²	56.7	3%	0.026	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	123.6	168.6	177.2	-110.7	0	0	0	109.2	G412 I413 V415 L422 N429 F907 Q911	F410-G412 VanDerWaalsContact C-N 3.27Å; F410-G412 PolarHBondContact O-N 2.83Å; F410-I413 PolarHBondContact N-O 3.46Å; F410-I413 WeakPolarHBondContact O-CB 3.42Å; F410-I413 PolarHBondContact O-N 3.06Å; F410-I413 VanDerWaalsContact O-N 3.08Å; F410-V415 HydrophobicContact CB-CG2 4.48Å; F410-L422 HydrophobicContact CB-CD1 3.44Å; F410-L422 VanDerWaalsContact CB-CD1 3.44Å; F410-L422 HydrophobicContact CB-CD2 4.06Å; F410-L422 HydrophobicContact CB-CG 4.4Å; F410-L422 HydrophobicContact CD1-CD2 4.07Å; F410-L422 HydrophobicContact CD2-CD1 4.32Å; F410-L422 HydrophobicContact CD2-CD2 4.45Å; F410-L422 HydrophobicContact CG-CD1 4.02Å; F410-L422 HydrophobicContact CG-CD2 3.95Å; F410-N429 WeakPolarHBondContact CD2-OD1 3.43Å; F410-N429 VanDerWaalsContact CE2-ND2 3.35Å; F410-N429 WeakPolarHBondContact CE2-ND2 3.38Å; F410-N429 WeakPolarHBondContact CE2-OD1 3.38Å; F410-F907 HydrophobicContact CE1-CE2 4.44Å; F410-Q911 HydrophobicContact CD1-CG 3.97Å; F410-Q911 HydrophobicContact CE1-CB 4.19Å; F410-Q911 HydrophobicContact CE1-CG 3.99Å
411	C	54.7	Low	59.6	Low	18 Å²	18	58.2 Å²	58.2	12%	0.122	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.2	35.6	-173.2	-43.9	0	0	0	0	113.3	I413 Q911 L914 A933	C411-I413 PolarHBondContact O-N 3.34Å; C411-I413 VanDerWaalsContact O-N 3.13Å; C411-Q911 HydrophobicContact CB-CG 4.37Å; C411-L914 HydrophobicContact CB-CD2 4.41Å; C411-L914 WeakPolarHBondContact SG-CD2 3.33Å; C411-A933 HydrophobicContact CB-CB 3.96Å
412	G	52.1	Low	59.5	Low	22 Å²	22	57 Å²	57	23%	0.227	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.5	-6.1	-174.5	0	0	0	0	0	115	F410 H937	F410-G412 VanDerWaalsContact C-N 3.27Å; F410-G412 PolarHBondContact O-N 2.83Å; G412-H937 PolarHBondContact O-CE1 2.96Å; G412-H937 PolarHBondContact O-ND1 3.12Å; G412-H937 VanDerWaalsContact O-ND1 3.08Å
413	I	58.1	Low	59.4	Low	27 Å²	27	56.7 Å²	56.7	14%	0.138	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	125.6	177.6	-57.5	169.3	0	0	0	108.9	S409 F410 C411 V415 T908 Q911	S409-I413 CarbonylContact C-O 3.6Å; S409-I413 WeakPolarHBondContact CA-O 3.31Å; S409-I413 VanDerWaalsContact CB-O 3.31Å; S409-I413 WeakPolarHBondContact CB-O 3.4Å; F410-I413 PolarHBondContact N-O 3.46Å; F410-I413 WeakPolarHBondContact O-CB 3.42Å; F410-I413 PolarHBondContact O-N 3.06Å; F410-I413 VanDerWaalsContact O-N 3.08Å; C411-I413 PolarHBondContact O-N 3.34Å; C411-I413 VanDerWaalsContact O-N 3.13Å; I413-V415 PolarHBondContact O-N 3.48Å; I413-T908 HydrophobicContact CD1-CG2 4.21Å; I413-Q911 HydrophobicContact CD1-CG 4.04Å
414	P	57.7	Low	59.4	Low	71 Å²	71	55.4 Å²	55.4	46%	0.461	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	130.3	175.1	-19.7	30	0	0	0	110.3	G416	P414-G416 PolarHBondContact O-N 3.15Å
415	V	57.9	Low	59.4	Low	43 Å²	43	56 Å²	56	26%	0.261	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-67.5	120	174.6	-173.1	0	0	0	0	107.7	V408 F410 I413 Q419 L422	V408-V415 PolarHBondContact O-N 2.83Å; F410-V415 HydrophobicContact CB-CG2 4.48Å; I413-V415 PolarHBondContact O-N 3.48Å; V415-Q419 HydrophobicContact CG1-CB 3.82Å; V415-L422 HydrophobicContact CG1-CG 4.48Å; V415-L422 HydrophobicContact CG2-CD1 3.43Å; V415-L422 VanDerWaalsContact CG2-CD1 3.43Å; V415-L422 HydrophobicContact CG2-CG 4.18Å
416	G	52.1	Low	59.7	Low	36 Å²	36	52.5 Å²	52.5	37%	0.371	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-58.6	148	-179.7	0	0	0	0	0	111.4	P414 L418 Q419	P414-G416 PolarHBondContact O-N 3.15Å; G416-L418 PolarHBondContact O-N 3.07Å; G416-Q419 PolarHBondContact O-N 3.5Å
417	V	44.2	Very low	60.2	Low	158 Å²	158	51 Å²	51	96%	0.958	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-21.8	-178.9	-174.9	0	0	0	0	112.7
418	L	37.8	Very low	60.5	Low	167 Å²	167	51 Å²	51	87%	0.874	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.1	-10	179.7	-68.6	166.2	0	0	0	114.3	G416 N420	G416-L418 PolarHBondContact O-N 3.07Å; L418-N420 PolarHBondContact O-N 2.89Å; L418-N420 VanDerWaalsContact O-N 3.13Å
419	Q	50.6	Low	61.2	Low	53 Å²	53	48.6 Å²	48.6	25%	0.248	28%	0.28	C	S	.	.	S	Bend	trans	-74.4	107.1	172.9	-89.6	178.1	-10.3	0	0	108	V415 G416 K421	V415-Q419 HydrophobicContact CG1-CB 3.82Å; G416-Q419 PolarHBondContact O-N 3.5Å; Q419-K421 PolarHBondContact O-N 2.9Å
420	N	48	Very low	62	Low	158 Å²	158	47.3 Å²	47.3	85%	0.845	27%	0.271	S	S	*	.			trans	-46.6	138.2	170.3	-77.3	-40.2	0	0	0	109.5	L418 L422	L418-N420 PolarHBondContact O-N 2.89Å; L418-N420 VanDerWaalsContact O-N 3.13Å; N420-L422 PolarHBondContact O-N 3.26Å
421	K	54	Low	62.7	Low	105 Å²	105	47.2 Å²	47.2	46%	0.457	27%	0.271	S	S	.	.			trans	-23.3	119.9	179.2	-169.5	-165.3	179.1	-153.5	0	111.7	S387 Q419 D424	S387-K421 PolarHBondContact O-NZ 3.37Å; S387-K421 WeakPolarHBondContact OG-CE 3.3Å; S387-K421 PolarHBondContact OG-NZ 2.63Å; Q419-K421 PolarHBondContact O-N 2.9Å; K421-D424 IonicContact NZ-OD1 2.79Å; K421-D424 PolarHBondContact NZ-OD1 3.38Å; K421-D424 IonicContact NZ-OD2 2.9Å; K421-D424 PolarHBondContact NZ-OD2 2.95Å
422	L	60.6	Low	63.4	Low	27 Å²	27	46.9 Å²	46.9	14%	0.141	27%	0.271	C	S	.	.			trans	-50.8	135.9	171.4	-72.8	157.7	0	0	0	109.1	F410 V415 N420	F410-L422 HydrophobicContact CB-CD1 3.44Å; F410-L422 VanDerWaalsContact CB-CD1 3.44Å; F410-L422 HydrophobicContact CB-CD2 4.06Å; F410-L422 HydrophobicContact CB-CG 4.4Å; F410-L422 HydrophobicContact CD1-CD2 4.07Å; F410-L422 HydrophobicContact CD2-CD1 4.32Å; F410-L422 HydrophobicContact CD2-CD2 4.45Å; F410-L422 HydrophobicContact CG-CD1 4.02Å; F410-L422 HydrophobicContact CG-CD2 3.95Å; V415-L422 HydrophobicContact CG1-CG 4.48Å; V415-L422 HydrophobicContact CG2-CD1 3.43Å; V415-L422 VanDerWaalsContact CG2-CD1 3.43Å; V415-L422 HydrophobicContact CG2-CG 4.18Å; N420-L422 PolarHBondContact O-N 3.26Å
423	P	67.6	Low	64.1	Low	17 Å²	17	48.7 Å²	48.7	11%	0.11	27%	0.273	C	S	.	.			trans	-59.7	149.9	176.3	20.4	-26.9	0	0	0	110.6	L425 E897 L901	P423-L425 HydrophobicContact CB-CD2 4.13Å; P423-L425 HydrophobicContact CB-CG 4.05Å; P423-L425 HydrophobicContact CG-CD1 3.99Å; P423-L425 HydrophobicContact CG-CD2 4.12Å; P423-L425 HydrophobicContact CG-CG 3.85Å; P423-L425 PolarHBondContact O-N 2.99Å; P423-E897 HydrophobicContact CB-CB 4.05Å; P423-E897 WeakPolarHBondContact CB-OE2 3.03Å; P423-E897 HydrophobicContact CG-CB 4.44Å; P423-L901 HydrophobicContact CG-CD1 3.47Å; P423-L901 VanDerWaalsContact CG-CD1 3.47Å; P423-L901 HydrophobicContact CG-CG 4.21Å
424	D	71	Confident	64.1	Low	23 Å²	23	50 Å²	50	12%	0.123	29%	0.285	C	S	.	.			trans	-73.7	58	-178.2	-67.4	-25.5	0	0	0	110.6	N369 S387 K421 S426 M430	N369-D424 PolarHBondContact ND2-O 3.39Å; N369-D424 VanDerWaalsContact ND2-O 3.07Å; S387-D424 WeakPolarHBondContact CB-OD1 3.48Å; S387-D424 PolarHBondContact N-OD2 3Å; S387-D424 VanDerWaalsContact OG-CG 3.23Å; S387-D424 PolarHBondContact OG-OD1 3.01Å; S387-D424 PolarHBondContact OG-OD2 3.13Å; K421-D424 IonicContact NZ-OD1 2.79Å; K421-D424 PolarHBondContact NZ-OD1 3.38Å; K421-D424 IonicContact NZ-OD2 2.9Å; K421-D424 PolarHBondContact NZ-OD2 2.95Å; D424-S426 VanDerWaalsContact C-N 3.33Å; D424-S426 PolarHBondContact O-N 3.34Å; D424-M430 HydrophobicContact CB-CE 4.39Å; D424-M430 HydrophobicContact CB-CG 3.97Å; D424-M430 HydrophobicContact CB-SD 4.33Å
425	L	76.4	Confident	63.7	Low	23 Å²	23	47.4 Å²	47.4	12%	0.12	27%	0.269	C	S	.	.			trans	-72.7	-26.4	-172.8	-62.2	174.7	0	0	0	113.1	N367 N369 P423 I898 L901 L915	N367-L425 VanDerWaalsContact CB-O 3.28Å; N367-L425 WeakPolarHBondContact CB-O 3.22Å; N367-L425 PolarHBondContact ND2-O 3.11Å; N369-L425 PolarHBondContact ND2-O 2.85Å; P423-L425 HydrophobicContact CB-CD2 4.13Å; P423-L425 HydrophobicContact CB-CG 4.05Å; P423-L425 HydrophobicContact CG-CD1 3.99Å; P423-L425 HydrophobicContact CG-CD2 4.12Å; P423-L425 HydrophobicContact CG-CG 3.85Å; P423-L425 PolarHBondContact O-N 2.99Å; L425-I898 HydrophobicContact CD2-CD1 4.34Å; L425-I898 HydrophobicContact CD2-CG1 4.01Å; L425-L901 HydrophobicContact CD1-CD1 4.08Å; L425-L915 HydrophobicContact CD1-CD1 4.09Å
426	S	82.9	Confident	63.4	Low	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.259	C	S	.	.	S	Bend	trans	-163.7	162.7	-171.4	49.1	0	0	0	0	111.7	N367 D424 D428 N429 M430 R918	N367-S426 CarbonylContact O-C 3.6Å; N367-S426 WeakPolarHBondContact O-CA 3.15Å; N367-S426 WeakPolarHBondContact O-CB 3.3Å; D424-S426 VanDerWaalsContact C-N 3.33Å; D424-S426 PolarHBondContact O-N 3.34Å; S426-D428 VanDerWaalsContact C-N 3.33Å; S426-D428 WeakPolarHBondContact CB-OD1 3.34Å; S426-D428 PolarHBondContact O-N 3.38Å; S426-D428 PolarHBondContact OG-OD1 3.04Å; S426-N429 WeakPolarHBondContact O-CB 3.42Å; S426-N429 PolarHBondContact O-N 3.33Å; S426-N429 VanDerWaalsContact O-N 3.07Å; S426-N429 VanDerWaalsContact OG-CG 3.29Å; S426-N429 PolarHBondContact OG-OD1 3.09Å; S426-M430 VanDerWaalsContact O-CG 3.27Å; S426-M430 WeakPolarHBondContact O-CG 3.29Å; S426-M430 PolarHBondContact O-N 3.13Å; S426-M430 VanDerWaalsContact O-N 3.14Å; S426-R918 PolarHBondContact OG-NH1 2.81Å
427	L	82.7	Confident	62.9	Low	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-63.6	-36.9	-174.8	-170.6	64	0	0	0	112.7	C297 Q299 R300 N367 E368 L385 N429 M430 I431	C297-L427 HydrophobicContact CB-CD2 4.14Å; Q299-L427 VanDerWaalsContact OE1-N 3.11Å; R300-L427 HydrophobicContact CB-CD2 3.88Å; R300-L427 HydrophobicContact CB-CG 4.21Å; R300-L427 HydrophobicContact CG-CD2 4.23Å; R300-L427 HydrophobicContact CG-CG 4.01Å; N367-L427 PolarHBondContact O-N 2.93Å; E368-L427 HydrophobicContact CB-CB 4.04Å; E368-L427 HydrophobicContact CB-CD2 4.28Å; L385-L427 HydrophobicContact CD2-CD1 3.96Å; L427-N429 VanDerWaalsContact C-N 3.3Å; L427-N429 PolarHBondContact O-N 3.08Å; L427-M430 PolarHBondContact O-N 3.43Å; L427-I431 HydrophobicContact CD1-CD1 3.67Å; L427-I431 HydrophobicContact CD1-CG1 4.31Å; L427-I431 HydrophobicContact CG-CD1 4.34Å; L427-I431 PolarHBondContact O-N 3.14Å
428	D	75.1	Confident	62.6	Low	26 Å²	26	41.3 Å²	41.3	14%	0.139	24%	0.242	C	C	.	.	H	α-helix	trans	-62.4	-31.6	172.2	65.7	-24.4	0	0	0	113.6	Q299 R300 S426 I431 R918	Q299-D428 HydrophobicContact CB-CB 4.34Å; Q299-D428 VanDerWaalsContact OE1-N 3.12Å; Q299-D428 PolarHBondContact OE1-OD1 3.36Å; R300-D428 PolarHBondContact NH2-O 3.37Å; S426-D428 VanDerWaalsContact C-N 3.33Å; S426-D428 WeakPolarHBondContact CB-OD1 3.34Å; S426-D428 PolarHBondContact O-N 3.38Å; S426-D428 PolarHBondContact OG-OD1 3.04Å; D428-I431 VanDerWaalsContact O-O 3.04Å; D428-R918 IonicContact OD1-NH1 2.78Å; D428-R918 IonicContact OD1-NH2 2.96Å; D428-R918 IonicContact OD2-CZ 3.48Å; D428-R918 IonicContact OD2-NH2 3.89Å; D428-R918 PolarHBondContact OD2-NH2 2.99Å
429	N	76.4	Confident	62.9	Low	12 Å²	12	37.3 Å²	37.3	6%	0.064	22%	0.219	C	C	.	.	H	α-helix	trans	-78	-22.8	175.2	-73.4	15.2	0	0	0	112.8	P407 F410 S426 L427	P407-N429 VanDerWaalsContact CD-O 3.25Å; P407-N429 WeakPolarHBondContact CD-O 3.37Å; P407-N429 WeakPolarHBondContact CG-O 3.45Å; F410-N429 WeakPolarHBondContact CD2-OD1 3.43Å; F410-N429 VanDerWaalsContact CE2-ND2 3.35Å; F410-N429 WeakPolarHBondContact CE2-ND2 3.38Å; F410-N429 WeakPolarHBondContact CE2-OD1 3.38Å; S426-N429 WeakPolarHBondContact O-CB 3.42Å; S426-N429 PolarHBondContact O-N 3.33Å; S426-N429 VanDerWaalsContact O-N 3.07Å; S426-N429 VanDerWaalsContact OG-CG 3.29Å; S426-N429 PolarHBondContact OG-OD1 3.09Å; L427-N429 VanDerWaalsContact C-N 3.3Å; L427-N429 PolarHBondContact O-N 3.08Å
430	M	77.8	Confident	62.2	Low	1 Å²	1	42 Å²	42	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-90.6	-37.3	-178.4	-64.5	170.3	81.1	0	0	112.3	N369 L385 S387 D424 S426 L427 L452	N369-M430 HydrophobicContact CB-SD 4.06Å; L385-M430 HydrophobicContact CB-CE 4.09Å; L385-M430 HydrophobicContact CD2-CE 3.9Å; L385-M430 HydrophobicContact CD2-SD 4.2Å; L385-M430 HydrophobicContact CG-CE 3.79Å; L385-M430 WeakPolarHBondContact O-CE 3.37Å; S387-M430 VanDerWaalsContact N-CE 3.32Å; D424-M430 HydrophobicContact CB-CE 4.39Å; D424-M430 HydrophobicContact CB-CG 3.97Å; D424-M430 HydrophobicContact CB-SD 4.33Å; S426-M430 VanDerWaalsContact O-CG 3.27Å; S426-M430 WeakPolarHBondContact O-CG 3.29Å; S426-M430 PolarHBondContact O-N 3.13Å; S426-M430 VanDerWaalsContact O-N 3.14Å; L427-M430 PolarHBondContact O-N 3.43Å; M430-L452 HydrophobicContact CB-CD2 4.36Å; M430-L452 HydrophobicContact CE-CD2 3.74Å
431	I	79.1	Confident	62	Low	4 Å²	4	37.5 Å²	37.5	2%	0.021	21%	0.214	C	C	.	.	S	Bend	trans	-123.8	126.5	-175.4	-46.9	173.3	0	0	0	108.5	R300 V316 L404 L427 D428 L452	R300-I431 PolarHBondContact NE-O 3.38Å; R300-I431 PolarHBondContact NH2-O 3.5Å; V316-I431 HydrophobicContact CG2-CD1 4.34Å; L404-I431 HydrophobicContact CB-CG2 4.43Å; L404-I431 HydrophobicContact CD1-CD1 4.25Å; L404-I431 HydrophobicContact CD1-CG2 4.47Å; L404-I431 HydrophobicContact CD2-CG2 3.97Å; L427-I431 HydrophobicContact CD1-CD1 3.67Å; L427-I431 HydrophobicContact CD1-CG1 4.31Å; L427-I431 HydrophobicContact CG-CD1 4.34Å; L427-I431 PolarHBondContact O-N 3.14Å; D428-I431 VanDerWaalsContact O-O 3.04Å; I431-L452 HydrophobicContact CD1-CD1 3.6Å; I431-L452 HydrophobicContact CD1-CD2 4.48Å; I431-L452 HydrophobicContact CG1-CD1 4.19Å; I431-L452 HydrophobicContact CG1-CD2 4.24Å
432	G	70.1	Confident	61.4	Low	12 Å²	12	36 Å²	36	12%	0.124	22%	0.215	C	C	.	.			trans	-68.7	169.4	171.5	0	0	0	0	0	113	Y405 S434	Y405-G432 PolarHBondContact O-N 3.22Å; G432-S434 PolarHBondContact O-N 3.45Å
433	Q	66.9	Low	60.3	Low	60 Å²	60	46.1 Å²	46.1	28%	0.28	25%	0.252	S	S	.	.			trans	-59.4	136	174.3	-76.1	172.3	-2	0	0	110.8	A435 P962 D964	Q433-A435 PolarHBondContact O-N 3.36Å; Q433-P962 PolarHBondContact NE2-O 2.88Å; Q433-P962 PolarHBondContact OE1-O 3.13Å; Q433-D964 WeakPolarHBondContact CG-OD1 3.32Å; Q433-D964 PolarHBondContact NE2-OD1 3.46Å
434	S	56.9	Low	58.9	Low	54 Å²	54	48.9 Å²	48.9	38%	0.378	28%	0.283	S	S	.	.			trans	-73.1	115.7	169.1	-70.1	0	0	0	0	108	S319 G432	S319-S434 WeakPolarHBondContact OG-CB 3.48Å; G432-S434 PolarHBondContact O-N 3.45Å
435	A	49.9	Very low	57.7	Low	17 Å²	17	50.1 Å²	50.1	14%	0.14	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-60	136.6	-179.7	0	0	0	0	0	111	S319 Q433 H441	S319-A435 PolarHBondContact OG-O 3.29Å; Q433-A435 PolarHBondContact O-N 3.36Å; A435-H441 WeakPolarHBondContact CB-CE1 3.46Å
436	I	52	Low	56.6	Low	9 Å²	9	56.4 Å²	56.4	5%	0.046	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-63	140.6	172.8	-61.9	176	0	0	0	108.5	G438 E439 Y975 K978 F979 E982	I436-G438 PolarHBondContact O-N 3.18Å; I436-E439 PolarHBondContact O-N 3.49Å; I436-Y975 HydrophobicContact CD1-CD2 3.77Å; I436-Y975 HydrophobicContact CD1-CE2 3.24Å; I436-Y975 HydrophobicContact CG1-CE2 3.98Å; I436-K978 HydrophobicContact CB-CD 4.47Å; I436-K978 HydrophobicContact CD1-CD 4.27Å; I436-K978 HydrophobicContact CD1-CG 4.36Å; I436-K978 HydrophobicContact CG2-CD 4.14Å; I436-K978 HydrophobicContact CG2-CG 4.11Å; I436-F979 HydrophobicContact CD1-CB 4.27Å; I436-E982 WeakPolarHBondContact CG2-OE2 3.05Å
437	A	39.9	Very low	55.4	Low	34 Å²	34	58.8 Å²	58.8	28%	0.281	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.6	123.5	179.3	0	0	0	0	0	111.5	Y320	Y320-A437 WeakPolarHBondContact O-CA 3.43Å; Y320-A437 VanDerWaalsContact O-CB 3.25Å; Y320-A437 WeakPolarHBondContact O-CB 3.06Å
438	G	39.3	Very low	54.7	Low	66 Å²	66	65.6 Å²	65.6	68%	0.68	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	103.7	0.9	177.3	0	0	0	0	0	116.5	I436	I436-G438 PolarHBondContact O-N 3.18Å
439	E	43.4	Very low	54.7	Low	83 Å²	83	68 Å²	68	39%	0.388	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-84.5	116.6	169.4	-109.8	160.9	-131.7	0	0	111.8	I436 H441 K978	I436-E439 PolarHBondContact O-N 3.49Å; E439-H441 PolarHBondContact O-N 3.03Å; E439-H441 VanDerWaalsContact O-N 3.16Å; E439-H441 PolarHBondContact O-ND1 3.28Å; E439-K978 IonicContact OE1-NZ 3.53Å; E439-K978 PolarHBondContact OE1-NZ 3.46Å
440	E	37.2	Very low	54.8	Low	150 Å²	150	67.7 Å²	67.7	70%	0.701	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-61.3	116.2	164.8	-71.8	-158.7	155.4	0	0	108.2
441	H	43.8	Very low	55.1	Low	65 Å²	65	71.7 Å²	71.7	30%	0.301	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-61.4	136.2	173.4	-72.7	38	0	0	0	108.6	N321 A435 E439 R443	N321-H441 PolarHBondContact ND2-CE1 2.99Å; A435-H441 WeakPolarHBondContact CB-CE1 3.46Å; E439-H441 PolarHBondContact O-N 3.03Å; E439-H441 VanDerWaalsContact O-N 3.16Å; E439-H441 PolarHBondContact O-ND1 3.28Å; H441-R443 PolarHBondContact O-N 2.81Å
442	P	41.1	Very low	55.5	Low	73 Å²	73	72 Å²	72	47%	0.474	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-57	118.7	-175.7	20.1	-30.8	0	0	0	109.8	G444	P442-G444 PolarHBondContact O-N 3.49Å
443	R	36.1	Very low	56.5	Low	240 Å²	240	77.4 Å²	77.4	91%	0.906	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	74.5	169.2	-66.3	-176	-174.4	-176.5	4.3	108.6	H441	H441-R443 PolarHBondContact O-N 2.81Å
444	G	39.6	Very low	57.7	Low	74 Å²	74	75.5 Å²	75.5	76%	0.763	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-179.7	-32.1	-178.3	0	0	0	0	0	116.9	P442	P442-G444 PolarHBondContact O-N 3.49Å
445	S	44.9	Very low	59.4	Low	49 Å²	49	76.8 Å²	76.8	34%	0.343	41%	0.405	S	S	.	.	S	Bend	trans	-90.2	127.4	175.9	60.1	0	0	0	0	110.6	L447	S445-L447 PolarHBondContact O-N 3.06Å
446	I	52.7	Low	61.4	Low	155 Å²	155	79.9 Å²	79.9	80%	0.795	42%	0.419	S	S	*	.			trans	-68.8	78.1	175.3	-56	167.4	0	0	0	108.5	R448	I446-R448 PolarHBondContact O-N 3.27Å; I446-R448 VanDerWaalsContact O-N 3.14Å
447	L	59.3	Low	63.2	Low	50 Å²	50	82.8 Å²	82.8	26%	0.262	44%	0.437	S	S	.	.			trans	-65.1	112.8	173.9	-71.5	170.6	0	0	0	108.2	Y405 V408 S445	Y405-L447 HydrophobicContact CD1-CB 3.67Å; Y405-L447 HydrophobicContact CE1-CB 4.17Å; Y405-L447 HydrophobicContact CG-CB 4.14Å; V408-L447 HydrophobicContact CG2-CD2 3.53Å; S445-L447 PolarHBondContact O-N 3.06Å
448	R	67.8	Low	65.4	Low	143 Å²	143	81.4 Å²	81.4	54%	0.54	43%	0.427	S	S	.	.			trans	-85.9	123.3	177.4	-67.3	176.7	-179.7	-175.5	3	108.7	V389 S406 I446	V389-R448 HydrophobicContact CG1-CB 3.97Å; V389-R448 HydrophobicContact CG1-CG 4.33Å; S406-R448 PolarHBondContact N-O 2.97Å; S406-R448 PolarHBondContact OG-O 3.37Å; S406-R448 VanDerWaalsContact OG-O 3.05Å; I446-R448 PolarHBondContact O-N 3.27Å; I446-R448 VanDerWaalsContact O-N 3.14Å
449	E	74.9	Confident	67.8	Low	78 Å²	78	82.6 Å²	82.6	36%	0.364	42%	0.417	S	S	.	.	B	Isolated β-bridge	trans	-67.6	135.2	174.3	-172.2	179.1	179.9	0	0	110.4	C390 P403 L404 H451	C390-E449 PolarHBondContact N-O 3.29Å; P403-E449 HydrophobicContact CB-CG 4.28Å; L404-E449 CarbonylContact O-C 3.58Å; L404-E449 VanDerWaalsContact O-CA 3.29Å; L404-E449 WeakPolarHBondContact O-CA 3.47Å; E449-H451 IonicContact OE1-CE1 3.85Å; E449-H451 PolarHBondContact OE1-CE1 3.09Å
450	V	78.4	Confident	69.9	Low	4 Å²	4	79.5 Å²	79.5	2%	0.024	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	133.9	-173.6	174.3	0	0	0	0	110.3	L404 L452	L404-V450 PolarHBondContact O-N 3.36Å; V450-L452 HydrophobicContact CG1-CD2 4.23Å
451	H	83.8	Confident	72.2	Confident	86 Å²	86	74.2 Å²	74.2	40%	0.398	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	137.5	170.4	-74.9	58.1	0	0	0	110.4	T388 C390 E449	T388-H451 PolarHBondContact N-O 3.04Å; T388-H451 PolarHBondContact O-N 3.46Å; T388-H451 PolarHBondContact OG1-O 3.49Å; C390-H451 PolarHBondContact SG-CE1 3.09Å; C390-H451 PolarHBondContact SG-ND1 3.42Å; E449-H451 IonicContact OE1-CE1 3.85Å; E449-H451 PolarHBondContact OE1-CE1 3.09Å
452	L	88.2	Confident	74	Confident	11 Å²	11	71.8 Å²	71.8	6%	0.058	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	138.7	-176.5	-55.6	169.3	0	0	0	109.9	L314 R344 S345 L385 K386 L404 M430 I431 V450	L314-L452 HydrophobicContact CD2-CD1 3.81Å; R344-L452 HydrophobicContact CB-CD1 4.19Å; S345-L452 WeakPolarHBondContact CB-O 3.36Å; L385-L452 HydrophobicContact CD1-CB 3.98Å; L385-L452 HydrophobicContact CD2-CB 4.39Å; L385-L452 HydrophobicContact CD2-CD1 4.21Å; L385-L452 HydrophobicContact CD2-CD2 4.09Å; L385-L452 HydrophobicContact CD2-CG 4.45Å; L385-L452 HydrophobicContact CG-CB 4.24Å; L385-L452 HydrophobicContact CG-CD2 4.41Å; K386-L452 WeakPolarHBondContact O-CA 3.46Å; L404-L452 HydrophobicContact CD1-CD1 3.94Å; L404-L452 HydrophobicContact CD1-CG 4.45Å; M430-L452 HydrophobicContact CB-CD2 4.36Å; M430-L452 HydrophobicContact CE-CD2 3.74Å; I431-L452 HydrophobicContact CD1-CD1 3.6Å; I431-L452 HydrophobicContact CD1-CD2 4.48Å; I431-L452 HydrophobicContact CG1-CD1 4.19Å; I431-L452 HydrophobicContact CG1-CD2 4.24Å; V450-L452 HydrophobicContact CG1-CD2 4.23Å
453	K	90.1	Very high	76.2	Confident	124 Å²	124	68.3 Å²	68.3	54%	0.539	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	141.5	175.9	-65.4	-173.8	-179.3	-177.2	0	110.4	L385 K386	L385-K453 CarbonylContact C-O 3.54Å; L385-K453 WeakPolarHBondContact CA-O 3.44Å; K386-K453 PolarHBondContact N-O 2.79Å; K386-K453 PolarHBondContact O-N 2.75Å
454	F	92.3	Very high	78.4	Confident	21 Å²	21	58.2 Å²	58.2	9%	0.092	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	138.6	170.1	-75.7	-70.8	0	0	0	110.5	F304 I312 L314 S345 C347 W383 E384 L385	F304-F454 HydrophobicContact CD1-CZ 4.1Å; F304-F454 AromaticContact CE1-CE1 3.84Å; F304-F454 HydrophobicContact CE1-CE1 3.84Å; F304-F454 AromaticContact CE1-CZ 3.69Å; F304-F454 HydrophobicContact CE1-CZ 3.69Å; I312-F454 HydrophobicContact CG2-CZ 4.03Å; L314-F454 HydrophobicContact CB-CE2 4.28Å; L314-F454 HydrophobicContact CB-CZ 4.13Å; S345-F454 WeakPolarHBondContact OG-CE2 3.19Å; C347-F454 HydrophobicContact CB-CB 3.93Å; C347-F454 HydrophobicContact CB-CD2 4.01Å; C347-F454 HydrophobicContact CB-CG 4.03Å; W383-F454 HydrophobicContact CB-CD1 4.02Å; W383-F454 HydrophobicContact CE3-CB 4.08Å; E384-F454 CarbonylContact O-C 3.59Å; E384-F454 WeakPolarHBondContact O-CA 3.42Å; L385-F454 HydrophobicContact CD1-CD1 3.99Å; L385-F454 HydrophobicContact CD1-CD2 4.39Å; L385-F454 HydrophobicContact CD1-CE1 3.86Å; L385-F454 HydrophobicContact CD1-CE2 4.28Å; L385-F454 HydrophobicContact CD1-CG 4.27Å; L385-F454 HydrophobicContact CD1-CZ 4.02Å
455	L	92.1	Very high	80.4	Confident	80 Å²	80	57.1 Å²	57.1	42%	0.419	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	130.3	173.4	-64.7	174.7	0	0	0	108.7	W383 E384 K386 T457	W383-L455 CarbonylContact C-O 3.55Å; W383-L455 WeakPolarHBondContact CA-O 3.45Å; E384-L455 PolarHBondContact N-O 2.65Å; E384-L455 PolarHBondContact O-N 2.65Å; K386-L455 HydrophobicContact CB-CD1 4.12Å; K386-L455 HydrophobicContact CD-CD1 3.53Å; K386-L455 HydrophobicContact CG-CD1 3.73Å; L455-T457 PolarHBondContact O-N 3.4Å
456	L	92.1	Very high	82.2	Confident	83 Å²	83	57 Å²	57	44%	0.435	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	111.3	172.1	-176.4	70.1	0	0	0	108.5	M381 W383	M381-L456 HydrophobicContact CB-CD1 3.75Å; M381-L456 HydrophobicContact CG-CD1 4.13Å; W383-L456 HydrophobicContact CD2-CB 4.47Å; W383-L456 HydrophobicContact CD2-CD1 4.11Å; W383-L456 HydrophobicContact CE3-CB 3.93Å; W383-L456 HydrophobicContact CE3-CD1 4.4Å; W383-L456 HydrophobicContact CH2-CB 4.1Å; W383-L456 HydrophobicContact CH2-CD1 4.37Å; W383-L456 HydrophobicContact CZ2-CD1 4.05Å; W383-L456 HydrophobicContact CZ3-CB 3.74Å
457	T	89.8	Confident	83.5	Confident	69 Å²	69	54.8 Å²	54.8	42%	0.423	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	-29.3	-178	51	0	0	0	0	112.9	I382 E384 L455	I382-T457 PolarHBondContact O-N 2.76Å; I382-T457 PolarHBondContact O-OG1 3.15Å; E384-T457 HydrophobicContact CB-CG2 3.6Å; E384-T457 WeakPolarHBondContact OE2-CG2 2.94Å; L455-T457 PolarHBondContact O-N 3.4Å
458	G	87.1	Confident	84.7	Confident	6 Å²	6	53 Å²	53	6%	0.062	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	139.5	-179.4	0	0	0	0	0	112.6	I382	I382-G458 PolarHBondContact N-O 2.68Å; I382-G458 PolarHBondContact O-N 3.36Å
459	L	89.6	Confident	85.8	Confident	91 Å²	91	46.6 Å²	46.6	48%	0.476	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	111.8	173.3	177.6	67.3	0	0	0	110	V380 M381	V380-L459 WeakPolarHBondContact O-CA 3.38Å; M381-L459 HydrophobicContact CG-CD1 3.71Å
460	L	87.6	Confident	86.8	Confident	17 Å²	17	43.1 Å²	43.1	9%	0.089	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	124.8	167.9	-177.3	65	0	0	0	109	I46 R379 V380	I46-L460 HydrophobicContact CG2-CD2 3.82Å; R379-L460 VanDerWaalsContact CA-O 3.25Å; R379-L460 WeakPolarHBondContact CA-O 3.48Å; V380-L460 HydrophobicContact CB-CB 4.17Å; V380-L460 HydrophobicContact CG2-CD2 4.43Å; V380-L460 PolarHBondContact N-O 3.38Å; V380-L460 PolarHBondContact O-N 3.32Å
461	S	84.7	Confident	87.6	Confident	39 Å²	39	44.7 Å²	44.7	27%	0.273	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-96.4	116.3	179.3	-64.4	0	0	0	0	111.7
462	G	81.8	Confident	88.1	Confident	14 Å²	14	41.1 Å²	41.1	14%	0.144	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-76	154.6	172.2	0	0	0	0	0	113.2	G378	G378-G462 PolarHBondContact O-N 2.94Å
463	L	86.6	Confident	88.2	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.226	C	C	.	.	B	Isolated β-bridge	trans	-65.8	140	166.4	-70.3	164.7	0	0	0	111.2	L15 T16 G17 A18 F468 V490 L498 Y500 I818	L15-L463 HydrophobicContact CB-CD1 3.99Å; T16-L463 PolarHBondContact O-N 2.89Å; T16-L463 VanDerWaalsContact O-N 3.11Å; G17-L463 CarbonylContact C-O 3.43Å; G17-L463 WeakPolarHBondContact CA-O 3.32Å; A18-L463 PolarHBondContact N-O 3.07Å; L463-F468 HydrophobicContact CB-CE1 4.44Å; L463-F468 HydrophobicContact CB-CZ 4.19Å; L463-V490 HydrophobicContact CD2-CG1 4.25Å; L463-L498 HydrophobicContact CD2-CD1 4.26Å; L463-Y500 HydrophobicContact CD2-CD2 4.35Å; L463-Y500 HydrophobicContact CD2-CE2 3.41Å; L463-Y500 VanDerWaalsContact CD2-CE2 3.41Å; L463-Y500 WeakPolarHBondContact CD2-OH 3.25Å; L463-Y500 HydrophobicContact CG-CE2 4.36Å; L463-I818 HydrophobicContact CD1-CB 4.03Å; L463-I818 HydrophobicContact CD1-CD1 3.72Å; L463-I818 HydrophobicContact CD1-CG1 3.68Å; L463-I818 HydrophobicContact CD2-CD1 3.99Å
464	P	83.7	Confident	88.2	Confident	28 Å²	28	36.3 Å²	36.3	18%	0.182	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-69.1	173.4	176.6	28.1	-32.8	0	0	0	111.5	F468 T492 L498	P464-F468 HydrophobicContact CG-CE1 4.44Å; P464-F468 WeakPolarHBondContact O-CE1 3.19Å; P464-F468 WeakPolarHBondContact O-CZ 3.38Å; P464-T492 HydrophobicContact CG-CG2 3.38Å; P464-L498 VanDerWaalsContact CD-CD1 3.45Å; P464-L498 HydrophobicContact CG-CD1 4.11Å
465	A	81.8	Confident	87.9	Confident	51 Å²	51	38.4 Å²	38.4	42%	0.421	23%	0.225	S	C	.	.	S	Bend	trans	-62.3	139.9	176.7	0	0	0	0	0	111.6	A18 S493	A18-A465 HydrophobicContact CB-CB 4.41Å; A465-S493 PolarHBondContact O-OG 2.79Å; A465-S493 VanDerWaalsContact O-OG 3.09Å
466	P	81.4	Confident	87.5	Confident	46 Å²	46	38.1 Å²	38.1	30%	0.299	22%	0.223	S	C	.	.	S	Bend	trans	-60	161.1	178.7	21.5	-28.8	0	0	0	112	F468 L799 D814	P466-F468 HydrophobicContact CB-CD2 4.17Å; P466-F468 HydrophobicContact CB-CE2 3.95Å; P466-F468 HydrophobicContact CB-CZ 4.21Å; P466-L799 HydrophobicContact CB-CD1 3.53Å; P466-D814 WeakPolarHBondContact CG-O 3.32Å
467	Q	80	Confident	87.1	Confident	110 Å²	110	37.2 Å²	37.2	51%	0.514	22%	0.222	S	C	.	.	P	Polyproline II helix	cis	-84.6	153.6	18.3	-61	-175.4	-0.7	0	0	115	E517	Q467-E517 PolarHBondContact OE1-OE1 2.92Å
468	F	85.4	Confident	86.6	Confident	12 Å²	12	40.4 Å²	40.4	5%	0.053	24%	0.241	C	C	.	.			trans	-116.9	139.3	177.6	-53.9	-55.6	0	0	0	111.4	L463 P464 P466 I470 V490 G491 L799 A812	L463-F468 HydrophobicContact CB-CE1 4.44Å; L463-F468 HydrophobicContact CB-CZ 4.19Å; P464-F468 HydrophobicContact CG-CE1 4.44Å; P464-F468 WeakPolarHBondContact O-CE1 3.19Å; P464-F468 WeakPolarHBondContact O-CZ 3.38Å; P466-F468 HydrophobicContact CB-CD2 4.17Å; P466-F468 HydrophobicContact CB-CE2 3.95Å; P466-F468 HydrophobicContact CB-CZ 4.21Å; F468-I470 HydrophobicContact CB-CG2 4.39Å; F468-V490 HydrophobicContact CB-CG1 4.28Å; F468-V490 HydrophobicContact CD1-CG1 3.99Å; F468-V490 HydrophobicContact CG-CG1 4.34Å; F468-G491 WeakPolarHBondContact CA-O 3.5Å; F468-L799 HydrophobicContact CD2-CD1 4.4Å; F468-A812 HydrophobicContact CB-CB 4.25Å; F468-A812 HydrophobicContact CD2-CB 4.27Å
469	A	91.3	Very high	86.3	Confident	9 Å²	9	49.4 Å²	49.4	7%	0.074	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	121.2	162	0	0	0	0	0	108.4	V490 G491	A469-V490 CarbonylContact O-C 3.51Å; A469-V490 WeakPolarHBondContact O-CA 3.45Å; A469-G491 PolarHBondContact N-O 3.02Å; A469-G491 PolarHBondContact O-N 3.31Å
470	I	95.1	Very high	86	Confident	4 Å²	4	46 Å²	46	2%	0.021	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	143.1	-176.7	63.5	166.2	0	0	0	112	F468 L488 A489 V490 D800 D802 I810 A812 I818	F468-I470 HydrophobicContact CB-CG2 4.39Å; I470-L488 HydrophobicContact CB-CD1 4.3Å; I470-A489 WeakPolarHBondContact CA-O 3.25Å; I470-V490 HydrophobicContact CG2-CG1 4.28Å; I470-V490 HydrophobicContact CG2-CG2 4.24Å; I470-D800 HydrophobicContact CG1-CB 3.94Å; I470-D800 WeakPolarHBondContact CG1-OD2 3.37Å; I470-D800 PolarHBondContact N-OD2 3.13Å; I470-D802 HydrophobicContact CD1-CB 4.35Å; I470-I810 HydrophobicContact CD1-CB 4.21Å; I470-I810 HydrophobicContact CD1-CG2 3.63Å; I470-A812 HydrophobicContact CD1-CB 4.07Å; I470-A812 HydrophobicContact CG1-CB 4.38Å; I470-A812 HydrophobicContact CG2-CB 3.93Å; I470-I818 HydrophobicContact CG2-CD1 4.03Å
471	R	94.6	Very high	85.8	Confident	37 Å²	37	47.6 Å²	47.6	14%	0.14	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	119.1	172.9	-162.2	73.9	172.7	127.7	-3.5	112.4	A489 I521 E522 W523 R756 D802	R471-A489 PolarHBondContact N-O 2.77Å; R471-A489 PolarHBondContact O-N 2.92Å; R471-I521 HydrophobicContact CB-CB 3.92Å; R471-I521 HydrophobicContact CB-CG2 3.97Å; R471-I521 WeakPolarHBondContact CB-O 3.35Å; R471-I521 VanDerWaalsContact CD-O 3.27Å; R471-I521 WeakPolarHBondContact CD-O 3.48Å; R471-I521 VanDerWaalsContact CG-O 3.24Å; R471-I521 WeakPolarHBondContact CG-O 3.28Å; R471-E522 IonicContact CZ-OE1 3.87Å; R471-E522 IonicContact CZ-OE2 3.7Å; R471-E522 VanDerWaalsContact CZ-OE2 3.24Å; R471-E522 IonicContact NE-OE1 2.72Å; R471-E522 PolarHBondContact NE-OE1 3.46Å; R471-E522 IonicContact NE-OE2 3.9Å; R471-E522 PolarHBondContact NE-OE2 3.22Å; R471-E522 IonicContact NH2-OE1 2.85Å; R471-E522 PolarHBondContact NH2-OE1 3.44Å; R471-E522 IonicContact NH2-OE2 3.82Å; R471-E522 PolarHBondContact NH2-OE2 2.85Å; R471-W523 PolarHBondContact O-NE1 3.08Å; R471-R756 VanDerWaalsContact CZ-CZ 3.49Å; R471-R756 VanDerWaalsContact CZ-NH2 3.26Å; R471-R756 VanDerWaalsContact NH1-CZ 3.33Å; R471-R756 VanDerWaalsContact NH2-NH1 3.19Å; R471-D802 IonicContact NH1-OD1 3.65Å; R471-D802 IonicContact NH1-OD2 3.93Å; R471-D802 PolarHBondContact NH1-OD2 3.44Å; R471-D802 VanDerWaalsContact NH1-OD2 3.17Å
472	M	94.2	Very high	85.8	Confident	12 Å²	12	55.4 Å²	55.4	6%	0.059	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	145.1	173.8	-169.6	61.6	-175.9	0	0	110.9	P486 L487 L488 L502 W523 D802 W803 I810	M472-P486 HydrophobicContact CE-CB 3.74Å; M472-L487 VanDerWaalsContact SD-O 3.41Å; M472-L488 HydrophobicContact SD-CB 4.38Å; M472-L488 HydrophobicContact SD-CD1 4.42Å; M472-L502 HydrophobicContact CE-CD1 4Å; M472-L502 HydrophobicContact SD-CD1 3.71Å; M472-W523 PolarHBondContact O-NE1 3.21Å; M472-D802 PolarHBondContact N-OD2 3.35Å; M472-W803 WeakPolarHBondContact CB-O 3.25Å; M472-W803 WeakPolarHBondContact CG-O 3.33Å; M472-I810 HydrophobicContact CB-CD1 4.37Å; M472-I810 HydrophobicContact CG-CD1 4.5Å; M472-I810 HydrophobicContact SD-CD1 4.02Å
473	C	91.3	Very high	85.9	Confident	6 Å²	6	61.8 Å²	61.8	4%	0.041	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-57.5	157.5	172.9	72.5	0	0	0	0	111.7	Q485 L487 W523	C473-Q485 PolarHBondContact SG-O 2.96Å; C473-L487 HydrophobicContact CB-CB 4.3Å; C473-L487 VanDerWaalsContact CB-O 3.3Å; C473-L487 WeakPolarHBondContact CB-O 3.23Å; C473-L487 PolarHBondContact N-O 2.96Å; C473-W523 HydrophobicContact CB-CD2 4.33Å; C473-W523 HydrophobicContact CB-CH2 4.22Å; C473-W523 HydrophobicContact CB-CZ2 4.02Å; C473-W523 HydrophobicContact CB-CZ3 4.5Å
474	P	89.3	Confident	85.9	Confident	27 Å²	27	62.4 Å²	62.4	18%	0.175	33%	0.328	C	S	.	.	S	Bend	trans	-53.4	138.6	178.5	-26.3	34.6	0	0	0	111.8	Y484 W523 S525 L526	P474-Y484 VanDerWaalsContact O-CE2 3.26Å; P474-Y484 WeakPolarHBondContact O-CE2 3.32Å; P474-W523 HydrophobicContact CG-CB 3.83Å; P474-S525 WeakPolarHBondContact CD-O 2.98Å; P474-S525 WeakPolarHBondContact CG-O 3.28Å; P474-L526 HydrophobicContact CB-CD2 4.11Å; P474-L526 HydrophobicContact CG-CD2 4.36Å
475	P	85.9	Confident	86.1	Confident	65 Å²	65	65.6 Å²	65.6	42%	0.422	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-64.5	158	-166.9	25.9	-35.6	0	0	0	113.7	T477 N480 P759	P475-T477 PolarHBondContact O-N 3.03Å; P475-N480 PolarHBondContact O-ND2 3.45Å; P475-N480 VanDerWaalsContact O-ND2 3.08Å; P475-P759 HydrophobicContact CB-CB 3.58Å; P475-P759 HydrophobicContact CG-CB 4.28Å
476	L	84.8	Confident	86.4	Confident	74 Å²	74	63.2 Å²	63.2	39%	0.387	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-60.7	133	172.7	178.9	64	0	0	0	111.1	F8 I481 Y484	F8-L476 HydrophobicContact CD2-CD2 4.23Å; L476-I481 HydrophobicContact CD1-CB 4.03Å; L476-I481 HydrophobicContact CD1-CG1 4.08Å; L476-Y484 HydrophobicContact CB-CD1 4.1Å; L476-Y484 HydrophobicContact CB-CD2 4.26Å; L476-Y484 HydrophobicContact CB-CE1 4.03Å; L476-Y484 HydrophobicContact CB-CE2 4.22Å; L476-Y484 HydrophobicContact CB-CG 4.2Å; L476-Y484 HydrophobicContact CD1-CD1 3.85Å; L476-Y484 HydrophobicContact CD1-CD2 4.38Å; L476-Y484 HydrophobicContact CD1-CG 3.71Å; L476-Y484 HydrophobicContact CG-CD1 4.4Å
477	T	82.4	Confident	87	Confident	65 Å²	65	61.4 Å²	61.4	40%	0.399	31%	0.309	S	S	.	.			trans	-137.8	164.3	177	69.5	0	0	0	0	109.9	P475 K479 N480 I481	P475-T477 PolarHBondContact O-N 3.03Å; T477-K479 PolarHBondContact O-N 2.7Å; T477-K479 VanDerWaalsContact O-N 3.09Å; T477-K479 PolarHBondContact OG1-N 2.96Å; T477-N480 WeakPolarHBondContact CA-OD1 3.31Å; T477-N480 PolarHBondContact N-OD1 3.48Å; T477-N480 PolarHBondContact O-N 3.04Å; T477-N480 PolarHBondContact O-OD1 2.99Å; T477-N480 VanDerWaalsContact OG1-CG 3.26Å; T477-N480 PolarHBondContact OG1-N 3.02Å; T477-N480 PolarHBondContact OG1-OD1 3.48Å; T477-I481 PolarHBondContact O-N 2.82Å
478	T	81	Confident	87.7	Confident	135 Å²	135	56.2 Å²	56.2	83%	0.828	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-21.4	174.5	53	0	0	0	0	113.6
479	K	79.8	Confident	88.2	Confident	196 Å²	196	55.6 Å²	55.6	85%	0.852	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-30.9	-179.1	-65.5	-175.8	-179.8	179	0	113.5	T477	T477-K479 PolarHBondContact O-N 2.7Å; T477-K479 VanDerWaalsContact O-N 3.09Å; T477-K479 PolarHBondContact OG1-N 2.96Å
480	N	83.8	Confident	88.3	Confident	19 Å²	19	55.2 Å²	55.2	10%	0.102	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	1.1	-174.4	64.8	1.2	0	0	0	114.4	P475 T477 K482 M483 Y484 L526	P475-N480 PolarHBondContact O-ND2 3.45Å; P475-N480 VanDerWaalsContact O-ND2 3.08Å; T477-N480 WeakPolarHBondContact CA-OD1 3.31Å; T477-N480 PolarHBondContact N-OD1 3.48Å; T477-N480 PolarHBondContact O-N 3.04Å; T477-N480 PolarHBondContact O-OD1 2.99Å; T477-N480 VanDerWaalsContact OG1-CG 3.26Å; T477-N480 PolarHBondContact OG1-N 3.02Å; T477-N480 PolarHBondContact OG1-OD1 3.48Å; N480-K482 PolarHBondContact O-N 3.17Å; N480-M483 PolarHBondContact O-N 3.15Å; N480-Y484 WeakPolarHBondContact O-CB 3.31Å; N480-Y484 PolarHBondContact O-N 3.36Å; N480-L526 HydrophobicContact CB-CD1 3.57Å
481	I	83.1	Confident	88.2	Confident	51 Å²	51	55 Å²	55	26%	0.262	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.8	-33.2	-176.3	-167.3	163	0	0	0	115.2	V6 F8 L476 T477	V6-I481 HydrophobicContact CB-CD1 4.11Å; V6-I481 HydrophobicContact CB-CG1 4.16Å; V6-I481 HydrophobicContact CG2-CD1 4.11Å; V6-I481 HydrophobicContact CG2-CG1 4.19Å; F8-I481 HydrophobicContact CE2-CG1 4.47Å; L476-I481 HydrophobicContact CD1-CB 4.03Å; L476-I481 HydrophobicContact CD1-CG1 4.08Å; T477-I481 PolarHBondContact O-N 2.82Å
482	K	83.8	Confident	88	Confident	202 Å²	202	53.4 Å²	53.4	88%	0.878	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-24.1	-179.7	-65.4	-171.2	177.6	-174.1	0	114.4	N480	N480-K482 PolarHBondContact O-N 3.17Å
483	M	84.4	Confident	87.7	Confident	148 Å²	148	54.6 Å²	54.6	73%	0.729	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.8	-1.7	-174.7	-64.4	-178.1	-76.4	0	0	112.3	N480	N480-M483 PolarHBondContact O-N 3.15Å
484	Y	87.3	Confident	87.4	Confident	13 Å²	13	59.8 Å²	59.8	5%	0.051	31%	0.308	C	S	.	.			trans	-72	133.3	-175.2	-179.6	-98.1	0	0	0	111	F8 P474 L476 N480 P486 L526	F8-Y484 HydrophobicContact CD2-CD1 4.22Å; F8-Y484 HydrophobicContact CE2-CD1 4.29Å; P474-Y484 VanDerWaalsContact O-CE2 3.26Å; P474-Y484 WeakPolarHBondContact O-CE2 3.32Å; L476-Y484 HydrophobicContact CB-CD1 4.1Å; L476-Y484 HydrophobicContact CB-CD2 4.26Å; L476-Y484 HydrophobicContact CB-CE1 4.03Å; L476-Y484 HydrophobicContact CB-CE2 4.22Å; L476-Y484 HydrophobicContact CB-CG 4.2Å; L476-Y484 HydrophobicContact CD1-CD1 3.85Å; L476-Y484 HydrophobicContact CD1-CD2 4.38Å; L476-Y484 HydrophobicContact CD1-CG 3.71Å; L476-Y484 HydrophobicContact CG-CD1 4.4Å; N480-Y484 WeakPolarHBondContact O-CB 3.31Å; N480-Y484 PolarHBondContact O-N 3.36Å; Y484-P486 HydrophobicContact CE1-CB 4.3Å; Y484-L526 HydrophobicContact CD2-CD2 4.13Å
485	Q	87.4	Confident	87.4	Confident	95 Å²	95	58.5 Å²	58.5	44%	0.444	30%	0.3	S	S	.	.			trans	-132.1	137.3	169.1	-68.7	-178.3	-17.4	0	0	108.4	C473 L487	C473-Q485 PolarHBondContact SG-O 2.96Å; Q485-L487 HydrophobicContact CB-CD1 4.35Å; Q485-L487 HydrophobicContact CB-CD2 4.29Å; Q485-L487 HydrophobicContact CB-CG 3.93Å; Q485-L487 PolarHBondContact O-N 3.42Å
486	P	89.3	Confident	87.7	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.006	29%	0.286	C	S	.	.			trans	-77	75	179.6	31.1	-32.9	0	0	0	110.7	V10 M472 Y484 L502 T503	V10-P486 HydrophobicContact CG2-CB 4.23Å; V10-P486 HydrophobicContact CG2-CG 4.38Å; M472-P486 HydrophobicContact CE-CB 3.74Å; Y484-P486 HydrophobicContact CE1-CB 4.3Å; P486-L502 HydrophobicContact CB-CB 4.46Å; P486-L502 PolarHBondContact O-N 3.43Å; P486-T503 WeakPolarHBondContact CG-OG1 3.46Å
487	L	93.3	Very high	88.1	Confident	9 Å²	9	52.7 Å²	52.7	5%	0.047	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	129.1	-179.1	-60	177.5	0	0	0	111.2	M472 C473 Q485 V499 Y500 H501 W523 L552	M472-L487 VanDerWaalsContact SD-O 3.41Å; C473-L487 HydrophobicContact CB-CB 4.3Å; C473-L487 VanDerWaalsContact CB-O 3.3Å; C473-L487 WeakPolarHBondContact CB-O 3.23Å; C473-L487 PolarHBondContact N-O 2.96Å; Q485-L487 HydrophobicContact CB-CD1 4.35Å; Q485-L487 HydrophobicContact CB-CD2 4.29Å; Q485-L487 HydrophobicContact CB-CG 3.93Å; Q485-L487 PolarHBondContact O-N 3.42Å; L487-V499 HydrophobicContact CB-CG1 4.2Å; L487-V499 HydrophobicContact CD2-CG1 4.35Å; L487-Y500 CarbonylContact C-O 3.57Å; L487-Y500 WeakPolarHBondContact CA-O 3.48Å; L487-H501 HydrophobicContact CD2-CB 4.13Å; L487-W523 HydrophobicContact CB-CH2 4.17Å; L487-W523 HydrophobicContact CB-CZ2 4.45Å; L487-L552 HydrophobicContact CD1-CD1 4.23Å
488	L	94.4	Very high	88.6	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	122.7	173.1	-179.8	65.4	0	0	0	109.6	I470 M472 V490 V499 Y500 L502 I810 I818	I470-L488 HydrophobicContact CB-CD1 4.3Å; M472-L488 HydrophobicContact SD-CB 4.38Å; M472-L488 HydrophobicContact SD-CD1 4.42Å; L488-V490 HydrophobicContact CD2-CG2 4.03Å; L488-V490 HydrophobicContact CG-CG2 4Å; L488-V499 CarbonylContact O-C 3.59Å; L488-V499 WeakPolarHBondContact O-CA 3.27Å; L488-Y500 PolarHBondContact N-O 3.07Å; L488-Y500 PolarHBondContact O-N 2.84Å; L488-L502 HydrophobicContact CB-CD1 4.03Å; L488-L502 HydrophobicContact CB-CD2 3.88Å; L488-L502 HydrophobicContact CB-CG 3.93Å; L488-L502 HydrophobicContact CD2-CD2 3.95Å; L488-I810 HydrophobicContact CD1-CD1 3.87Å; L488-I810 HydrophobicContact CD2-CD1 4.43Å; L488-I810 HydrophobicContact CD2-CG2 4.14Å; L488-I818 HydrophobicContact CD2-CD1 4.32Å; L488-I818 HydrophobicContact CD2-CG2 3.87Å
489	A	95.3	Very high	89.2	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	131.3	170.3	0	0	0	0	0	110.1	I470 R471 V497 L498 I521 W523	I470-A489 WeakPolarHBondContact CA-O 3.25Å; R471-A489 PolarHBondContact N-O 2.77Å; R471-A489 PolarHBondContact O-N 2.92Å; A489-V497 HydrophobicContact CB-CG1 4.18Å; A489-L498 CarbonylContact C-O 3.48Å; A489-I521 HydrophobicContact CB-CD1 4.1Å; A489-I521 HydrophobicContact CB-CG2 4.06Å; A489-W523 HydrophobicContact CB-CZ2 3.81Å
490	V	94.3	Very high	89.8	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	110.7	-178.1	-175.3	0	0	0	0	108.5	L463 F468 A469 I470 L488 V497 L498 Y500 I818	L463-V490 HydrophobicContact CD2-CG1 4.25Å; F468-V490 HydrophobicContact CB-CG1 4.28Å; F468-V490 HydrophobicContact CD1-CG1 3.99Å; F468-V490 HydrophobicContact CG-CG1 4.34Å; A469-V490 CarbonylContact O-C 3.51Å; A469-V490 WeakPolarHBondContact O-CA 3.45Å; I470-V490 HydrophobicContact CG2-CG1 4.28Å; I470-V490 HydrophobicContact CG2-CG2 4.24Å; L488-V490 HydrophobicContact CD2-CG2 4.03Å; L488-V490 HydrophobicContact CG-CG2 4Å; V490-V497 CarbonylContact O-C 3.55Å; V490-V497 WeakPolarHBondContact O-CA 3.41Å; V490-L498 HydrophobicContact CB-CB 4.38Å; V490-L498 PolarHBondContact N-O 2.83Å; V490-L498 PolarHBondContact O-N 3.47Å; V490-Y500 HydrophobicContact CG2-CD2 4.17Å; V490-I818 HydrophobicContact CB-CD1 4.28Å; V490-I818 HydrophobicContact CG1-CD1 3.8Å; V490-I818 HydrophobicContact CG2-CD1 3.44Å; V490-I818 VanDerWaalsContact CG2-CD1 3.44Å
491	G	93.3	Very high	90	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	136.4	172.3	0	0	0	0	0	110.6	F468 A469	F468-G491 WeakPolarHBondContact CA-O 3.5Å; A469-G491 PolarHBondContact N-O 3.02Å; A469-G491 PolarHBondContact O-N 3.31Å
492	T	90.5	Very high	90.2	Very high	4 Å²	4	33.1 Å²	33.1	3%	0.025	16%	0.163	C	C	.	.			trans	-109.7	160.7	-174.7	69.4	0	0	0	0	111.4	P464 N494 G495 S496 L498 V518	P464-T492 HydrophobicContact CG-CG2 3.38Å; T492-N494 PolarHBondContact O-N 3.5Å; T492-G495 PolarHBondContact O-N 3.04Å; T492-S496 WeakPolarHBondContact CB-O 3.29Å; T492-S496 WeakPolarHBondContact CG2-O 3.43Å; T492-S496 PolarHBondContact N-O 3.42Å; T492-S496 WeakPolarHBondContact OG1-CA 3.49Å; T492-S496 PolarHBondContact OG1-N 3.25Å; T492-S496 PolarHBondContact OG1-O 3.45Å; T492-L498 HydrophobicContact CG2-CD1 3.91Å; T492-L498 HydrophobicContact CG2-CG 3.89Å; T492-V518 PolarHBondContact O-N 3.2Å; T492-V518 VanDerWaalsContact O-N 3.14Å
493	S	87.2	Confident	90.1	Very high	37 Å²	37	25.3 Å²	25.3	26%	0.259	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-22.5	172.9	51.9	0	0	0	0	113.8	A465 E517	A465-S493 PolarHBondContact O-OG 2.79Å; A465-S493 VanDerWaalsContact O-OG 3.09Å; S493-E517 WeakPolarHBondContact O-CA 3.5Å
494	N	85.3	Confident	89.9	Confident	114 Å²	114	19.4 Å²	19.4	61%	0.61	11%	0.106	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.8	1	-179.6	-62.8	-7.6	0	0	0	113.7	T492	T492-N494 PolarHBondContact O-N 3.5Å
495	G	88.7	Confident	89.6	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.11	C	C	.	.	S	Bend	trans	85.1	2.7	-178.5	0	0	0	0	0	115.5	T492 I513 H514 C516	T492-G495 PolarHBondContact O-N 3.04Å; G495-I513 PolarHBondContact O-N 3.38Å; G495-H514 WeakPolarHBondContact O-CB 3.19Å; G495-H514 PolarHBondContact O-N 2.94Å; G495-C516 WeakPolarHBondContact CA-O 3.08Å; G495-C516 PolarHBondContact N-O 3.48Å
496	S	91.6	Very high	89.5	Confident	18 Å²	18	18.4 Å²	18.4	13%	0.126	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	150.8	169.3	-60.2	0	0	0	0	111.5	T492 L511	T492-S496 WeakPolarHBondContact CB-O 3.29Å; T492-S496 WeakPolarHBondContact CG2-O 3.43Å; T492-S496 PolarHBondContact N-O 3.42Å; T492-S496 WeakPolarHBondContact OG1-CA 3.49Å; T492-S496 PolarHBondContact OG1-N 3.25Å; T492-S496 PolarHBondContact OG1-O 3.45Å; S496-L511 CarbonylContact C-O 3.51Å; S496-L511 VanDerWaalsContact CA-O 3.22Å; S496-L511 WeakPolarHBondContact CA-O 3.44Å
497	V	93.8	Very high	89.4	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	121.2	165.2	-179.1	0	0	0	0	108.7	A489 V490 L511 I513 V518 I521 F529	A489-V497 HydrophobicContact CB-CG1 4.18Å; V490-V497 CarbonylContact O-C 3.55Å; V490-V497 WeakPolarHBondContact O-CA 3.41Å; V497-L511 PolarHBondContact N-O 3.46Å; V497-L511 PolarHBondContact O-N 3.01Å; V497-I513 HydrophobicContact CB-CD1 3.72Å; V497-I513 HydrophobicContact CG2-CD1 3.61Å; V497-V518 HydrophobicContact CG2-CG1 4.43Å; V497-V518 HydrophobicContact CG2-CG2 4.18Å; V497-I521 HydrophobicContact CG1-CD1 3.87Å; V497-I521 HydrophobicContact CG2-CD1 4.23Å; V497-F529 HydrophobicContact CB-CE2 4.36Å; V497-F529 HydrophobicContact CB-CZ 4.16Å; V497-F529 HydrophobicContact CG1-CE2 3.98Å; V497-F529 HydrophobicContact CG1-CZ 3.76Å; V497-F529 HydrophobicContact CG2-CE2 4.21Å; V497-F529 HydrophobicContact CG2-CZ 4.48Å
498	L	93.3	Very high	89.2	Confident	7 Å²	7	24.7 Å²	24.7	4%	0.037	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	133.3	175.7	-55.8	178.2	0	0	0	109.1	L463 P464 A489 V490 T492 Y500 L507 E510	L463-L498 HydrophobicContact CD2-CD1 4.26Å; P464-L498 VanDerWaalsContact CD-CD1 3.45Å; P464-L498 HydrophobicContact CG-CD1 4.11Å; A489-L498 CarbonylContact C-O 3.48Å; V490-L498 HydrophobicContact CB-CB 4.38Å; V490-L498 PolarHBondContact N-O 2.83Å; V490-L498 PolarHBondContact O-N 3.47Å; T492-L498 HydrophobicContact CG2-CD1 3.91Å; T492-L498 HydrophobicContact CG2-CG 3.89Å; L498-Y500 HydrophobicContact CB-CD2 4.25Å; L498-Y500 HydrophobicContact CB-CE2 3.76Å; L498-Y500 HydrophobicContact CD1-CE2 4.18Å; L498-L507 HydrophobicContact CB-CD1 3.9Å; L498-L507 HydrophobicContact CD2-CD1 4.2Å; L498-E510 HydrophobicContact CD2-CB 3.64Å; L498-E510 HydrophobicContact CD2-CG 3.5Å; L498-E510 VanDerWaalsContact CD2-CG 3.5Å
499	V	93.7	Very high	89	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	113.4	179.9	-176.4	0	0	0	0	107.8	L487 L488 H508 K509 L552	L487-V499 HydrophobicContact CB-CG1 4.2Å; L487-V499 HydrophobicContact CD2-CG1 4.35Å; L488-V499 CarbonylContact O-C 3.59Å; L488-V499 WeakPolarHBondContact O-CA 3.27Å; V499-H508 HydrophobicContact CG1-CB 4.43Å; V499-H508 WeakPolarHBondContact O-CA 2.91Å; V499-H508 VanDerWaalsContact O-CB 3.27Å; V499-H508 WeakPolarHBondContact O-CB 3.36Å; V499-H508 PolarHBondContact O-N 3.4Å; V499-K509 HydrophobicContact CB-CB 4.45Å; V499-K509 PolarHBondContact N-O 3.49Å; V499-K509 PolarHBondContact O-N 3.18Å; V499-L552 HydrophobicContact CG1-CD2 4.45Å; V499-L552 HydrophobicContact CG2-CD2 3.76Å
500	Y	91.4	Very high	88.9	Confident	6 Å²	6	33.5 Å²	33.5	2%	0.024	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	142.2	179.7	-77.5	-92.5	0	0	0	111.1	L15 L463 L487 L488 V490 L498 L507	L15-Y500 HydrophobicContact CD1-CD1 3.96Å; L15-Y500 HydrophobicContact CD1-CG 3.98Å; L463-Y500 HydrophobicContact CD2-CD2 4.35Å; L463-Y500 HydrophobicContact CD2-CE2 3.41Å; L463-Y500 VanDerWaalsContact CD2-CE2 3.41Å; L463-Y500 WeakPolarHBondContact CD2-OH 3.25Å; L463-Y500 HydrophobicContact CG-CE2 4.36Å; L487-Y500 CarbonylContact C-O 3.57Å; L487-Y500 WeakPolarHBondContact CA-O 3.48Å; L488-Y500 PolarHBondContact N-O 3.07Å; L488-Y500 PolarHBondContact O-N 2.84Å; V490-Y500 HydrophobicContact CG2-CD2 4.17Å; L498-Y500 HydrophobicContact CB-CD2 4.25Å; L498-Y500 HydrophobicContact CB-CE2 3.76Å; L498-Y500 HydrophobicContact CD1-CE2 4.18Å; Y500-L507 HydrophobicContact CD1-CB 4.42Å; Y500-L507 HydrophobicContact CD2-CD1 4.19Å; Y500-L507 HydrophobicContact CE1-CB 4.06Å; Y500-L507 HydrophobicContact CE1-CD1 4.23Å; Y500-L507 HydrophobicContact CE2-CD1 3.84Å
501	H	89.5	Confident	88.8	Confident	42 Å²	42	34.7 Å²	34.7	19%	0.194	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	108.8	169.5	-176.6	-88.4	0	0	0	109.2	L487 T503 S504 G505 L506	L487-H501 HydrophobicContact CD2-CB 4.13Å; H501-T503 PolarHBondContact O-N 3.39Å; H501-S504 WeakPolarHBondContact CB-OG 3.46Å; H501-S504 PolarHBondContact ND1-N 3.4Å; H501-S504 PolarHBondContact ND1-OG 3.04Å; H501-S504 VanDerWaalsContact ND1-OG 3.08Å; H501-S504 PolarHBondContact O-N 3.25Å; H501-S504 PolarHBondContact O-OG 3.5Å; H501-S504 VanDerWaalsContact O-OG 3.12Å; H501-G505 WeakPolarHBondContact O-CA 3.33Å; H501-G505 PolarHBondContact O-N 3.02Å; H501-L506 PolarHBondContact N-O 3.04Å
502	L	86.8	Confident	88.7	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-26.2	-166.2	-66.6	-176.7	0	0	0	114.6	V10 R13 L15 M472 P486 L488 S504 C804 I810 V820	V10-L502 HydrophobicContact CG1-CB 4.31Å; R13-L502 WeakPolarHBondContact CD-O 3.19Å; R13-L502 VanDerWaalsContact CZ-O 3.25Å; R13-L502 PolarHBondContact NE-O 2.96Å; R13-L502 PolarHBondContact NH1-O 2.82Å; L15-L502 HydrophobicContact CD1-CD2 4.09Å; M472-L502 HydrophobicContact CE-CD1 4Å; M472-L502 HydrophobicContact SD-CD1 3.71Å; P486-L502 HydrophobicContact CB-CB 4.46Å; P486-L502 PolarHBondContact O-N 3.43Å; L488-L502 HydrophobicContact CB-CD1 4.03Å; L488-L502 HydrophobicContact CB-CD2 3.88Å; L488-L502 HydrophobicContact CB-CG 3.93Å; L488-L502 HydrophobicContact CD2-CD2 3.95Å; L502-S504 VanDerWaalsContact C-N 3.33Å; L502-C804 HydrophobicContact CD1-CB 4.33Å; L502-C804 WeakPolarHBondContact CD1-SG 3.45Å; L502-I810 HydrophobicContact CD1-CD1 3.81Å; L502-V820 HydrophobicContact CD1-CG2 4.33Å; L502-V820 HydrophobicContact CD2-CG2 4.16Å
503	T	82.6	Confident	88.6	Confident	38 Å²	38	40.7 Å²	40.7	23%	0.233	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-34.4	174.8	-54.4	0	0	0	0	111.9	R13 P486 H501	R13-T503 PolarHBondContact NH1-O 2.78Å; R13-T503 PolarHBondContact NH2-O 2.87Å; P486-T503 WeakPolarHBondContact CG-OG1 3.46Å; H501-T503 PolarHBondContact O-N 3.39Å
504	S	79.3	Confident	88.8	Confident	23 Å²	23	39.7 Å²	39.7	16%	0.161	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-27.6	178.7	59	0	0	0	0	112.7	R13 H501 L502 L506 T838	R13-S504 PolarHBondContact NH1-O 2.93Å; R13-S504 VanDerWaalsContact NH1-O 3.16Å; H501-S504 WeakPolarHBondContact CB-OG 3.46Å; H501-S504 PolarHBondContact ND1-N 3.4Å; H501-S504 PolarHBondContact ND1-OG 3.04Å; H501-S504 VanDerWaalsContact ND1-OG 3.08Å; H501-S504 PolarHBondContact O-N 3.25Å; H501-S504 PolarHBondContact O-OG 3.5Å; H501-S504 VanDerWaalsContact O-OG 3.12Å; L502-S504 VanDerWaalsContact C-N 3.33Å; S504-L506 PolarHBondContact O-N 3.41Å; S504-L506 PolarHBondContact OG-N 3.27Å; S504-T838 VanDerWaalsContact CA-CG2 3.47Å
505	G	81.5	Confident	89	Confident	15 Å²	15	38.4 Å²	38.4	16%	0.155	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.1	2.6	-170.1	0	0	0	0	0	113.1	R13 H501	R13-G505 VanDerWaalsContact NH1-N 3.1Å; H501-G505 WeakPolarHBondContact O-CA 3.33Å; H501-G505 PolarHBondContact O-N 3.02Å
506	L	84	Confident	89	Confident	73 Å²	73	40 Å²	40	38%	0.382	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	148.4	-179.1	-60.4	176.4	0	0	0	111.1	H501 S504 H508	H501-L506 PolarHBondContact N-O 3.04Å; S504-L506 PolarHBondContact O-N 3.41Å; S504-L506 PolarHBondContact OG-N 3.27Å; L506-H508 PolarHBondContact O-N 2.78Å
507	L	88.4	Confident	88.9	Confident	50 Å²	50	41.6 Å²	41.6	26%	0.262	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	120.2	172.4	-179	68.2	0	0	0	109.3	L498 Y500 E510	L498-L507 HydrophobicContact CB-CD1 3.9Å; L498-L507 HydrophobicContact CD2-CD1 4.2Å; Y500-L507 HydrophobicContact CD1-CB 4.42Å; Y500-L507 HydrophobicContact CD2-CD1 4.19Å; Y500-L507 HydrophobicContact CE1-CB 4.06Å; Y500-L507 HydrophobicContact CE1-CD1 4.23Å; Y500-L507 HydrophobicContact CE2-CD1 3.84Å; L507-E510 HydrophobicContact CD2-CB 4.3Å
508	H	89.3	Confident	88.9	Confident	92 Å²	92	41.8 Å²	41.8	43%	0.426	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	-47.4	178.2	-178.1	66.7	0	0	0	111.9	V499 L506	V499-H508 HydrophobicContact CG1-CB 4.43Å; V499-H508 WeakPolarHBondContact O-CA 2.91Å; V499-H508 VanDerWaalsContact O-CB 3.27Å; V499-H508 WeakPolarHBondContact O-CB 3.36Å; V499-H508 PolarHBondContact O-N 3.4Å; L506-H508 PolarHBondContact O-N 2.78Å
509	K	90.3	Very high	88.8	Confident	59 Å²	59	45.7 Å²	45.7	26%	0.257	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	144.5	176.1	-71.9	-163.5	177.1	-159.8	0	111.7	V499 L511 L552 P553	V499-K509 HydrophobicContact CB-CB 4.45Å; V499-K509 PolarHBondContact N-O 3.49Å; V499-K509 PolarHBondContact O-N 3.18Å; K509-L511 HydrophobicContact CB-CG 4.44Å; K509-L552 WeakPolarHBondContact CD-O 3.31Å; K509-L552 VanDerWaalsContact CE-O 3.31Å; K509-L552 WeakPolarHBondContact CE-O 3.49Å; K509-L552 PolarHBondContact NZ-O 2.96Å; K509-P553 PolarHBondContact NZ-O 3.05Å
510	E	91.3	Very high	88.8	Confident	126 Å²	126	46.2 Å²	46.2	59%	0.589	26%	0.255	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.9	125.2	165.5	170.4	169.1	-162.6	0	0	108.9	L498 L507	L498-E510 HydrophobicContact CD2-CB 3.64Å; L498-E510 HydrophobicContact CD2-CG 3.5Å; L498-E510 VanDerWaalsContact CD2-CG 3.5Å; L507-E510 HydrophobicContact CD2-CB 4.3Å
511	L	92.6	Very high	89	Confident	24 Å²	24	46.4 Å²	46.4	13%	0.126	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	110.9	-175.7	-59	173.9	0	0	0	109.8	S496 V497 K509 I513 F529 V550 L552	S496-L511 CarbonylContact C-O 3.51Å; S496-L511 VanDerWaalsContact CA-O 3.22Å; S496-L511 WeakPolarHBondContact CA-O 3.44Å; V497-L511 PolarHBondContact N-O 3.46Å; V497-L511 PolarHBondContact O-N 3.01Å; K509-L511 HydrophobicContact CB-CG 4.44Å; L511-I513 HydrophobicContact CB-CD1 3.62Å; L511-I513 HydrophobicContact CB-CG1 3.83Å; L511-I513 HydrophobicContact CD1-CD1 4.39Å; L511-I513 PolarHBondContact O-N 3.06Å; L511-F529 HydrophobicContact CD1-CE1 4.41Å; L511-F529 HydrophobicContact CD1-CZ 4.29Å; L511-V550 HydrophobicContact CD1-CG1 3.71Å; L511-L552 HydrophobicContact CD1-CD2 4.17Å
512	S	91.2	Very high	89.2	Confident	106 Å²	106	45 Å²	45	74%	0.741	25%	0.25	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-81.2	91.1	173.7	57.8	0	0	0	0	110.3
513	I	89.9	Confident	89.5	Confident	25 Å²	25	45.2 Å²	45.2	13%	0.128	25%	0.25	C	S	.	.			trans	-101.7	-39.3	-168.3	-64.2	149.6	0	0	0	112.1	G495 V497 L511 F529 Q548 V550	G495-I513 PolarHBondContact O-N 3.38Å; V497-I513 HydrophobicContact CB-CD1 3.72Å; V497-I513 HydrophobicContact CG2-CD1 3.61Å; L511-I513 HydrophobicContact CB-CD1 3.62Å; L511-I513 HydrophobicContact CB-CG1 3.83Å; L511-I513 HydrophobicContact CD1-CD1 4.39Å; L511-I513 PolarHBondContact O-N 3.06Å; I513-F529 HydrophobicContact CD1-CE2 4.23Å; I513-F529 HydrophobicContact CD1-CZ 4.02Å; I513-Q548 HydrophobicContact CG2-CB 3.49Å; I513-Q548 VanDerWaalsContact CG2-CB 3.49Å; I513-Q548 HydrophobicContact CG2-CG 3.59Å; I513-V550 HydrophobicContact CD1-CG1 4.48Å; I513-V550 HydrophobicContact CD1-CG2 3.75Å; I513-V550 HydrophobicContact CG1-CG2 4.05Å; I513-V550 HydrophobicContact CG2-CG2 4.18Å
514	H	91.1	Very high	90	Very high	16 Å²	16	44.1 Å²	44.1	7%	0.074	24%	0.244	C	C	.	.			trans	-113.7	157.6	-171.3	-66.1	-75.9	0	0	0	112.1	G495 S531 A533 E546	G495-H514 WeakPolarHBondContact O-CB 3.19Å; G495-H514 PolarHBondContact O-N 2.94Å; H514-S531 PolarHBondContact CE1-O 3.38Å; H514-S531 WeakPolarHBondContact NE2-CB 3.3Å; H514-S531 PolarHBondContact NE2-O 2.84Å; H514-S531 PolarHBondContact NE2-OG 3.05Å; H514-A533 HydrophobicContact CB-CB 3.86Å; H514-E546 VanDerWaalsContact CA-OE2 3.31Å; H514-E546 WeakPolarHBondContact CA-OE2 3.3Å; H514-E546 WeakPolarHBondContact CB-OE2 3.46Å; H514-E546 IonicContact CG-OE2 2.66Å; H514-E546 WeakPolarHBondContact ND1-CB 3.39Å; H514-E546 IonicContact ND1-OE2 3.89Å; H514-E546 PolarHBondContact ND1-OE2 3.32Å; H514-E546 VanDerWaalsContact ND1-OE2 3.12Å
515	S	88.3	Confident	90.4	Very high	86 Å²	86	44.9 Å²	44.9	60%	0.601	25%	0.249	S	C	*	.	S	Bend	trans	-87	-14.9	173.2	68.3	0	0	0	0	113.5	E546	S515-E546 PolarHBondContact N-OE2 2.79Å; S515-E546 VanDerWaalsContact N-OE2 3.1Å; S515-E546 PolarHBondContact OG-OE1 3.04Å
516	C	89.6	Confident	90.7	Very high	34 Å²	34	46.1 Å²	46.1	23%	0.23	25%	0.252	C	S	.	.	S	Bend	trans	-131.7	172.3	-173.6	-62.3	0	0	0	0	110.9	G495 V518 A533	G495-C516 WeakPolarHBondContact CA-O 3.08Å; G495-C516 PolarHBondContact N-O 3.48Å; C516-V518 PolarHBondContact O-N 3.42Å; C516-A533 HydrophobicContact CB-CB 4.36Å
517	E	89.9	Confident	91	Very high	52 Å²	52	45.8 Å²	45.8	24%	0.243	25%	0.253	C	S	.	.			trans	-52.1	130.2	176.7	176.2	-173.2	162.9	0	0	112.6	Q467 S493 K519 A533	Q467-E517 PolarHBondContact OE1-OE1 2.92Å; S493-E517 WeakPolarHBondContact O-CA 3.5Å; E517-K519 HydrophobicContact CG-CD 4.48Å; E517-K519 PolarHBondContact O-N 2.99Å; E517-K519 IonicContact OE1-NZ 3.04Å; E517-K519 PolarHBondContact OE1-NZ 3.31Å; E517-K519 IonicContact OE2-NZ 2.79Å; E517-K519 PolarHBondContact OE2-NZ 3.47Å; E517-A533 VanDerWaalsContact O-CB 3.24Å; E517-A533 WeakPolarHBondContact O-CB 3.35Å
518	V	93.4	Very high	91.1	Very high	3 Å²	3	44.4 Å²	44.4	2%	0.018	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	115.3	175.3	-175.2	0	0	0	0	109.5	T492 V497 C516 I521	T492-V518 PolarHBondContact O-N 3.2Å; T492-V518 VanDerWaalsContact O-N 3.14Å; V497-V518 HydrophobicContact CG2-CG1 4.43Å; V497-V518 HydrophobicContact CG2-CG2 4.18Å; C516-V518 PolarHBondContact O-N 3.42Å; V518-I521 HydrophobicContact CG1-CD1 4.28Å; V518-I521 HydrophobicContact CG1-CG1 3.94Å
519	K	91.8	Very high	91.4	Very high	89 Å²	89	40 Å²	40	39%	0.387	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	-24.7	-176.8	-68	-64.4	177.3	-168.8	0	113.8	E517 F532	E517-K519 HydrophobicContact CG-CD 4.48Å; E517-K519 PolarHBondContact O-N 2.99Å; E517-K519 IonicContact OE1-NZ 3.04Å; E517-K519 PolarHBondContact OE1-NZ 3.31Å; E517-K519 IonicContact OE2-NZ 2.79Å; E517-K519 PolarHBondContact OE2-NZ 3.47Å; K519-F532 HydrophobicContact CB-CD2 4.12Å; K519-F532 HydrophobicContact CB-CE2 3.6Å; K519-F532 HydrophobicContact CB-CZ 3.91Å; K519-F532 PolarHBondContact N-O 3.47Å
520	G	92.1	Very high	91.6	Very high	12 Å²	12	37.2 Å²	37.2	12%	0.124	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.6	159.2	175.7	0	0	0	0	0	114.1	S531 F532	G520-S531 WeakPolarHBondContact O-CA 3.49Å; G520-F532 VanDerWaalsContact CA-CE1 3.42Å; G520-F532 WeakPolarHBondContact O-CD1 3.14Å; G520-F532 PolarHBondContact O-N 2.85Å; G520-F532 VanDerWaalsContact O-N 3.07Å
521	I	95.4	Very high	91.8	Very high	9 Å²	9	31.2 Å²	31.2	5%	0.046	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	134.7	-176.3	-57.7	173.8	0	0	0	108.8	R471 A489 V497 V518 F529 L530	R471-I521 HydrophobicContact CB-CB 3.92Å; R471-I521 HydrophobicContact CB-CG2 3.97Å; R471-I521 WeakPolarHBondContact CB-O 3.35Å; R471-I521 VanDerWaalsContact CD-O 3.27Å; R471-I521 WeakPolarHBondContact CD-O 3.48Å; R471-I521 VanDerWaalsContact CG-O 3.24Å; R471-I521 WeakPolarHBondContact CG-O 3.28Å; A489-I521 HydrophobicContact CB-CD1 4.1Å; A489-I521 HydrophobicContact CB-CG2 4.06Å; V497-I521 HydrophobicContact CG1-CD1 3.87Å; V497-I521 HydrophobicContact CG2-CD1 4.23Å; V518-I521 HydrophobicContact CG1-CD1 4.28Å; V518-I521 HydrophobicContact CG1-CG1 3.94Å; I521-F529 HydrophobicContact CG2-CB 4.27Å; I521-F529 HydrophobicContact CG2-CD2 3.81Å; I521-F529 HydrophobicContact CG2-CG 4.25Å; I521-L530 CarbonylContact C-O 3.59Å; I521-L530 WeakPolarHBondContact CA-O 3.44Å
522	E	94.6	Very high	91.9	Very high	13 Å²	13	30.5 Å²	30.5	6%	0.061	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	126.4	172.9	-77.5	-68.7	176	0	0	110.9	R471 L530 I574 V576 R756	R471-E522 IonicContact CZ-OE1 3.87Å; R471-E522 IonicContact CZ-OE2 3.7Å; R471-E522 VanDerWaalsContact CZ-OE2 3.24Å; R471-E522 IonicContact NE-OE1 2.72Å; R471-E522 PolarHBondContact NE-OE1 3.46Å; R471-E522 IonicContact NE-OE2 3.9Å; R471-E522 PolarHBondContact NE-OE2 3.22Å; R471-E522 IonicContact NH2-OE1 2.85Å; R471-E522 PolarHBondContact NH2-OE1 3.44Å; R471-E522 IonicContact NH2-OE2 3.82Å; R471-E522 PolarHBondContact NH2-OE2 2.85Å; E522-L530 PolarHBondContact N-O 3.41Å; E522-L530 PolarHBondContact O-N 3.29Å; E522-I574 HydrophobicContact CB-CD1 4.29Å; E522-I574 HydrophobicContact CB-CG1 4.47Å; E522-I574 HydrophobicContact CG-CD1 4.48Å; E522-I574 HydrophobicContact CG-CG1 4.15Å; E522-V576 HydrophobicContact CB-CG2 3.78Å; E522-R756 IonicContact OE1-CZ 2.65Å; E522-R756 IonicContact OE1-NH1 2.78Å; E522-R756 IonicContact OE1-NH2 2.98Å; E522-R756 PolarHBondContact OE1-NH2 2.9Å
523	W	93.6	Very high	91.9	Very high	4 Å²	4	25.5 Å²	25.5	2%	0.015	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	131.8	-179.3	-68.8	87.9	0	0	0	112.1	R471 M472 C473 P474 L487 A489 L526 F529 L552 K580	R471-W523 PolarHBondContact O-NE1 3.08Å; M472-W523 PolarHBondContact O-NE1 3.21Å; C473-W523 HydrophobicContact CB-CD2 4.33Å; C473-W523 HydrophobicContact CB-CH2 4.22Å; C473-W523 HydrophobicContact CB-CZ2 4.02Å; C473-W523 HydrophobicContact CB-CZ3 4.5Å; P474-W523 HydrophobicContact CG-CB 3.83Å; L487-W523 HydrophobicContact CB-CH2 4.17Å; L487-W523 HydrophobicContact CB-CZ2 4.45Å; A489-W523 HydrophobicContact CB-CZ2 3.81Å; W523-L526 WeakPolarHBondContact CZ3-O 3.32Å; W523-F529 HydrophobicContact CD2-CB 3.92Å; W523-F529 HydrophobicContact CE3-CB 3.96Å; W523-F529 HydrophobicContact CG-CB 4.21Å; W523-F529 HydrophobicContact CZ3-CD1 4.35Å; W523-L552 HydrophobicContact CH2-CD1 3.45Å; W523-L552 VanDerWaalsContact CH2-CD1 3.45Å; W523-L552 HydrophobicContact CZ3-CD1 3.4Å; W523-L552 HydrophobicContact CZ3-CG 4.47Å; W523-K580 PolarHBondContact O-NZ 3.25Å
524	T	91.5	Very high	91.9	Very high	15 Å²	15	25.5 Å²	25.5	9%	0.092	15%	0.149	C	C	.	.	S	Bend	trans	-96.7	-29.8	175.6	54.4	0	0	0	0	111.5	S528 L530 L549 V576 K580 V597	T524-S528 PolarHBondContact N-O 3.38Å; T524-S528 PolarHBondContact OG1-O 3.45Å; T524-S528 VanDerWaalsContact OG1-O 3.13Å; T524-S528 PolarHBondContact OG1-OG 3.3Å; T524-L530 HydrophobicContact CG2-CD1 3.5Å; T524-L530 HydrophobicContact CG2-CG 3.72Å; T524-L549 HydrophobicContact CG2-CD1 4.26Å; T524-V576 HydrophobicContact CG2-CG2 4.23Å; T524-K580 WeakPolarHBondContact O-CB 3.26Å; T524-K580 WeakPolarHBondContact O-CG 2.85Å; T524-V597 HydrophobicContact CG2-CG1 3.63Å
525	S	89.1	Confident	91.8	Very high	40 Å²	40	26.1 Å²	26.1	28%	0.28	16%	0.155	S	C	.	.	S	Bend	trans	-143.5	-167.4	170.4	79.6	0	0	0	0	111.1	P474 T527 S528	P474-S525 WeakPolarHBondContact CD-O 2.98Å; P474-S525 WeakPolarHBondContact CG-O 3.28Å; S525-T527 VanDerWaalsContact C-N 3.26Å; S525-T527 PolarHBondContact OG-N 3.37Å; S525-T527 PolarHBondContact OG-OG1 2.79Å; S525-S528 WeakPolarHBondContact CB-OG 3.31Å; S525-S528 PolarHBondContact N-O 3.29Å; S525-S528 PolarHBondContact OG-N 2.8Å; S525-S528 PolarHBondContact OG-OG 3.01Å
526	L	87.6	Confident	91.7	Very high	41 Å²	41	28 Å²	28	22%	0.215	16%	0.163	C	C	.	.	S	Bend	trans	-74.5	-19.7	171	-67.9	167.5	0	0	0	112.6	P474 N480 Y484 W523	P474-L526 HydrophobicContact CB-CD2 4.11Å; P474-L526 HydrophobicContact CG-CD2 4.36Å; N480-L526 HydrophobicContact CB-CD1 3.57Å; Y484-L526 HydrophobicContact CD2-CD2 4.13Å; W523-L526 WeakPolarHBondContact CZ3-O 3.32Å
527	T	89.3	Confident	91.5	Very high	65 Å²	65	30.6 Å²	30.6	40%	0.399	18%	0.18	S	C	.	.	S	Bend	trans	-119.1	-4.4	-174.4	59.4	0	0	0	0	112.6	S525 L552 P553	S525-T527 VanDerWaalsContact C-N 3.26Å; S525-T527 PolarHBondContact OG-N 3.37Å; S525-T527 PolarHBondContact OG-OG1 2.79Å; T527-L552 WeakPolarHBondContact O-CA 3.5Å; T527-L552 WeakPolarHBondContact O-CB 3.16Å; T527-L552 VanDerWaalsContact O-CG 3.27Å; T527-L552 WeakPolarHBondContact O-CG 3.34Å; T527-L552 PolarHBondContact O-N 2.7Å; T527-P553 HydrophobicContact CG2-CG 4.28Å
528	S	92.1	Very high	91.3	Very high	21 Å²	21	31 Å²	31	15%	0.147	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	145	-178.6	58	0	0	0	0	112.5	T524 S525 V550	T524-S528 PolarHBondContact N-O 3.38Å; T524-S528 PolarHBondContact OG1-O 3.45Å; T524-S528 VanDerWaalsContact OG1-O 3.13Å; T524-S528 PolarHBondContact OG1-OG 3.3Å; S525-S528 WeakPolarHBondContact CB-OG 3.31Å; S525-S528 PolarHBondContact N-O 3.29Å; S525-S528 PolarHBondContact OG-N 2.8Å; S525-S528 PolarHBondContact OG-OG 3.01Å; S528-V550 WeakPolarHBondContact CA-O 3.35Å; S528-V550 VanDerWaalsContact CB-O 3.28Å; S528-V550 WeakPolarHBondContact CB-O 3.44Å
529	F	95.2	Very high	90.8	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	157.7	-179	67.7	-94.1	0	0	0	111.6	V497 L511 I513 I521 W523 V550 L552	V497-F529 HydrophobicContact CB-CE2 4.36Å; V497-F529 HydrophobicContact CB-CZ 4.16Å; V497-F529 HydrophobicContact CG1-CE2 3.98Å; V497-F529 HydrophobicContact CG1-CZ 3.76Å; V497-F529 HydrophobicContact CG2-CE2 4.21Å; V497-F529 HydrophobicContact CG2-CZ 4.48Å; L511-F529 HydrophobicContact CD1-CE1 4.41Å; L511-F529 HydrophobicContact CD1-CZ 4.29Å; I513-F529 HydrophobicContact CD1-CE2 4.23Å; I513-F529 HydrophobicContact CD1-CZ 4.02Å; I521-F529 HydrophobicContact CG2-CB 4.27Å; I521-F529 HydrophobicContact CG2-CD2 3.81Å; I521-F529 HydrophobicContact CG2-CG 4.25Å; W523-F529 HydrophobicContact CD2-CB 3.92Å; W523-F529 HydrophobicContact CE3-CB 3.96Å; W523-F529 HydrophobicContact CG-CB 4.21Å; W523-F529 HydrophobicContact CZ3-CD1 4.35Å; F529-V550 HydrophobicContact CD1-CB 4.48Å; F529-V550 HydrophobicContact CD2-CB 4.46Å; F529-V550 HydrophobicContact CE1-CB 4.01Å; F529-V550 HydrophobicContact CE1-CG1 3.94Å; F529-V550 HydrophobicContact CE2-CB 4Å; F529-V550 HydrophobicContact CE2-CG2 4.09Å; F529-V550 HydrophobicContact CZ-CB 3.76Å; F529-V550 HydrophobicContact CZ-CG1 3.84Å; F529-V550 HydrophobicContact CZ-CG2 4.13Å; F529-V550 PolarHBondContact N-O 2.96Å; F529-V550 PolarHBondContact O-N 3.02Å; F529-L552 HydrophobicContact CD1-CD2 4.18Å; F529-L552 HydrophobicContact CD1-CG 4.23Å; F529-L552 HydrophobicContact CE1-CD2 3.63Å; F529-L552 HydrophobicContact CE1-CG 4.14Å
530	L	95	Very high	90.3	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	133.8	169.8	-72.5	161.8	0	0	0	108.9	I521 E522 T524 L547 Q548 L549 F560 I574 V576 L583	I521-L530 CarbonylContact C-O 3.59Å; I521-L530 WeakPolarHBondContact CA-O 3.44Å; E522-L530 PolarHBondContact N-O 3.41Å; E522-L530 PolarHBondContact O-N 3.29Å; T524-L530 HydrophobicContact CG2-CD1 3.5Å; T524-L530 HydrophobicContact CG2-CG 3.72Å; L530-L547 HydrophobicContact CB-CD1 4.5Å; L530-L547 HydrophobicContact CD2-CD1 4.46Å; L530-Q548 WeakPolarHBondContact CA-O 3.47Å; L530-L549 HydrophobicContact CD2-CB 3.7Å; L530-L549 HydrophobicContact CD2-CD1 3.81Å; L530-L549 HydrophobicContact CD2-CG 4.33Å; L530-L549 HydrophobicContact CG-CD1 3.96Å; L530-F560 HydrophobicContact CD2-CB 4.21Å; L530-F560 HydrophobicContact CD2-CD2 3.72Å; L530-F560 HydrophobicContact CD2-CE2 4.27Å; L530-F560 HydrophobicContact CD2-CG 3.98Å; L530-I574 HydrophobicContact CB-CD1 4.18Å; L530-V576 HydrophobicContact CD1-CG2 4.1Å; L530-L583 HydrophobicContact CD1-CD1 3.83Å; L530-L583 HydrophobicContact CD1-CD2 3.78Å; L530-L583 HydrophobicContact CD1-CG 4.35Å
531	S	94.9	Very high	89.8	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	144.5	171.3	56.5	0	0	0	0	110.2	H514 G520 Q548	H514-S531 PolarHBondContact CE1-O 3.38Å; H514-S531 WeakPolarHBondContact NE2-CB 3.3Å; H514-S531 PolarHBondContact NE2-O 2.84Å; H514-S531 PolarHBondContact NE2-OG 3.05Å; G520-S531 WeakPolarHBondContact O-CA 3.49Å; S531-Q548 PolarHBondContact N-O 2.77Å; S531-Q548 PolarHBondContact O-N 3.09Å
532	F	94.1	Very high	89.4	Confident	10 Å²	10	46.5 Å²	46.5	4%	0.044	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	147.2	176.5	78.6	-81.5	0	0	0	113	K519 G520 E546 L547 I571 I574	K519-F532 HydrophobicContact CB-CD2 4.12Å; K519-F532 HydrophobicContact CB-CE2 3.6Å; K519-F532 HydrophobicContact CB-CZ 3.91Å; K519-F532 PolarHBondContact N-O 3.47Å; G520-F532 VanDerWaalsContact CA-CE1 3.42Å; G520-F532 WeakPolarHBondContact O-CD1 3.14Å; G520-F532 PolarHBondContact O-N 2.85Å; G520-F532 VanDerWaalsContact O-N 3.07Å; F532-E546 CarbonylContact C-O 3.57Å; F532-E546 WeakPolarHBondContact CA-O 3.18Å; F532-L547 HydrophobicContact CB-CD1 3.74Å; F532-I571 HydrophobicContact CD2-CB 3.96Å; F532-I571 HydrophobicContact CD2-CG2 3.61Å; F532-I571 HydrophobicContact CE2-CB 4.13Å; F532-I571 HydrophobicContact CE2-CG2 3.63Å; F532-I571 HydrophobicContact CG-CG2 4.25Å; F532-I571 HydrophobicContact CZ-CG2 4.29Å; F532-I574 HydrophobicContact CD1-CB 4.46Å; F532-I574 HydrophobicContact CD1-CD1 3.59Å; F532-I574 HydrophobicContact CD1-CG1 3.69Å; F532-I574 HydrophobicContact CD1-CG2 4.01Å; F532-I574 HydrophobicContact CE1-CD1 4.17Å; F532-I574 HydrophobicContact CE1-CG1 3.77Å; F532-I574 HydrophobicContact CE1-CG2 4.29Å; F532-I574 HydrophobicContact CG-CG2 4.35Å
533	A	92	Very high	89.1	Confident	1 Å²	1	46 Å²	46	1%	0.008	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	148.8	176.3	0	0	0	0	0	109.6	H514 C516 E517 E546	H514-A533 HydrophobicContact CB-CB 3.86Å; C516-A533 HydrophobicContact CB-CB 4.36Å; E517-A533 VanDerWaalsContact O-CB 3.24Å; E517-A533 WeakPolarHBondContact O-CB 3.35Å; A533-E546 HydrophobicContact CB-CB 4.45Å; A533-E546 PolarHBondContact N-O 2.98Å; A533-E546 PolarHBondContact O-N 2.77Å
534	T	90.2	Very high	88.8	Confident	25 Å²	25	52 Å²	52	15%	0.153	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	129.3	177.9	58.2	0	0	0	0	108.9	N545 P570 I571	T534-N545 WeakPolarHBondContact CG2-OD1 3.35Å; T534-P570 HydrophobicContact CG2-CB 4.39Å; T534-I571 HydrophobicContact CG2-CB 4.23Å
535	S	88.4	Confident	88.8	Confident	29 Å²	29	51.7 Å²	51.7	20%	0.203	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-68	170.2	176.8	75.6	0	0	0	0	112.1	V543 R544	S535-V543 VanDerWaalsContact O-CG1 3.24Å; S535-V543 WeakPolarHBondContact O-CG1 3.43Å; S535-R544 PolarHBondContact N-O 3.34Å; S535-R544 PolarHBondContact OG-N 2.83Å
536	T	86.3	Confident	88.9	Confident	124 Å²	124	51 Å²	51	76%	0.761	29%	0.285	S	S	*	.	P	Polyproline II helix	trans	-59.2	138.8	168.4	50.1	0	0	0	0	110.6
537	P	85.6	Confident	89.1	Confident	90 Å²	90	49.3 Å²	49.3	58%	0.584	28%	0.276	S	S	*	.	P	Polyproline II helix	trans	-62.2	139.2	177.9	-18.3	29.5	0	0	0	111.8	L542 V543	P537-L542 WeakPolarHBondContact CA-O 3.33Å; P537-V543 HydrophobicContact CB-CG1 4.04Å; P537-V543 HydrophobicContact CG-CG1 3.97Å
538	N	85.2	Confident	89.3	Confident	60 Å²	60	47.7 Å²	47.7	32%	0.321	26%	0.264	S	S	.	.			trans	-75.4	178.2	168.5	68.7	20.6	0	0	0	110.7	M540 G541 L542 D567	N538-M540 PolarHBondContact O-N 2.9Å; N538-M540 WeakPolarHBondContact OD1-CA 3.31Å; N538-M540 WeakPolarHBondContact OD1-CB 3.44Å; N538-M540 PolarHBondContact OD1-N 3.34Å; N538-G541 PolarHBondContact O-N 3.25Å; N538-G541 PolarHBondContact OD1-N 3.3Å; N538-L542 PolarHBondContact N-O 3.42Å; N538-L542 PolarHBondContact OD1-N 3.02Å; N538-L542 PolarHBondContact OD1-O 3.23Å; N538-D567 PolarHBondContact ND2-OD1 3.29Å
539	N	83.1	Confident	89.4	Confident	176 Å²	176	48.1 Å²	48.1	94%	0.941	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-19.4	-179.2	-68.4	-13.1	0	0	0	113.9
540	M	81.4	Confident	89.4	Confident	158 Å²	158	48.1 Å²	48.1	78%	0.778	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	4.1	177.4	-63	-63.3	-63.2	0	0	112.7	N538 L542	N538-M540 PolarHBondContact O-N 2.9Å; N538-M540 WeakPolarHBondContact OD1-CA 3.31Å; N538-M540 WeakPolarHBondContact OD1-CB 3.44Å; N538-M540 PolarHBondContact OD1-N 3.34Å; M540-L542 HydrophobicContact CB-CD1 4.39Å; M540-L542 HydrophobicContact CB-CG 4.38Å; M540-L542 PolarHBondContact O-N 3.32Å
541	G	81	Confident	89.2	Confident	41 Å²	41	50.6 Å²	50.6	42%	0.423	28%	0.278	S	S	.	.	S	Bend	trans	75.5	5.1	-176.9	0	0	0	0	0	114.7	N538	N538-G541 PolarHBondContact O-N 3.25Å; N538-G541 PolarHBondContact OD1-N 3.3Å
542	L	86.8	Confident	89	Confident	64 Å²	64	51 Å²	51	34%	0.335	28%	0.28	S	S	.	.			trans	-85.7	147.8	177.5	-57.2	169.8	0	0	0	110.3	P537 N538 M540 D567 E568	P537-L542 WeakPolarHBondContact CA-O 3.33Å; N538-L542 PolarHBondContact N-O 3.42Å; N538-L542 PolarHBondContact OD1-N 3.02Å; N538-L542 PolarHBondContact OD1-O 3.23Å; M540-L542 HydrophobicContact CB-CD1 4.39Å; M540-L542 HydrophobicContact CB-CG 4.38Å; M540-L542 PolarHBondContact O-N 3.32Å; L542-D567 HydrophobicContact CB-CB 4.35Å; L542-D567 HydrophobicContact CD1-CB 4.23Å; L542-E568 WeakPolarHBondContact CA-O 3.01Å
543	V	88.7	Confident	88.8	Confident	3 Å²	3	54.4 Å²	54.4	2%	0.018	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-127.3	161.2	-178.3	-61	0	0	0	0	110.8	S535 P537 N545 D567 E568 P570	S535-V543 VanDerWaalsContact O-CG1 3.24Å; S535-V543 WeakPolarHBondContact O-CG1 3.43Å; P537-V543 HydrophobicContact CB-CG1 4.04Å; P537-V543 HydrophobicContact CG-CG1 3.97Å; V543-N545 WeakPolarHBondContact CG2-OD1 3.46Å; V543-D567 PolarHBondContact O-N 3.05Å; V543-E568 WeakPolarHBondContact CG2-O 3.26Å; V543-E568 PolarHBondContact N-O 3.25Å; V543-E568 PolarHBondContact O-N 3.01Å; V543-P570 HydrophobicContact CG1-CB 4.43Å; V543-P570 HydrophobicContact CG2-CB 3.68Å
544	R	88.1	Confident	88.7	Confident	128 Å²	128	59 Å²	59	48%	0.483	33%	0.331	S	S	.	.			trans	-85.8	119.4	163.5	-172.1	175.8	-174.3	177.3	-2.7	109.1	S535 G565 N566	S535-R544 PolarHBondContact N-O 3.34Å; S535-R544 PolarHBondContact OG-N 2.83Å; R544-G565 CarbonylContact C-O 3.57Å; R544-G565 WeakPolarHBondContact CA-O 3.45Å; R544-N566 WeakPolarHBondContact CG-OD1 3.33Å; R544-N566 PolarHBondContact NE-OD1 3.25Å
545	N	90.1	Very high	88.5	Confident	10 Å²	10	59.2 Å²	59.2	5%	0.053	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	117.1	178.3	-72.3	-41.9	0	0	0	109.9	T534 V543 G565 S569 I571	T534-N545 WeakPolarHBondContact CG2-OD1 3.35Å; V543-N545 WeakPolarHBondContact CG2-OD1 3.46Å; N545-G565 PolarHBondContact N-O 2.67Å; N545-S569 PolarHBondContact ND2-O 3.45Å; N545-I571 HydrophobicContact CB-CD1 3.77Å; N545-I571 HydrophobicContact CB-CG1 4.11Å; N545-I571 PolarHBondContact OD1-N 2.87Å
546	E	91.3	Very high	88.6	Confident	25 Å²	25	66.2 Å²	66.2	12%	0.117	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	119.2	174.3	-63.3	-179.2	176.7	0	0	109.4	H514 S515 F532 A533	H514-E546 VanDerWaalsContact CA-OE2 3.31Å; H514-E546 WeakPolarHBondContact CA-OE2 3.3Å; H514-E546 WeakPolarHBondContact CB-OE2 3.46Å; H514-E546 IonicContact CG-OE2 2.66Å; H514-E546 WeakPolarHBondContact ND1-CB 3.39Å; H514-E546 IonicContact ND1-OE2 3.89Å; H514-E546 PolarHBondContact ND1-OE2 3.32Å; H514-E546 VanDerWaalsContact ND1-OE2 3.12Å; S515-E546 PolarHBondContact N-OE2 2.79Å; S515-E546 VanDerWaalsContact N-OE2 3.1Å; S515-E546 PolarHBondContact OG-OE1 3.04Å; F532-E546 CarbonylContact C-O 3.57Å; F532-E546 WeakPolarHBondContact CA-O 3.18Å; A533-E546 HydrophobicContact CB-CB 4.45Å; A533-E546 PolarHBondContact N-O 2.98Å; A533-E546 PolarHBondContact O-N 2.77Å
547	L	93.3	Very high	88.8	Confident	6 Å²	6	63.2 Å²	63.2	3%	0.031	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	116.8	172.6	179.3	67	0	0	0	108.8	L530 F532 F560 R561 I574 L583 V585	L530-L547 HydrophobicContact CB-CD1 4.5Å; L530-L547 HydrophobicContact CD2-CD1 4.46Å; F532-L547 HydrophobicContact CB-CD1 3.74Å; L547-F560 HydrophobicContact CD2-CB 4.07Å; L547-F560 HydrophobicContact CD2-CD1 3.67Å; L547-F560 HydrophobicContact CD2-CG 4.16Å; L547-F560 HydrophobicContact CG-CB 3.93Å; L547-F560 HydrophobicContact CG-CD1 4.43Å; L547-F560 HydrophobicContact CG-CG 4.46Å; L547-F560 PolarHBondContact O-N 2.93Å; L547-R561 HydrophobicContact CD2-CG 4.03Å; L547-I574 HydrophobicContact CD1-CD1 4.09Å; L547-I574 HydrophobicContact CD1-CG2 4.41Å; L547-L583 HydrophobicContact CD2-CD2 4.03Å; L547-V585 HydrophobicContact CD2-CG2 4.22Å
548	Q	93.3	Very high	89	Confident	31 Å²	31	62.7 Å²	62.7	15%	0.145	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	132.3	-171.7	-62.8	-70	-20.3	0	0	110.2	I513 L530 S531 V550 I558 A559	I513-Q548 HydrophobicContact CG2-CB 3.49Å; I513-Q548 VanDerWaalsContact CG2-CB 3.49Å; I513-Q548 HydrophobicContact CG2-CG 3.59Å; L530-Q548 WeakPolarHBondContact CA-O 3.47Å; S531-Q548 PolarHBondContact N-O 2.77Å; S531-Q548 PolarHBondContact O-N 3.09Å; Q548-V550 HydrophobicContact CB-CG2 4.49Å; Q548-I558 WeakPolarHBondContact CA-O 3.37Å; Q548-I558 PolarHBondContact OE1-O 3.04Å; Q548-A559 VanDerWaalsContact OE1-CA 3.3Å; Q548-A559 VanDerWaalsContact OE1-N 3.09Å
549	L	93.9	Very high	89.3	Confident	29 Å²	29	62 Å²	62	15%	0.152	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	122.2	169.1	177.5	65.1	0	0	0	108.6	T524 L530 S557 I558 F560	T524-L549 HydrophobicContact CG2-CD1 4.26Å; L530-L549 HydrophobicContact CD2-CB 3.7Å; L530-L549 HydrophobicContact CD2-CD1 3.81Å; L530-L549 HydrophobicContact CD2-CG 4.33Å; L530-L549 HydrophobicContact CG-CD1 3.96Å; L549-S557 CarbonylContact O-C 3.59Å; L549-S557 WeakPolarHBondContact O-CA 3.46Å; L549-I558 PolarHBondContact N-O 2.69Å; L549-I558 PolarHBondContact O-N 3.43Å; L549-F560 HydrophobicContact CB-CD2 4.17Å; L549-F560 HydrophobicContact CD2-CD2 4.43Å
550	V	94.5	Very high	89.5	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.006	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	131.2	-173.9	-178.5	0	0	0	0	110	L511 I513 S528 F529 Q548 R556	L511-V550 HydrophobicContact CD1-CG1 3.71Å; I513-V550 HydrophobicContact CD1-CG1 4.48Å; I513-V550 HydrophobicContact CD1-CG2 3.75Å; I513-V550 HydrophobicContact CG1-CG2 4.05Å; I513-V550 HydrophobicContact CG2-CG2 4.18Å; S528-V550 WeakPolarHBondContact CA-O 3.35Å; S528-V550 VanDerWaalsContact CB-O 3.28Å; S528-V550 WeakPolarHBondContact CB-O 3.44Å; F529-V550 HydrophobicContact CD1-CB 4.48Å; F529-V550 HydrophobicContact CD2-CB 4.46Å; F529-V550 HydrophobicContact CE1-CB 4.01Å; F529-V550 HydrophobicContact CE1-CG1 3.94Å; F529-V550 HydrophobicContact CE2-CB 4Å; F529-V550 HydrophobicContact CE2-CG2 4.09Å; F529-V550 HydrophobicContact CZ-CB 3.76Å; F529-V550 HydrophobicContact CZ-CG1 3.84Å; F529-V550 HydrophobicContact CZ-CG2 4.13Å; F529-V550 PolarHBondContact N-O 2.96Å; F529-V550 PolarHBondContact O-N 3.02Å; Q548-V550 HydrophobicContact CB-CG2 4.49Å; V550-R556 WeakPolarHBondContact CA-O 3.49Å
551	D	92.2	Very high	89.8	Confident	52 Å²	52	47 Å²	47	28%	0.278	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	119.1	170.4	179.5	48.8	0	0	0	110.1	P553 T554 G555 R556	D551-P553 VanDerWaalsContact OD1-CD 3.26Å; D551-P553 WeakPolarHBondContact OD1-CD 3.48Å; D551-T554 WeakPolarHBondContact OD2-CB 3.36Å; D551-T554 VanDerWaalsContact OD2-CG2 3.31Å; D551-T554 WeakPolarHBondContact OD2-CG2 3.49Å; D551-T554 PolarHBondContact OD2-OG1 3.42Å; D551-G555 VanDerWaalsContact O-CA 3.25Å; D551-G555 WeakPolarHBondContact O-CA 3.43Å; D551-G555 PolarHBondContact O-N 2.97Å; D551-R556 PolarHBondContact N-O 3.34Å; D551-R556 PolarHBondContact O-N 3.17Å
552	L	90.6	Very high	89.8	Confident	7 Å²	7	47.4 Å²	47.4	4%	0.037	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-48.2	-172.4	-73.9	173.2	0	0	0	113.9	L487 V499 K509 L511 W523 T527 F529 T554 G555	L487-L552 HydrophobicContact CD1-CD1 4.23Å; V499-L552 HydrophobicContact CG1-CD2 4.45Å; V499-L552 HydrophobicContact CG2-CD2 3.76Å; K509-L552 WeakPolarHBondContact CD-O 3.31Å; K509-L552 VanDerWaalsContact CE-O 3.31Å; K509-L552 WeakPolarHBondContact CE-O 3.49Å; K509-L552 PolarHBondContact NZ-O 2.96Å; L511-L552 HydrophobicContact CD1-CD2 4.17Å; W523-L552 HydrophobicContact CH2-CD1 3.45Å; W523-L552 VanDerWaalsContact CH2-CD1 3.45Å; W523-L552 HydrophobicContact CZ3-CD1 3.4Å; W523-L552 HydrophobicContact CZ3-CG 4.47Å; T527-L552 WeakPolarHBondContact O-CA 3.5Å; T527-L552 WeakPolarHBondContact O-CB 3.16Å; T527-L552 VanDerWaalsContact O-CG 3.27Å; T527-L552 WeakPolarHBondContact O-CG 3.34Å; T527-L552 PolarHBondContact O-N 2.7Å; F529-L552 HydrophobicContact CD1-CD2 4.18Å; F529-L552 HydrophobicContact CD1-CG 4.23Å; F529-L552 HydrophobicContact CE1-CD2 3.63Å; F529-L552 HydrophobicContact CE1-CG 4.14Å; L552-T554 VanDerWaalsContact C-N 3.34Å; L552-T554 PolarHBondContact O-N 3.07Å; L552-G555 PolarHBondContact O-N 3.01Å
553	P	89.7	Confident	88.8	Confident	83 Å²	83	53 Å²	53	54%	0.539	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-45.1	-176.1	-23.7	36.5	0	0	0	111.2	K509 T527 D551	K509-P553 PolarHBondContact NZ-O 3.05Å; T527-P553 HydrophobicContact CG2-CG 4.28Å; D551-P553 VanDerWaalsContact OD1-CD 3.26Å; D551-P553 WeakPolarHBondContact OD1-CD 3.48Å
554	T	88.4	Confident	87.7	Confident	97 Å²	97	61.1 Å²	61.1	60%	0.595	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-23.5	-179.4	62.2	0	0	0	0	113.7	D551 L552 R556	D551-T554 WeakPolarHBondContact OD2-CB 3.36Å; D551-T554 VanDerWaalsContact OD2-CG2 3.31Å; D551-T554 WeakPolarHBondContact OD2-CG2 3.49Å; D551-T554 PolarHBondContact OD2-OG1 3.42Å; L552-T554 VanDerWaalsContact C-N 3.34Å; L552-T554 PolarHBondContact O-N 3.07Å; T554-R556 PolarHBondContact O-N 3.26Å; T554-R556 WeakPolarHBondContact OG1-CB 3.38Å; T554-R556 PolarHBondContact OG1-N 3.19Å
555	G	87.2	Confident	86.4	Confident	30 Å²	30	55.2 Å²	55.2	31%	0.309	30%	0.298	S	S	.	.			trans	70.2	9.7	-171.3	0	0	0	0	0	113.6	D551 L552	D551-G555 VanDerWaalsContact O-CA 3.25Å; D551-G555 WeakPolarHBondContact O-CA 3.43Å; D551-G555 PolarHBondContact O-N 2.97Å; L552-G555 PolarHBondContact O-N 3.01Å
556	R	89.5	Confident	85.3	Confident	176 Å²	176	59.1 Å²	59.1	66%	0.664	32%	0.319	S	S	*	.			trans	-77	128.1	-177.6	-172.9	178.1	179.6	179.3	-0.1	110.3	V550 D551 T554	V550-R556 WeakPolarHBondContact CA-O 3.49Å; D551-R556 PolarHBondContact N-O 3.34Å; D551-R556 PolarHBondContact O-N 3.17Å; T554-R556 PolarHBondContact O-N 3.26Å; T554-R556 WeakPolarHBondContact OG1-CB 3.38Å; T554-R556 PolarHBondContact OG1-N 3.19Å
557	S	91.1	Very high	84.8	Confident	61 Å²	61	62.9 Å²	62.9	43%	0.427	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	135.8	171.8	59.2	0	0	0	0	111.4	L549	L549-S557 CarbonylContact O-C 3.59Å; L549-S557 WeakPolarHBondContact O-CA 3.46Å
558	I	90.9	Very high	84.5	Confident	78 Å²	78	64.1 Å²	64.1	40%	0.4	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	129.5	177.6	-58	171.9	0	0	0	108.8	Q548 L549 F560	Q548-I558 WeakPolarHBondContact CA-O 3.37Å; Q548-I558 PolarHBondContact OE1-O 3.04Å; L549-I558 PolarHBondContact N-O 2.69Å; L549-I558 PolarHBondContact O-N 3.43Å; I558-F560 PolarHBondContact O-N 2.69Å
559	A	90.3	Very high	84.3	Confident	47 Å²	47	63.2 Å²	63.2	39%	0.388	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	105.5	174.3	0	0	0	0	0	110	Q548 R561 G562	Q548-A559 VanDerWaalsContact OE1-CA 3.3Å; Q548-A559 VanDerWaalsContact OE1-N 3.09Å; A559-R561 PolarHBondContact O-N 2.94Å; A559-G562 PolarHBondContact O-N 3.46Å; A559-G562 VanDerWaalsContact O-N 3.15Å
560	F	87.8	Confident	84.1	Confident	5 Å²	5	63 Å²	63	2%	0.022	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-36.3	-169.4	-171.3	-91.8	0	0	0	112.8	L530 L547 L549 I558 L583 W595 C600	L530-F560 HydrophobicContact CD2-CB 4.21Å; L530-F560 HydrophobicContact CD2-CD2 3.72Å; L530-F560 HydrophobicContact CD2-CE2 4.27Å; L530-F560 HydrophobicContact CD2-CG 3.98Å; L547-F560 HydrophobicContact CD2-CB 4.07Å; L547-F560 HydrophobicContact CD2-CD1 3.67Å; L547-F560 HydrophobicContact CD2-CG 4.16Å; L547-F560 HydrophobicContact CG-CB 3.93Å; L547-F560 HydrophobicContact CG-CD1 4.43Å; L547-F560 HydrophobicContact CG-CG 4.46Å; L547-F560 PolarHBondContact O-N 2.93Å; L549-F560 HydrophobicContact CB-CD2 4.17Å; L549-F560 HydrophobicContact CD2-CD2 4.43Å; I558-F560 PolarHBondContact O-N 2.69Å; F560-L583 HydrophobicContact CD1-CD2 4.04Å; F560-L583 HydrophobicContact CE1-CD2 3.53Å; F560-L583 HydrophobicContact CZ-CD2 3.92Å; F560-W595 HydrophobicContact CD1-CD2 4.46Å; F560-W595 HydrophobicContact CD1-CE3 4.29Å; F560-W595 HydrophobicContact CE1-CB 3.71Å; F560-W595 AromaticContact CE1-CD2 3.84Å; F560-W595 HydrophobicContact CE1-CD2 3.84Å; F560-W595 AromaticContact CE1-CE3 3.77Å; F560-W595 HydrophobicContact CE1-CE3 3.77Å; F560-W595 AromaticContact CE1-CG 3.83Å; F560-W595 HydrophobicContact CE1-CG 3.83Å; F560-W595 HydrophobicContact CZ-CB 4.05Å; F560-C600 HydrophobicContact CD2-CB 4.13Å; F560-C600 VanDerWaalsContact CD2-SG 3.6Å; F560-C600 HydrophobicContact CE2-CB 3.99Å; F560-C600 VanDerWaalsContact CE2-SG 3.51Å
561	R	88	Confident	84	Confident	14 Å²	14	63.3 Å²	63.3	5%	0.053	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95	5.1	176.8	-66.4	177.5	75.5	-129.1	-4.7	113.5	L547 A559 R564 E568 F587 E593 W595	L547-R561 HydrophobicContact CD2-CG 4.03Å; A559-R561 PolarHBondContact O-N 2.94Å; R561-R564 PolarHBondContact O-N 3.2Å; R561-E568 IonicContact CZ-OE2 2.85Å; R561-E568 VanDerWaalsContact CZ-OE2 3.31Å; R561-E568 IonicContact NH1-OE2 3.46Å; R561-E568 PolarHBondContact NH1-OE2 3.44Å; R561-E568 IonicContact NH2-OE1 3.4Å; R561-E568 PolarHBondContact NH2-OE1 3.39Å; R561-E568 IonicContact NH2-OE2 2.8Å; R561-E568 PolarHBondContact NH2-OE2 2.93Å; R561-F587 VanDerWaalsContact CZ-CZ 3.49Å; R561-E593 IonicContact CZ-OE1 2.72Å; R561-E593 IonicContact CZ-OE2 2.7Å; R561-E593 IonicContact NE-OE2 3.16Å; R561-E593 PolarHBondContact NE-OE2 3.05Å; R561-E593 IonicContact NH2-OE1 3.31Å; R561-E593 PolarHBondContact NH2-OE1 3.26Å; R561-E593 IonicContact NH2-OE2 3.8Å; R561-E593 PolarHBondContact NH2-OE2 2.9Å; R561-E593 VanDerWaalsContact NH2-OE2 3.16Å; R561-W595 HydrophobicContact CB-CH2 4.31Å; R561-W595 HydrophobicContact CB-CZ2 4.38Å; R561-W595 HydrophobicContact CG-CH2 4.08Å; R561-W595 HydrophobicContact CG-CZ2 3.77Å
562	G	80.3	Confident	83.8	Confident	48 Å²	48	66.2 Å²	66.2	50%	0.495	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.7	-142.9	-173	0	0	0	0	0	112.7	A559 R564	A559-G562 PolarHBondContact O-N 3.46Å; A559-G562 VanDerWaalsContact O-N 3.15Å; G562-R564 VanDerWaalsContact C-N 3.29Å; G562-R564 PolarHBondContact O-N 3.31Å
563	E	65.4	Low	83.8	Confident	183 Å²	183	67.8 Å²	67.8	86%	0.855	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	1.6	-179.9	-63.8	-172.1	166	0	0	114.6	G565	E563-G565 PolarHBondContact O-N 2.84Å
564	R	66.4	Low	84.1	Confident	173 Å²	173	64.1 Å²	64.1	65%	0.653	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	1	-175.3	-68.7	-176.3	174.1	-134.4	-0.7	115	R561 G562 E568	R561-R564 PolarHBondContact O-N 3.2Å; G562-R564 VanDerWaalsContact C-N 3.29Å; G562-R564 PolarHBondContact O-N 3.31Å; R564-E568 VanDerWaalsContact O-CD 3.25Å
565	G	60.5	Low	84.3	Confident	4 Å²	4	60.8 Å²	60.8	4%	0.041	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	15.9	-168.8	0	0	0	0	0	116.7	R544 N545 E563	R544-G565 CarbonylContact C-O 3.57Å; R544-G565 WeakPolarHBondContact CA-O 3.45Å; N545-G565 PolarHBondContact N-O 2.67Å; E563-G565 PolarHBondContact O-N 2.84Å
566	N	67.6	Low	84.5	Confident	91 Å²	91	60 Å²	60	49%	0.487	31%	0.307	S	S	.	.	S	Bend	trans	-94.4	129.4	176.5	-64.9	-19.6	0	0	0	110.1	R544	R544-N566 WeakPolarHBondContact CG-OD1 3.33Å; R544-N566 PolarHBondContact NE-OD1 3.25Å
567	D	79.3	Confident	84.6	Confident	104 Å²	104	51.7 Å²	51.7	56%	0.556	28%	0.275	S	S	*	.	S	Bend	trans	57.5	57.2	-179.6	-62	-39.1	0	0	0	115.3	N538 L542 V543	N538-D567 PolarHBondContact ND2-OD1 3.29Å; L542-D567 HydrophobicContact CB-CB 4.35Å; L542-D567 HydrophobicContact CD1-CB 4.23Å; V543-D567 PolarHBondContact O-N 3.05Å
568	E	87.4	Confident	84.3	Confident	32 Å²	32	53.3 Å²	53.3	15%	0.15	28%	0.276	C	S	.	.	B	Isolated β-bridge	trans	-118.9	170.3	174.8	-68.2	-167.2	131.1	0	0	112.3	L542 V543 R561 R564 K590	L542-E568 WeakPolarHBondContact CA-O 3.01Å; V543-E568 WeakPolarHBondContact CG2-O 3.26Å; V543-E568 PolarHBondContact N-O 3.25Å; V543-E568 PolarHBondContact O-N 3.01Å; R561-E568 IonicContact CZ-OE2 2.85Å; R561-E568 VanDerWaalsContact CZ-OE2 3.31Å; R561-E568 IonicContact NH1-OE2 3.46Å; R561-E568 PolarHBondContact NH1-OE2 3.44Å; R561-E568 IonicContact NH2-OE1 3.4Å; R561-E568 PolarHBondContact NH2-OE1 3.39Å; R561-E568 IonicContact NH2-OE2 2.8Å; R561-E568 PolarHBondContact NH2-OE2 2.93Å; R564-E568 VanDerWaalsContact O-CD 3.25Å; E568-K590 IonicContact OE1-NZ 2.73Å; E568-K590 PolarHBondContact OE1-NZ 3.32Å
569	S	89.1	Confident	84	Confident	13 Å²	13	51.8 Å²	51.8	9%	0.091	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-61.3	146.4	167.5	59.9	0	0	0	0	110.8	N545 F587 K590	N545-S569 PolarHBondContact ND2-O 3.45Å; S569-F587 WeakPolarHBondContact O-CD1 3.44Å; S569-F587 WeakPolarHBondContact OG-CB 3.46Å; S569-K590 WeakPolarHBondContact OG-CB 3.41Å; S569-K590 PolarHBondContact OG-N 2.77Å
570	P	89.7	Confident	83.9	Confident	24 Å²	24	52.8 Å²	52.8	16%	0.156	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-63.1	141.9	-177.2	24.6	-33.2	0	0	0	113	T534 V543 E572 F587 K588	T534-P570 HydrophobicContact CG2-CB 4.39Å; V543-P570 HydrophobicContact CG1-CB 4.43Å; V543-P570 HydrophobicContact CG2-CB 3.68Å; P570-E572 PolarHBondContact O-N 3.46Å; P570-F587 WeakPolarHBondContact O-CA 3.33Å; P570-K588 HydrophobicContact CG-CB 3.97Å; P570-K588 HydrophobicContact CG-CD 4.15Å; P570-K588 PolarHBondContact O-N 3.17Å
571	I	91.8	Very high	83.8	Confident	8 Å²	8	54 Å²	54	4%	0.041	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	122.5	167.4	-64.1	170	0	0	0	108.2	F532 T534 N545 I574 V585 F587	F532-I571 HydrophobicContact CD2-CB 3.96Å; F532-I571 HydrophobicContact CD2-CG2 3.61Å; F532-I571 HydrophobicContact CE2-CB 4.13Å; F532-I571 HydrophobicContact CE2-CG2 3.63Å; F532-I571 HydrophobicContact CG-CG2 4.25Å; F532-I571 HydrophobicContact CZ-CG2 4.29Å; T534-I571 HydrophobicContact CG2-CB 4.23Å; N545-I571 HydrophobicContact CB-CD1 3.77Å; N545-I571 HydrophobicContact CB-CG1 4.11Å; N545-I571 PolarHBondContact OD1-N 2.87Å; I571-I574 HydrophobicContact CG2-CG2 3.96Å; I571-V585 HydrophobicContact CD1-CG1 4.15Å; I571-V585 HydrophobicContact CG1-CG1 4.11Å; I571-V585 HydrophobicContact CG2-CG1 4.21Å; I571-F587 HydrophobicContact CD1-CE1 4.3Å; I571-F587 HydrophobicContact CG1-CD1 3.79Å; I571-F587 HydrophobicContact CG1-CE1 3.48Å; I571-F587 VanDerWaalsContact CG1-CE1 3.48Å; I571-F587 HydrophobicContact CG1-CZ 4.34Å
572	E	89	Confident	84	Confident	112 Å²	112	53.4 Å²	53.4	52%	0.523	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	-44.2	176.8	-77.3	-72.6	161.8	0	0	110.9	P570 V586 K588	P570-E572 PolarHBondContact O-N 3.46Å; E572-V586 PolarHBondContact N-O 3.13Å; E572-K588 HydrophobicContact CG-CB 3.92Å
573	M	91.3	Very high	84.6	Confident	40 Å²	40	51.1 Å²	51.1	20%	0.197	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	152.4	-178.7	62.9	-177.4	-49	0	0	113	K575 V586 L616	M573-K575 HydrophobicContact CE-CD 4.2Å; M573-K575 HydrophobicContact CE-CG 3.81Å; M573-V586 HydrophobicContact CG-CB 3.58Å; M573-V586 HydrophobicContact CG-CG1 4.18Å; M573-V586 HydrophobicContact CG-CG2 3.72Å; M573-V586 PolarHBondContact N-O 3.32Å; M573-V586 PolarHBondContact O-N 3.5Å; M573-V586 HydrophobicContact SD-CG2 4.25Å; M573-L616 HydrophobicContact CE-CB 4.21Å; M573-L616 HydrophobicContact SD-CB 4.3Å
574	I	94.3	Very high	86	Confident	7 Å²	7	42.4 Å²	42.4	4%	0.036	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	140.3	170	65.5	170.8	0	0	0	110	E522 L530 F532 L547 I571 L583 A584 V585	E522-I574 HydrophobicContact CB-CD1 4.29Å; E522-I574 HydrophobicContact CB-CG1 4.47Å; E522-I574 HydrophobicContact CG-CD1 4.48Å; E522-I574 HydrophobicContact CG-CG1 4.15Å; L530-I574 HydrophobicContact CB-CD1 4.18Å; F532-I574 HydrophobicContact CD1-CB 4.46Å; F532-I574 HydrophobicContact CD1-CD1 3.59Å; F532-I574 HydrophobicContact CD1-CG1 3.69Å; F532-I574 HydrophobicContact CD1-CG2 4.01Å; F532-I574 HydrophobicContact CE1-CD1 4.17Å; F532-I574 HydrophobicContact CE1-CG1 3.77Å; F532-I574 HydrophobicContact CE1-CG2 4.29Å; F532-I574 HydrophobicContact CG-CG2 4.35Å; L547-I574 HydrophobicContact CD1-CD1 4.09Å; L547-I574 HydrophobicContact CD1-CG2 4.41Å; I571-I574 HydrophobicContact CG2-CG2 3.96Å; I574-L583 HydrophobicContact CB-CD1 4.24Å; I574-A584 WeakPolarHBondContact CA-O 3.48Å; I574-V585 HydrophobicContact CG2-CG1 4.39Å; I574-V585 HydrophobicContact CG2-CG2 4.42Å
575	K	92.9	Very high	87.2	Confident	27 Å²	27	34.2 Å²	34.2	12%	0.117	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	115	177.9	-70.1	-71.9	-176.5	158.4	0	111	M573 A584 L616 E617 W618	M573-K575 HydrophobicContact CE-CD 4.2Å; M573-K575 HydrophobicContact CE-CG 3.81Å; K575-A584 PolarHBondContact N-O 2.66Å; K575-A584 PolarHBondContact O-N 3.18Å; K575-L616 HydrophobicContact CB-CD2 3.71Å; K575-L616 VanDerWaalsContact CE-O 3.22Å; K575-L616 WeakPolarHBondContact CE-O 3.35Å; K575-L616 HydrophobicContact CG-CD2 3.79Å; K575-E617 IonicContact NZ-OE2 3.72Å; K575-E617 PolarHBondContact NZ-OE2 3.49Å; K575-W618 PolarHBondContact O-NE1 3.28Å; K575-W618 VanDerWaalsContact O-NE1 3.09Å
576	V	92.8	Very high	88.8	Confident	14 Å²	14	34.3 Å²	34.3	9%	0.085	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	134.2	172.6	-173.5	0	0	0	0	109.1	E522 T524 L530 K580 L583	E522-V576 HydrophobicContact CB-CG2 3.78Å; T524-V576 HydrophobicContact CG2-CG2 4.23Å; L530-V576 HydrophobicContact CD1-CG2 4.1Å; V576-K580 HydrophobicContact CB-CD 4.42Å; V576-K580 HydrophobicContact CG1-CB 4.35Å; V576-K580 HydrophobicContact CG1-CD 3.5Å; V576-L583 HydrophobicContact CG2-CD1 3.76Å
577	S	90.9	Very high	89.9	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.151	C	C	.	.			trans	-54.3	159.1	174.4	57.3	0	0	0	0	114	L579 K580 Q581 Y582 E677	S577-L579 VanDerWaalsContact C-N 3.31Å; S577-L579 PolarHBondContact O-N 2.86Å; S577-K580 PolarHBondContact O-N 2.92Å; S577-K580 PolarHBondContact OG-N 3Å; S577-Q581 PolarHBondContact OG-N 3.24Å; S577-Y582 WeakPolarHBondContact CB-O 3.3Å; S577-Y582 PolarHBondContact N-O 3.29Å; S577-Y582 PolarHBondContact OG-N 3.39Å; S577-Y582 PolarHBondContact OG-O 3.41Å; S577-E677 VanDerWaalsContact CB-OE2 3.3Å; S577-E677 WeakPolarHBondContact CB-OE2 3.27Å; S577-E677 PolarHBondContact OG-OE2 3.39Å
578	H	85.3	Confident	90.2	Very high	95 Å²	95	31.5 Å²	31.5	44%	0.44	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-38.8	-177.2	-169.1	78.7	0	0	0	111.8	K580 S619 H622 E677	H578-K580 VanDerWaalsContact C-N 3.28Å; H578-S619 WeakPolarHBondContact CB-O 3.31Å; H578-H622 AromaticContact CD2-ND1 3.86Å; H578-E677 PolarHBondContact N-OE1 3.3Å
579	L	84.6	Confident	90	Very high	47 Å²	47	36.3 Å²	36.3	25%	0.246	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	3.5	175	-63.4	178.7	0	0	0	114	S577 Q581 H622 L624 A675 E677	S577-L579 VanDerWaalsContact C-N 3.31Å; S577-L579 PolarHBondContact O-N 2.86Å; L579-Q581 HydrophobicContact CB-CG 4.03Å; L579-Q581 PolarHBondContact O-N 2.72Å; L579-H622 HydrophobicContact CD1-CB 4.08Å; L579-H622 HydrophobicContact CG-CB 4.47Å; L579-L624 HydrophobicContact CD1-CD2 4.24Å; L579-A675 HydrophobicContact CD1-CB 3.5Å; L579-E677 WeakPolarHBondContact CB-OE1 3.11Å; L579-E677 HydrophobicContact CD1-CG 3.96Å; L579-E677 HydrophobicContact CG-CG 4.32Å; L579-E677 WeakPolarHBondContact CG-OE1 3.46Å; L579-E677 PolarHBondContact N-OE1 2.9Å
580	K	87.6	Confident	89.9	Confident	68 Å²	68	37.9 Å²	37.9	30%	0.296	18%	0.182	S	C	.	.	S	Bend	trans	60.8	26.6	178.9	-48.8	-64.3	-179.9	176.4	0	113.9	W523 T524 V576 S577 H578	W523-K580 PolarHBondContact O-NZ 3.25Å; T524-K580 WeakPolarHBondContact O-CB 3.26Å; T524-K580 WeakPolarHBondContact O-CG 2.85Å; V576-K580 HydrophobicContact CB-CD 4.42Å; V576-K580 HydrophobicContact CG1-CB 4.35Å; V576-K580 HydrophobicContact CG1-CD 3.5Å; S577-K580 PolarHBondContact O-N 2.92Å; S577-K580 PolarHBondContact OG-N 3Å; H578-K580 VanDerWaalsContact C-N 3.28Å
581	Q	86.5	Confident	89.8	Confident	31 Å²	31	37.9 Å²	37.9	15%	0.145	18%	0.182	C	C	.	.	S	Bend	trans	-92.7	-44.4	179.3	-60.3	-174.5	6.8	0	0	111.7	S577 L579 V597	S577-Q581 PolarHBondContact OG-N 3.24Å; L579-Q581 HydrophobicContact CB-CG 4.03Å; L579-Q581 PolarHBondContact O-N 2.72Å; Q581-V597 PolarHBondContact O-N 2.99Å
582	Y	91.1	Very high	89.8	Confident	1 Å²	1	37.7 Å²	37.7	0%	0.004	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	155	-178.1	-50.8	-65.6	0	0	0	113.2	S577 W595 L603 W618 S674 E677 V693 G695	S577-Y582 WeakPolarHBondContact CB-O 3.3Å; S577-Y582 PolarHBondContact N-O 3.29Å; S577-Y582 PolarHBondContact OG-N 3.39Å; S577-Y582 PolarHBondContact OG-O 3.41Å; Y582-W595 CarbonylContact C-O 3.59Å; Y582-W595 VanDerWaalsContact CA-O 3.26Å; Y582-W595 WeakPolarHBondContact CA-O 3.45Å; Y582-L603 HydrophobicContact CD1-CD1 3.4Å; Y582-L603 VanDerWaalsContact CD1-CD1 3.4Å; Y582-L603 HydrophobicContact CE1-CD1 3.52Å; Y582-W618 HydrophobicContact CD2-CH2 4.25Å; Y582-W618 HydrophobicContact CD2-CZ3 4.41Å; Y582-W618 HydrophobicContact CG-CH2 4.38Å; Y582-S674 WeakPolarHBondContact OH-CB 3.22Å; Y582-S674 PolarHBondContact OH-OG 3.09Å; Y582-E677 HydrophobicContact CD2-CB 4.5Å; Y582-E677 VanDerWaalsContact CD2-OE2 3.31Å; Y582-E677 WeakPolarHBondContact CD2-OE2 3.44Å; Y582-E677 HydrophobicContact CE2-CB 4.48Å; Y582-V693 HydrophobicContact CD1-CG1 4.33Å; Y582-V693 HydrophobicContact CD2-CG1 3.99Å; Y582-V693 HydrophobicContact CE1-CG1 4.17Å; Y582-V693 HydrophobicContact CE2-CG1 3.8Å; Y582-V693 HydrophobicContact CG-CG1 4.22Å; Y582-G695 PolarHBondContact OH-N 2.72Å
583	L	93.4	Very high	89.9	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	128.4	170	176.8	73.5	0	0	0	109.4	L530 L547 F560 I574 V576 V585 L594 W595 V597	L530-L583 HydrophobicContact CD1-CD1 3.83Å; L530-L583 HydrophobicContact CD1-CD2 3.78Å; L530-L583 HydrophobicContact CD1-CG 4.35Å; L547-L583 HydrophobicContact CD2-CD2 4.03Å; F560-L583 HydrophobicContact CD1-CD2 4.04Å; F560-L583 HydrophobicContact CE1-CD2 3.53Å; F560-L583 HydrophobicContact CZ-CD2 3.92Å; I574-L583 HydrophobicContact CB-CD1 4.24Å; V576-L583 HydrophobicContact CG2-CD1 3.76Å; L583-V585 HydrophobicContact CD2-CG2 3.81Å; L583-V585 HydrophobicContact CG-CG2 4.01Å; L583-L594 WeakPolarHBondContact O-CA 3.1Å; L583-W595 HydrophobicContact CB-CB 4.29Å; L583-W595 PolarHBondContact N-O 3.31Å; L583-W595 PolarHBondContact O-N 2.78Å; L583-V597 HydrophobicContact CB-CG2 3.71Å
584	A	93.4	Very high	89.9	Confident	0 Å²	0	31 Å²	31	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	126.8	168.1	0	0	0	0	0	109.3	I574 K575 L592 L616 W618	I574-A584 WeakPolarHBondContact CA-O 3.48Å; K575-A584 PolarHBondContact N-O 2.66Å; K575-A584 PolarHBondContact O-N 3.18Å; A584-L592 HydrophobicContact CB-CD1 3.91Å; A584-L616 HydrophobicContact CB-CD1 4.4Å; A584-L616 HydrophobicContact CB-CD2 4.27Å; A584-W618 HydrophobicContact CB-CZ2 4.26Å
585	V	93.2	Very high	89.8	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	114	175.8	-175.8	0	0	0	0	108.3	L547 I571 I574 L583 F587 L592 E593	L547-V585 HydrophobicContact CD2-CG2 4.22Å; I571-V585 HydrophobicContact CD1-CG1 4.15Å; I571-V585 HydrophobicContact CG1-CG1 4.11Å; I571-V585 HydrophobicContact CG2-CG1 4.21Å; I574-V585 HydrophobicContact CG2-CG1 4.39Å; I574-V585 HydrophobicContact CG2-CG2 4.42Å; L583-V585 HydrophobicContact CD2-CG2 3.81Å; L583-V585 HydrophobicContact CG-CG2 4.01Å; V585-F587 HydrophobicContact CB-CE2 4.44Å; V585-F587 HydrophobicContact CG1-CE1 4.23Å; V585-F587 HydrophobicContact CG1-CE2 3.92Å; V585-F587 HydrophobicContact CG1-CZ 3.65Å; V585-L592 VanDerWaalsContact O-CD1 3.29Å; V585-L592 WeakPolarHBondContact O-CD1 3.42Å; V585-E593 HydrophobicContact CB-CB 4.38Å; V585-E593 PolarHBondContact N-O 3.01Å; V585-E593 PolarHBondContact O-N 2.77Å
586	V	92.6	Very high	89.7	Confident	6 Å²	6	30.6 Å²	30.6	4%	0.036	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	133.6	-177.8	-178.3	0	0	0	0	109.1	E572 M573 L592 I613 L616	E572-V586 PolarHBondContact N-O 3.13Å; M573-V586 HydrophobicContact CG-CB 3.58Å; M573-V586 HydrophobicContact CG-CG1 4.18Å; M573-V586 HydrophobicContact CG-CG2 3.72Å; M573-V586 PolarHBondContact N-O 3.32Å; M573-V586 PolarHBondContact O-N 3.5Å; M573-V586 HydrophobicContact SD-CG2 4.25Å; V586-L592 HydrophobicContact CB-CD1 4.39Å; V586-L592 HydrophobicContact CG2-CD1 3.49Å; V586-L592 VanDerWaalsContact CG2-CD1 3.49Å; V586-I613 HydrophobicContact CG1-CB 4.02Å; V586-I613 HydrophobicContact CG1-CD1 4.3Å; V586-I613 HydrophobicContact CG1-CG2 4.4Å; V586-I613 HydrophobicContact CG2-CD1 4.14Å; V586-L616 HydrophobicContact CG2-CD1 4.32Å
587	F	90.8	Very high	89.5	Confident	10 Å²	10	30.5 Å²	30.5	4%	0.044	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	162.6	175.4	-54.9	-90	0	0	0	110.6	R561 S569 P570 I571 V585 K590 E593	R561-F587 VanDerWaalsContact CZ-CZ 3.49Å; S569-F587 WeakPolarHBondContact O-CD1 3.44Å; S569-F587 WeakPolarHBondContact OG-CB 3.46Å; P570-F587 WeakPolarHBondContact O-CA 3.33Å; I571-F587 HydrophobicContact CD1-CE1 4.3Å; I571-F587 HydrophobicContact CG1-CD1 3.79Å; I571-F587 HydrophobicContact CG1-CE1 3.48Å; I571-F587 VanDerWaalsContact CG1-CE1 3.48Å; I571-F587 HydrophobicContact CG1-CZ 4.34Å; V585-F587 HydrophobicContact CB-CE2 4.44Å; V585-F587 HydrophobicContact CG1-CE1 4.23Å; V585-F587 HydrophobicContact CG1-CE2 3.92Å; V585-F587 HydrophobicContact CG1-CZ 3.65Å; F587-K590 HydrophobicContact CB-CB 3.7Å; F587-K590 HydrophobicContact CD2-CB 4.03Å; F587-K590 HydrophobicContact CD2-CD 3.97Å; F587-K590 HydrophobicContact CD2-CG 4.15Å; F587-K590 HydrophobicContact CE2-CD 4.07Å; F587-K590 HydrophobicContact CG-CB 3.89Å; F587-K590 HydrophobicContact CG-CD 4.22Å; F587-K590 HydrophobicContact CG-CG 4.42Å; F587-K590 HydrophobicContact CZ-CD 4.37Å; F587-E593 HydrophobicContact CE2-CB 4.23Å; F587-E593 HydrophobicContact CE2-CG 3.8Å; F587-E593 HydrophobicContact CZ-CG 4.46Å
588	K	87	Confident	89.2	Confident	126 Å²	126	36.6 Å²	36.6	55%	0.548	17%	0.17	S	C	.	.	S	Bend	trans	-65	-51.5	177.2	-171	177.1	179.4	178.7	0	113.3	P570 E572	P570-K588 HydrophobicContact CG-CB 3.97Å; P570-K588 HydrophobicContact CG-CD 4.15Å; P570-K588 PolarHBondContact O-N 3.17Å; E572-K588 HydrophobicContact CG-CB 3.92Å
589	D	83.6	Confident	89.1	Confident	133 Å²	133	35.1 Å²	35.1	71%	0.711	17%	0.168	S	C	*	.	S	Bend	trans	-121.3	-1.2	-172.4	-56.6	-56.1	0	0	0	113.4
590	K	86.7	Confident	89.2	Confident	47 Å²	47	34.7 Å²	34.7	20%	0.204	17%	0.169	C	C	.	.	S	Bend	trans	-108.2	145.3	178.5	-176.4	-172.1	-173.3	-172.1	0	110.5	E568 S569 F587 E593 E605	E568-K590 IonicContact OE1-NZ 2.73Å; E568-K590 PolarHBondContact OE1-NZ 3.32Å; S569-K590 WeakPolarHBondContact OG-CB 3.41Å; S569-K590 PolarHBondContact OG-N 2.77Å; F587-K590 HydrophobicContact CB-CB 3.7Å; F587-K590 HydrophobicContact CD2-CB 4.03Å; F587-K590 HydrophobicContact CD2-CD 3.97Å; F587-K590 HydrophobicContact CD2-CG 4.15Å; F587-K590 HydrophobicContact CE2-CD 4.07Å; F587-K590 HydrophobicContact CG-CB 3.89Å; F587-K590 HydrophobicContact CG-CD 4.22Å; F587-K590 HydrophobicContact CG-CG 4.42Å; F587-K590 HydrophobicContact CZ-CD 4.37Å; K590-E593 IonicContact NZ-OE1 2.81Å; K590-E593 PolarHBondContact NZ-OE1 3.04Å; K590-E605 WeakPolarHBondContact CE-OE1 3.42Å
591	P	87.8	Confident	89.3	Confident	23 Å²	23	34.7 Å²	34.7	15%	0.149	18%	0.175	C	C	.	.			trans	-58.6	151.5	175.8	23.4	-35.7	0	0	0	113.1	E593 E605 M606	P591-E593 PolarHBondContact O-N 3.17Å; P591-E605 HydrophobicContact CG-CG 4.16Å; P591-M606 HydrophobicContact CB-CB 4.19Å; P591-M606 WeakPolarHBondContact CB-O 3.49Å; P591-M606 WeakPolarHBondContact CG-O 3.26Å
592	L	90.7	Very high	89.4	Confident	5 Å²	5	36 Å²	36	3%	0.026	18%	0.182	C	C	.	.			trans	-54.2	134.1	176.2	173.4	74.2	0	0	0	111.8	A584 V585 V586 M606 I613 L616 F679	A584-L592 HydrophobicContact CB-CD1 3.91Å; V585-L592 VanDerWaalsContact O-CD1 3.29Å; V585-L592 WeakPolarHBondContact O-CD1 3.42Å; V586-L592 HydrophobicContact CB-CD1 4.39Å; V586-L592 HydrophobicContact CG2-CD1 3.49Å; V586-L592 VanDerWaalsContact CG2-CD1 3.49Å; L592-M606 HydrophobicContact CB-CB 4.44Å; L592-M606 HydrophobicContact CB-CG 3.95Å; L592-M606 HydrophobicContact CD2-CG 4.23Å; L592-M606 HydrophobicContact CG-CG 4.36Å; L592-M606 WeakPolarHBondContact O-CG 3.44Å; L592-M606 PolarHBondContact O-N 3.41Å; L592-I613 HydrophobicContact CB-CD1 3.92Å; L592-I613 HydrophobicContact CD1-CD1 4.26Å; L592-I613 HydrophobicContact CD2-CD1 4.13Å; L592-I613 HydrophobicContact CG-CD1 4.32Å; L592-L616 HydrophobicContact CD1-CD1 4.47Å; L592-L616 HydrophobicContact CD2-CD1 4.45Å; L592-F679 HydrophobicContact CD2-CE2 4.35Å; L592-F679 HydrophobicContact CD2-CZ 4.08Å
593	E	91.8	Very high	89.2	Confident	6 Å²	6	37.3 Å²	37.3	3%	0.028	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	135.3	169.7	-70.6	176.2	-173.1	0	0	110.9	R561 V585 F587 K590 P591 W595 L602 E605	R561-E593 IonicContact CZ-OE1 2.72Å; R561-E593 IonicContact CZ-OE2 2.7Å; R561-E593 IonicContact NE-OE2 3.16Å; R561-E593 PolarHBondContact NE-OE2 3.05Å; R561-E593 IonicContact NH2-OE1 3.31Å; R561-E593 PolarHBondContact NH2-OE1 3.26Å; R561-E593 IonicContact NH2-OE2 3.8Å; R561-E593 PolarHBondContact NH2-OE2 2.9Å; R561-E593 VanDerWaalsContact NH2-OE2 3.16Å; V585-E593 HydrophobicContact CB-CB 4.38Å; V585-E593 PolarHBondContact N-O 3.01Å; V585-E593 PolarHBondContact O-N 2.77Å; F587-E593 HydrophobicContact CE2-CB 4.23Å; F587-E593 HydrophobicContact CE2-CG 3.8Å; F587-E593 HydrophobicContact CZ-CG 4.46Å; K590-E593 IonicContact NZ-OE1 2.81Å; K590-E593 PolarHBondContact NZ-OE1 3.04Å; P591-E593 PolarHBondContact O-N 3.17Å; E593-W595 PolarHBondContact OE2-NE1 3.3Å; E593-L602 HydrophobicContact CB-CD1 3.94Å; E593-L602 HydrophobicContact CG-CD1 4.14Å; E593-E605 HydrophobicContact CG-CG 4.41Å
594	L	91.9	Very high	88.9	Confident	4 Å²	4	41.8 Å²	41.8	2%	0.021	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	126.8	175.6	-172	75.9	0	0	0	110.4	L583 L603 R604 W618 V693 V698	L583-L594 WeakPolarHBondContact O-CA 3.1Å; L594-L603 HydrophobicContact CD2-CD1 4.45Å; L594-L603 HydrophobicContact CG-CD1 4.46Å; L594-L603 WeakPolarHBondContact O-CA 3.12Å; L594-L603 WeakPolarHBondContact O-CB 3.21Å; L594-L603 PolarHBondContact O-N 3.47Å; L594-R604 PolarHBondContact N-O 2.91Å; L594-R604 PolarHBondContact O-N 3.24Å; L594-W618 HydrophobicContact CD1-CH2 4.03Å; L594-W618 HydrophobicContact CD1-CZ2 4.07Å; L594-V693 HydrophobicContact CD2-CG1 3.61Å; L594-V693 HydrophobicContact CD2-CG2 4.04Å; L594-V698 HydrophobicContact CD2-CG2 3.84Å
595	W	92.1	Very high	88.7	Confident	12 Å²	12	46.4 Å²	46.4	5%	0.045	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	152.5	-173.5	-67.5	76.7	0	0	0	112	F560 R561 Y582 L583 E593 C600 T601 L602	F560-W595 HydrophobicContact CD1-CD2 4.46Å; F560-W595 HydrophobicContact CD1-CE3 4.29Å; F560-W595 HydrophobicContact CE1-CB 3.71Å; F560-W595 AromaticContact CE1-CD2 3.84Å; F560-W595 HydrophobicContact CE1-CD2 3.84Å; F560-W595 AromaticContact CE1-CE3 3.77Å; F560-W595 HydrophobicContact CE1-CE3 3.77Å; F560-W595 AromaticContact CE1-CG 3.83Å; F560-W595 HydrophobicContact CE1-CG 3.83Å; F560-W595 HydrophobicContact CZ-CB 4.05Å; R561-W595 HydrophobicContact CB-CH2 4.31Å; R561-W595 HydrophobicContact CB-CZ2 4.38Å; R561-W595 HydrophobicContact CG-CH2 4.08Å; R561-W595 HydrophobicContact CG-CZ2 3.77Å; Y582-W595 CarbonylContact C-O 3.59Å; Y582-W595 VanDerWaalsContact CA-O 3.26Å; Y582-W595 WeakPolarHBondContact CA-O 3.45Å; L583-W595 HydrophobicContact CB-CB 4.29Å; L583-W595 PolarHBondContact N-O 3.31Å; L583-W595 PolarHBondContact O-N 2.78Å; E593-W595 PolarHBondContact OE2-NE1 3.3Å; W595-C600 WeakPolarHBondContact CZ3-O 3.49Å; W595-T601 WeakPolarHBondContact CA-O 3.36Å; W595-L602 HydrophobicContact CD2-CB 4.09Å; W595-L602 HydrophobicContact CD2-CD1 4.11Å; W595-L602 HydrophobicContact CE3-CB 4.09Å; W595-L602 HydrophobicContact CG-CD1 4.32Å; W595-L602 HydrophobicContact CH2-CB 3.9Å; W595-L602 HydrophobicContact CZ2-CB 3.91Å; W595-L602 HydrophobicContact CZ2-CD1 3.92Å; W595-L602 HydrophobicContact CZ2-CG 4.38Å; W595-L602 HydrophobicContact CZ3-CB 4Å
596	D	89.6	Confident	88.4	Confident	15 Å²	15	47.9 Å²	47.9	8%	0.08	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	123.9	163.9	-172.5	-28.5	0	0	0	109	R598 T599 C600 T601 L603	D596-R598 WeakPolarHBondContact OD1-CB 3.32Å; D596-R598 PolarHBondContact OD1-N 2.81Å; D596-R598 IonicContact OD1-NE 3.99Å; D596-R598 IonicContact OD2-NH2 3.34Å; D596-T599 WeakPolarHBondContact CB-OG1 3.3Å; D596-C600 VanDerWaalsContact O-CA 3.22Å; D596-C600 WeakPolarHBondContact O-CA 3.37Å; D596-C600 PolarHBondContact O-N 3Å; D596-T601 PolarHBondContact N-O 2.7Å; D596-T601 PolarHBondContact O-N 2.82Å; D596-L603 HydrophobicContact CB-CD1 4.08Å; D596-L603 HydrophobicContact CB-CD2 4.03Å; D596-L603 HydrophobicContact CB-CG 4.14Å
597	V	88.8	Confident	88	Confident	12 Å²	12	51.1 Å²	51.1	7%	0.073	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-32.6	-177.2	176.4	0	0	0	0	111.8	T524 Q581 L583	T524-V597 HydrophobicContact CG2-CG1 3.63Å; Q581-V597 PolarHBondContact O-N 2.99Å; L583-V597 HydrophobicContact CB-CG2 3.71Å
598	R	84.3	Confident	87.4	Confident	128 Å²	128	60 Å²	60	48%	0.483	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-43	-174.6	-64.2	179.1	-65.2	151.9	7.4	111.3	D596 Q671	D596-R598 WeakPolarHBondContact OD1-CB 3.32Å; D596-R598 PolarHBondContact OD1-N 2.81Å; D596-R598 IonicContact OD1-NE 3.99Å; D596-R598 IonicContact OD2-NH2 3.34Å; R598-Q671 PolarHBondContact NH2-O 3.2Å; R598-Q671 VanDerWaalsContact NH2-O 3.07Å
599	T	84.2	Confident	87	Confident	63 Å²	63	61.5 Å²	61.5	39%	0.387	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-10.1	-178.5	55.8	0	0	0	0	113.1	D596 T601	D596-T599 WeakPolarHBondContact CB-OG1 3.3Å; T599-T601 PolarHBondContact O-N 2.93Å; T599-T601 PolarHBondContact OG1-OG1 2.8Å
600	C	87.3	Confident	86.9	Confident	39 Å²	39	57 Å²	57	26%	0.264	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.8	36	-173	-56.8	0	0	0	0	112.8	F560 W595 D596	F560-C600 HydrophobicContact CD2-CB 4.13Å; F560-C600 VanDerWaalsContact CD2-SG 3.6Å; F560-C600 HydrophobicContact CE2-CB 3.99Å; F560-C600 VanDerWaalsContact CE2-SG 3.51Å; W595-C600 WeakPolarHBondContact CZ3-O 3.49Å; D596-C600 VanDerWaalsContact O-CA 3.22Å; D596-C600 WeakPolarHBondContact O-CA 3.37Å; D596-C600 PolarHBondContact O-N 3Å
601	T	88.7	Confident	86.8	Confident	68 Å²	68	56.8 Å²	56.8	42%	0.417	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	140	-178.3	55.6	0	0	0	0	112.2	W595 D596 T599 L603	W595-T601 WeakPolarHBondContact CA-O 3.36Å; D596-T601 PolarHBondContact N-O 2.7Å; D596-T601 PolarHBondContact O-N 2.82Å; T599-T601 PolarHBondContact O-N 2.93Å; T599-T601 PolarHBondContact OG1-OG1 2.8Å; T601-L603 PolarHBondContact O-N 2.9Å
602	L	89.4	Confident	86.6	Confident	59 Å²	59	58.2 Å²	58.2	31%	0.309	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	121.1	172.2	179.6	68.7	0	0	0	109.7	E593 W595	E593-L602 HydrophobicContact CB-CD1 3.94Å; E593-L602 HydrophobicContact CG-CD1 4.14Å; W595-L602 HydrophobicContact CD2-CB 4.09Å; W595-L602 HydrophobicContact CD2-CD1 4.11Å; W595-L602 HydrophobicContact CE3-CB 4.09Å; W595-L602 HydrophobicContact CG-CD1 4.32Å; W595-L602 HydrophobicContact CH2-CB 3.9Å; W595-L602 HydrophobicContact CZ2-CB 3.91Å; W595-L602 HydrophobicContact CZ2-CD1 3.92Å; W595-L602 HydrophobicContact CZ2-CG 4.38Å; W595-L602 HydrophobicContact CZ3-CB 4Å
603	L	87.1	Confident	86.6	Confident	27 Å²	27	59.4 Å²	59.4	14%	0.141	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	-43.8	177.8	-60.6	172.3	0	0	0	111.4	Y582 L594 D596 T601 N696	Y582-L603 HydrophobicContact CD1-CD1 3.4Å; Y582-L603 VanDerWaalsContact CD1-CD1 3.4Å; Y582-L603 HydrophobicContact CE1-CD1 3.52Å; L594-L603 HydrophobicContact CD2-CD1 4.45Å; L594-L603 HydrophobicContact CG-CD1 4.46Å; L594-L603 WeakPolarHBondContact O-CA 3.12Å; L594-L603 WeakPolarHBondContact O-CB 3.21Å; L594-L603 PolarHBondContact O-N 3.47Å; D596-L603 HydrophobicContact CB-CD1 4.08Å; D596-L603 HydrophobicContact CB-CD2 4.03Å; D596-L603 HydrophobicContact CB-CG 4.14Å; T601-L603 PolarHBondContact O-N 2.9Å; L603-N696 WeakPolarHBondContact CD2-OD1 3.47Å
604	R	86.3	Confident	86.4	Confident	94 Å²	94	60.7 Å²	60.7	36%	0.355	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	136.9	-177	-171	172.4	-72.7	-154.8	-9.4	112	L594 M606 N696 V698	L594-R604 PolarHBondContact N-O 2.91Å; L594-R604 PolarHBondContact O-N 3.24Å; R604-M606 HydrophobicContact CG-SD 4.37Å; R604-N696 PolarHBondContact NE-O 2.91Å; R604-N696 PolarHBondContact NH2-O 2.96Å; R604-V698 PolarHBondContact NH1-O 3.13Å
605	E	88.6	Confident	86.3	Confident	98 Å²	98	60.7 Å²	60.7	46%	0.458	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	131.6	162.6	-173.7	176.1	-178.6	0	0	108.3	K590 P591 E593	K590-E605 WeakPolarHBondContact CE-OE1 3.42Å; P591-E605 HydrophobicContact CG-CG 4.16Å; E593-E605 HydrophobicContact CG-CG 4.41Å
606	M	87.2	Confident	86.3	Confident	31 Å²	31	60.1 Å²	60.1	15%	0.153	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-74	161.7	-179.2	-60.7	-57.8	-80.8	0	0	111.4	P591 L592 R604 F610 L691 V698	P591-M606 HydrophobicContact CB-CB 4.19Å; P591-M606 WeakPolarHBondContact CB-O 3.49Å; P591-M606 WeakPolarHBondContact CG-O 3.26Å; L592-M606 HydrophobicContact CB-CB 4.44Å; L592-M606 HydrophobicContact CB-CG 3.95Å; L592-M606 HydrophobicContact CD2-CG 4.23Å; L592-M606 HydrophobicContact CG-CG 4.36Å; L592-M606 WeakPolarHBondContact O-CG 3.44Å; L592-M606 PolarHBondContact O-N 3.41Å; R604-M606 HydrophobicContact CG-SD 4.37Å; M606-F610 HydrophobicContact CB-CB 4.22Å; M606-F610 HydrophobicContact CB-CD1 4.46Å; M606-F610 HydrophobicContact CB-CD2 4.02Å; M606-F610 HydrophobicContact CB-CG 3.98Å; M606-F610 HydrophobicContact CE-CD2 3.66Å; M606-F610 HydrophobicContact CE-CE2 3.14Å; M606-F610 HydrophobicContact CE-CZ 3.76Å; M606-F610 HydrophobicContact CG-CD2 4.4Å; M606-F610 HydrophobicContact CG-CE2 4.39Å; M606-L691 HydrophobicContact CE-CD2 4.08Å; M606-V698 HydrophobicContact CE-CG1 4.44Å
607	S	84.6	Confident	86.5	Confident	73 Å²	73	61 Å²	61	51%	0.51	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-65.2	152.8	-178.9	59.1	0	0	0	0	112.3	N609 F610	S607-N609 PolarHBondContact O-N 3.49Å; S607-N609 VanDerWaalsContact O-N 3.12Å; S607-F610 WeakPolarHBondContact O-CB 3.45Å; S607-F610 PolarHBondContact O-N 2.79Å
608	K	78.8	Confident	86.7	Confident	197 Å²	197	60.9 Å²	60.9	86%	0.857	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-25.6	174.3	-67.6	-173.1	177.6	-175.1	0	114.5	F610	K608-F610 PolarHBondContact O-N 2.95Å
609	N	78.6	Confident	86.8	Confident	157 Å²	157	54.9 Å²	54.9	84%	0.84	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	13.7	176.1	-62	-3.6	0	0	0	112.9	S607	S607-N609 PolarHBondContact O-N 3.49Å; S607-N609 VanDerWaalsContact O-N 3.12Å
610	F	81.4	Confident	86.6	Confident	40 Å²	40	53.1 Å²	53.1	18%	0.175	28%	0.283	C	S	.	.	S	Bend	trans	-71.7	137.5	178.6	-161.4	-100.7	0	0	0	109.8	M606 S607 K608 I613 F681 L691	M606-F610 HydrophobicContact CB-CB 4.22Å; M606-F610 HydrophobicContact CB-CD1 4.46Å; M606-F610 HydrophobicContact CB-CD2 4.02Å; M606-F610 HydrophobicContact CB-CG 3.98Å; M606-F610 HydrophobicContact CE-CD2 3.66Å; M606-F610 HydrophobicContact CE-CE2 3.14Å; M606-F610 HydrophobicContact CE-CZ 3.76Å; M606-F610 HydrophobicContact CG-CD2 4.4Å; M606-F610 HydrophobicContact CG-CE2 4.39Å; S607-F610 WeakPolarHBondContact O-CB 3.45Å; S607-F610 PolarHBondContact O-N 2.79Å; K608-F610 PolarHBondContact O-N 2.95Å; F610-I613 HydrophobicContact CD1-CD1 4.41Å; F610-I613 HydrophobicContact CD1-CG1 4.44Å; F610-I613 HydrophobicContact CE1-CD1 3.83Å; F610-I613 HydrophobicContact CE1-CG1 4.03Å; F610-F681 AromaticContact CE1-CE1 3.85Å; F610-F681 HydrophobicContact CE1-CE1 3.85Å; F610-F681 HydrophobicContact CE1-CE2 4.09Å; F610-F681 AromaticContact CE1-CZ 3.55Å; F610-F681 HydrophobicContact CE1-CZ 3.55Å; F610-F681 HydrophobicContact CE2-CE1 4.36Å; F610-F681 HydrophobicContact CE2-CZ 4.22Å; F610-F681 HydrophobicContact CZ-CD1 4.39Å; F610-F681 AromaticContact CZ-CE1 3.38Å; F610-F681 HydrophobicContact CZ-CE1 3.38Å; F610-F681 HydrophobicContact CZ-CE2 4.33Å; F610-F681 AromaticContact CZ-CZ 3.36Å; F610-F681 HydrophobicContact CZ-CZ 3.36Å; F610-L691 HydrophobicContact CE2-CD2 4.46Å; F610-L691 HydrophobicContact CZ-CD2 4.35Å
611	P	83.3	Confident	86	Confident	42 Å²	42	54.6 Å²	54.6	27%	0.273	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-56.6	144.6	178.9	-22.8	32.1	0	0	0	111.9	I613 F681 D683 Y689	P611-I613 PolarHBondContact O-N 2.95Å; P611-F681 HydrophobicContact CB-CE2 4.33Å; P611-D683 HydrophobicContact CB-CB 3.97Å; P611-Y689 HydrophobicContact CG-CE1 4.27Å; P611-Y689 HydrophobicContact CG-CE2 4.4Å
612	A	84.9	Confident	85.2	Confident	53 Å²	53	54.5 Å²	54.5	44%	0.438	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-64.1	127.2	172.7	0	0	0	0	0	109.2	D683	A612-D683 VanDerWaalsContact O-CA 3.31Å; A612-D683 WeakPolarHBondContact O-CA 3.41Å
613	I	89.2	Confident	84	Confident	29 Å²	29	55.7 Å²	55.7	15%	0.149	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-91	122.2	-174.1	-58.2	173.7	0	0	0	109.1	V586 L592 F610 P611 L616 F681 T682	V586-I613 HydrophobicContact CG1-CB 4.02Å; V586-I613 HydrophobicContact CG1-CD1 4.3Å; V586-I613 HydrophobicContact CG1-CG2 4.4Å; V586-I613 HydrophobicContact CG2-CD1 4.14Å; L592-I613 HydrophobicContact CB-CD1 3.92Å; L592-I613 HydrophobicContact CD1-CD1 4.26Å; L592-I613 HydrophobicContact CD2-CD1 4.13Å; L592-I613 HydrophobicContact CG-CD1 4.32Å; F610-I613 HydrophobicContact CD1-CD1 4.41Å; F610-I613 HydrophobicContact CD1-CG1 4.44Å; F610-I613 HydrophobicContact CE1-CD1 3.83Å; F610-I613 HydrophobicContact CE1-CG1 4.03Å; P611-I613 PolarHBondContact O-N 2.95Å; I613-L616 HydrophobicContact CD1-CD1 4.35Å; I613-L616 HydrophobicContact CG2-CB 4.16Å; I613-F681 HydrophobicContact CB-CD2 4.44Å; I613-F681 HydrophobicContact CG1-CD2 3.85Å; I613-F681 HydrophobicContact CG1-CE2 4.19Å; I613-F681 HydrophobicContact CG1-CG 4.34Å; I613-F681 HydrophobicContact CG2-CB 4Å; I613-F681 HydrophobicContact CG2-CD2 4.26Å; I613-F681 HydrophobicContact CG2-CG 4.45Å; I613-T682 WeakPolarHBondContact CA-O 3.34Å
614	T	87.9	Confident	83.1	Confident	34 Å²	34	57.5 Å²	57.5	21%	0.209	31%	0.305	C	S	.	.	S	Bend	trans	-91.8	-36.7	174.8	53.2	0	0	0	0	112.6	T682 D683 N684 I713	T614-T682 PolarHBondContact N-O 3.32Å; T614-T682 PolarHBondContact OG1-O 3.18Å; T614-T682 VanDerWaalsContact OG1-O 3.13Å; T614-T682 PolarHBondContact OG1-OG1 3.23Å; T614-D683 PolarHBondContact OG1-O 2.93Å; T614-N684 WeakPolarHBondContact CG2-OD1 3.39Å; T614-I713 WeakPolarHBondContact CB-O 3.44Å; T614-I713 PolarHBondContact OG1-O 3.05Å; T614-I713 VanDerWaalsContact OG1-O 3.07Å
615	A	89.4	Confident	82	Confident	3 Å²	3	61.4 Å²	61.4	3%	0.025	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	149.7	176.6	0	0	0	0	0	111.3	F681 T682 I716	A615-F681 CarbonylContact O-C 3.54Å; A615-F681 WeakPolarHBondContact O-CA 3.49Å; A615-F681 VanDerWaalsContact O-CB 3.3Å; A615-F681 WeakPolarHBondContact O-CB 3.4Å; A615-T682 PolarHBondContact O-N 3.01Å; A615-I716 HydrophobicContact CB-CB 4.4Å; A615-I716 HydrophobicContact CB-CD1 3.81Å; A615-I716 HydrophobicContact CB-CG1 3.64Å
616	L	93.6	Very high	81	Confident	1 Å²	1	58.5 Å²	58.5	1%	0.005	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	135.2	-177.6	-174.1	151.8	0	0	0	111.3	M573 K575 A584 V586 L592 I613 F679 V680 F681	M573-L616 HydrophobicContact CE-CB 4.21Å; M573-L616 HydrophobicContact SD-CB 4.3Å; K575-L616 HydrophobicContact CB-CD2 3.71Å; K575-L616 VanDerWaalsContact CE-O 3.22Å; K575-L616 WeakPolarHBondContact CE-O 3.35Å; K575-L616 HydrophobicContact CG-CD2 3.79Å; A584-L616 HydrophobicContact CB-CD1 4.4Å; A584-L616 HydrophobicContact CB-CD2 4.27Å; V586-L616 HydrophobicContact CG2-CD1 4.32Å; L592-L616 HydrophobicContact CD1-CD1 4.47Å; L592-L616 HydrophobicContact CD2-CD1 4.45Å; I613-L616 HydrophobicContact CD1-CD1 4.35Å; I613-L616 HydrophobicContact CG2-CB 4.16Å; L616-F679 HydrophobicContact CD1-CD2 3.76Å; L616-F679 HydrophobicContact CD1-CE2 3.73Å; L616-F679 HydrophobicContact CD2-CD2 4.3Å; L616-F679 HydrophobicContact CG-CD2 3.91Å; L616-F679 HydrophobicContact CG-CE2 4.38Å; L616-V680 WeakPolarHBondContact CA-O 3.41Å; L616-F681 HydrophobicContact CB-CB 4.12Å; L616-F681 HydrophobicContact CD1-CB 4.17Å; L616-F681 HydrophobicContact CG-CB 4.15Å
617	E	93.4	Very high	80.1	Confident	33 Å²	33	58 Å²	58	15%	0.154	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	141.8	175.1	-165	65	-161.7	0	0	112	K575 F679 V680 I716 W718	K575-E617 IonicContact NZ-OE2 3.72Å; K575-E617 PolarHBondContact NZ-OE2 3.49Å; E617-F679 WeakPolarHBondContact O-CA 3.33Å; E617-V680 PolarHBondContact N-O 3.07Å; E617-V680 PolarHBondContact O-N 3.35Å; E617-I716 HydrophobicContact CB-CB 4.3Å; E617-I716 HydrophobicContact CB-CG2 4.02Å; E617-W718 HydrophobicContact CG-CB 4.15Å
618	W	92.1	Very high	79.3	Confident	10 Å²	10	63 Å²	63	4%	0.038	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	145.2	178.1	-71.5	92.3	0	0	0	112	K575 Y582 A584 L594 E677 F679 V693	K575-W618 PolarHBondContact O-NE1 3.28Å; K575-W618 VanDerWaalsContact O-NE1 3.09Å; Y582-W618 HydrophobicContact CD2-CH2 4.25Å; Y582-W618 HydrophobicContact CD2-CZ3 4.41Å; Y582-W618 HydrophobicContact CG-CH2 4.38Å; A584-W618 HydrophobicContact CB-CZ2 4.26Å; L594-W618 HydrophobicContact CD1-CH2 4.03Å; L594-W618 HydrophobicContact CD1-CZ2 4.07Å; W618-E677 HydrophobicContact CE3-CB 4.15Å; W618-E677 HydrophobicContact CZ3-CB 3.92Å; W618-F679 HydrophobicContact CD2-CB 3.76Å; W618-F679 HydrophobicContact CE3-CB 3.73Å; W618-F679 HydrophobicContact CE3-CD1 4.21Å; W618-F679 HydrophobicContact CE3-CG 4.43Å; W618-F679 HydrophobicContact CG-CB 4.16Å; W618-F679 AromaticContact CH2-CD1 3.77Å; W618-F679 HydrophobicContact CH2-CD1 3.77Å; W618-F679 HydrophobicContact CH2-CE1 4.39Å; W618-F679 HydrophobicContact CZ2-CD1 4.2Å; W618-F679 HydrophobicContact CZ3-CB 4.19Å; W618-F679 AromaticContact CZ3-CD1 3.78Å; W618-F679 HydrophobicContact CZ3-CD1 3.78Å; W618-F679 HydrophobicContact CZ3-CG 4.43Å; W618-V693 HydrophobicContact CH2-CB 4.47Å; W618-V693 HydrophobicContact CH2-CG2 4.07Å; W618-V693 HydrophobicContact CZ3-CB 4.42Å; W618-V693 HydrophobicContact CZ3-CG2 4.23Å
619	S	87.8	Confident	79	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.007	31%	0.314	C	S	.	.			trans	-70.5	133.1	175.2	-167.9	0	0	0	0	111.2	H578 S621 H678 W718	H578-S619 WeakPolarHBondContact CB-O 3.31Å; S619-S621 PolarHBondContact O-N 2.92Å; S619-S621 PolarHBondContact OG-N 3.27Å; S619-S621 PolarHBondContact OG-OG 3Å; S619-H678 WeakPolarHBondContact CB-O 3.25Å; S619-H678 PolarHBondContact N-O 3.12Å; S619-W718 VanDerWaalsContact CA-CE3 3.49Å; S619-W718 VanDerWaalsContact CB-CH2 3.43Å; S619-W718 WeakPolarHBondContact OG-CH2 3.46Å; S619-W718 WeakPolarHBondContact OG-CZ2 3.41Å
620	P	80.3	Confident	78.5	Confident	27 Å²	27	58.4 Å²	58.4	18%	0.175	29%	0.293	C	S	.	.	S	Bend	trans	-67.2	-20.6	167.5	-17.5	30.6	0	0	0	112.8	H622 W718	P620-H622 PolarHBondContact O-ND1 2.92Å; P620-W718 HydrophobicContact CG-CG 4.28Å
621	S	74.3	Confident	78	Confident	69 Å²	69	61 Å²	61	48%	0.483	31%	0.306	S	S	.	.			trans	-81	128.3	-177.7	73.7	0	0	0	0	111	S619	S619-S621 PolarHBondContact O-N 2.92Å; S619-S621 PolarHBondContact OG-N 3.27Å; S619-S621 PolarHBondContact OG-OG 3Å
622	H	70.7	Confident	77.4	Confident	66 Å²	66	64 Å²	64	31%	0.306	32%	0.319	S	S	.	.			trans	-148.8	139.2	-176	55.3	-80.7	0	0	0	110.6	H578 L579 P620 L624	H578-H622 AromaticContact CD2-ND1 3.86Å; L579-H622 HydrophobicContact CD1-CB 4.08Å; L579-H622 HydrophobicContact CG-CB 4.47Å; P620-H622 PolarHBondContact O-ND1 2.92Å; H622-L624 VanDerWaalsContact CD2-CG 3.4Å; H622-L624 WeakPolarHBondContact CD2-CG 3.39Å; H622-L624 PolarHBondContact O-N 3.16Å
623	N	65	Low	76.7	Confident	85 Å²	85	63.8 Å²	63.8	46%	0.455	32%	0.317	S	S	.	.			trans	-94.7	81.7	-174.7	-169.5	-10.6	0	0	0	111.6	K625 S626	N623-K625 PolarHBondContact O-N 2.72Å; N623-K625 PolarHBondContact OD1-N 2.91Å; N623-S626 PolarHBondContact O-OG 2.9Å; N623-S626 PolarHBondContact OD1-N 3.14Å
624	L	67	Low	75.8	Confident	65 Å²	65	64.9 Å²	64.9	34%	0.34	33%	0.325	S	S	.	.	H	α-helix	trans	-69.4	-16.9	177.6	-63	177.7	0	0	0	113.8	L579 H622 L627 R628	L579-L624 HydrophobicContact CD1-CD2 4.24Å; H622-L624 VanDerWaalsContact CD2-CG 3.4Å; H622-L624 WeakPolarHBondContact CD2-CG 3.39Å; H622-L624 PolarHBondContact O-N 3.16Å; L624-L627 HydrophobicContact CD2-CD2 4.2Å; L624-L627 PolarHBondContact O-N 2.91Å; L624-R628 WeakPolarHBondContact O-CG 3.14Å; L624-R628 PolarHBondContact O-N 2.85Å
625	K	64.9	Low	74.8	Confident	175 Å²	175	72.7 Å²	72.7	76%	0.761	35%	0.351	S	S	*	.	H	α-helix	trans	-68.8	-40.3	-179.9	-68.4	-176	179.4	-179.9	0	111.2	N623 K629	N623-K625 PolarHBondContact O-N 2.72Å; N623-K625 PolarHBondContact OD1-N 2.91Å; K625-K629 WeakPolarHBondContact O-CB 3.27Å; K625-K629 PolarHBondContact O-N 2.78Å
626	S	66	Low	73.8	Confident	38 Å²	38	77.2 Å²	77.2	27%	0.266	37%	0.372	S	S	.	.	H	α-helix	trans	-66.3	-39	174.8	62.3	0	0	0	0	111.6	N623 K629 K630	N623-S626 PolarHBondContact O-OG 2.9Å; N623-S626 PolarHBondContact OD1-N 3.14Å; S626-K629 PolarHBondContact O-N 3.28Å; S626-K630 WeakPolarHBondContact O-CB 3.34Å; S626-K630 WeakPolarHBondContact O-CG 3.19Å; S626-K630 PolarHBondContact O-N 2.92Å
627	L	68.4	Low	72.5	Confident	21 Å²	21	79.7 Å²	79.7	11%	0.11	39%	0.392	C	S	.	.	H	α-helix	trans	-60.9	-50.8	175.8	-175.7	74.2	0	0	0	111.6	L624 K629 K630 Q631 I673 A675	L624-L627 HydrophobicContact CD2-CD2 4.2Å; L624-L627 PolarHBondContact O-N 2.91Å; L627-K629 VanDerWaalsContact C-N 3.32Å; L627-K629 PolarHBondContact O-N 2.88Å; L627-K630 PolarHBondContact O-N 2.99Å; L627-K630 VanDerWaalsContact O-N 3.16Å; L627-Q631 WeakPolarHBondContact O-CG 3.34Å; L627-Q631 PolarHBondContact O-N 2.73Å; L627-I673 HydrophobicContact CD1-CG2 3.66Å; L627-A675 HydrophobicContact CD1-CB 4.34Å; L627-A675 HydrophobicContact CD2-CB 4.2Å
628	R	67.5	Low	71	Confident	176 Å²	176	81.8 Å²	81.8	66%	0.664	40%	0.403	S	S	*	.	H	α-helix	trans	-60.7	-40.8	178	-73.4	179.6	-179.3	179.9	-0.8	112.1	L624 Q631 L632	L624-R628 WeakPolarHBondContact O-CG 3.14Å; L624-R628 PolarHBondContact O-N 2.85Å; R628-Q631 PolarHBondContact O-N 3.46Å; R628-L632 WeakPolarHBondContact O-CB 3.17Å; R628-L632 PolarHBondContact O-N 2.91Å
629	K	72.6	Confident	69.4	Low	167 Å²	167	83.9 Å²	83.9	73%	0.726	42%	0.422	S	S	*	.	H	α-helix	trans	-63	-40.6	175.7	-172.2	176.8	-179.8	179.3	0	111.8	K625 S626 L627 A633	K625-K629 WeakPolarHBondContact O-CB 3.27Å; K625-K629 PolarHBondContact O-N 2.78Å; S626-K629 PolarHBondContact O-N 3.28Å; L627-K629 VanDerWaalsContact C-N 3.32Å; L627-K629 PolarHBondContact O-N 2.88Å; K629-A633 VanDerWaalsContact O-CB 3.29Å; K629-A633 WeakPolarHBondContact O-CB 3.38Å; K629-A633 PolarHBondContact O-N 3.43Å
630	K	69.6	Low	68.1	Low	92 Å²	92	92.8 Å²	92.8	40%	0.4	46%	0.456	S	S	.	.	H	α-helix	trans	-67.8	-45.7	175.6	-74.7	-178.8	179.2	-168.5	0	112	S626 L627 L632 A633 T634 I673 E694	S626-K630 WeakPolarHBondContact O-CB 3.34Å; S626-K630 WeakPolarHBondContact O-CG 3.19Å; S626-K630 PolarHBondContact O-N 2.92Å; L627-K630 PolarHBondContact O-N 2.99Å; L627-K630 VanDerWaalsContact O-N 3.16Å; K630-L632 VanDerWaalsContact C-N 3.31Å; K630-L632 PolarHBondContact O-N 3.4Å; K630-A633 PolarHBondContact O-N 3.04Å; K630-T634 PolarHBondContact O-N 2.8Å; K630-T634 PolarHBondContact O-OG1 3.33Å; K630-I673 HydrophobicContact CB-CG2 4.2Å; K630-E694 IonicContact NZ-OE1 3.42Å; K630-E694 PolarHBondContact NZ-OE1 3.43Å
631	Q	69.5	Low	67	Low	93 Å²	93	99.3 Å²	99.3	44%	0.435	48%	0.484	S	S	.	.	H	α-helix	trans	-59.4	-42.5	175.5	-74.6	177.3	-21	0	0	111.8	L627 R628 T634 R635 I673	L627-Q631 WeakPolarHBondContact O-CG 3.34Å; L627-Q631 PolarHBondContact O-N 2.73Å; R628-Q631 PolarHBondContact O-N 3.46Å; Q631-T634 PolarHBondContact O-N 2.81Å; Q631-R635 VanDerWaalsContact O-CB 3.32Å; Q631-R635 WeakPolarHBondContact O-CB 3.5Å; Q631-R635 PolarHBondContact O-N 2.89Å; Q631-I673 HydrophobicContact CG-CD1 4.14Å; Q631-I673 HydrophobicContact CG-CG2 4.49Å
632	L	71	Confident	66.1	Low	106 Å²	106	101.7 Å²	101.7	56%	0.555	50%	0.495	S	S	*	.	H	α-helix	trans	-64	-46.1	175.3	-156.3	86.9	0	0	0	111.1	R628 K630 T634 R635 E636	R628-L632 WeakPolarHBondContact O-CB 3.17Å; R628-L632 PolarHBondContact O-N 2.91Å; K630-L632 VanDerWaalsContact C-N 3.31Å; K630-L632 PolarHBondContact O-N 3.4Å; L632-T634 PolarHBondContact O-N 2.9Å; L632-R635 PolarHBondContact O-N 3.12Å; L632-E636 WeakPolarHBondContact O-CB 3.29Å; L632-E636 WeakPolarHBondContact O-CG 3.46Å; L632-E636 PolarHBondContact O-N 3.13Å
633	A	71.4	Confident	65.2	Low	49 Å²	49	104 Å²	104	41%	0.405	51%	0.514	S	S	.	.	H	α-helix	trans	-63.8	-37.6	177.9	0	0	0	0	0	112.9	K629 K630 A637	K629-A633 VanDerWaalsContact O-CB 3.29Å; K629-A633 WeakPolarHBondContact O-CB 3.38Å; K629-A633 PolarHBondContact O-N 3.43Å; K630-A633 PolarHBondContact O-N 3.04Å; A633-A637 VanDerWaalsContact O-CB 3.28Å; A633-A637 WeakPolarHBondContact O-CB 3.43Å; A633-A637 PolarHBondContact O-N 3.38Å
634	T	68.8	Low	64.3	Low	51 Å²	51	106 Å²	106	31%	0.313	53%	0.529	S	S	.	.	H	α-helix	trans	-68.8	-39.7	174.7	-52.8	0	0	0	0	111.1	K630 Q631 L632 A637 M638 I673	K630-T634 PolarHBondContact O-N 2.8Å; K630-T634 PolarHBondContact O-OG1 3.33Å; Q631-T634 PolarHBondContact O-N 2.81Å; L632-T634 PolarHBondContact O-N 2.9Å; T634-A637 PolarHBondContact O-N 2.95Å; T634-M638 WeakPolarHBondContact O-CB 3.41Å; T634-M638 PolarHBondContact O-N 3.39Å; T634-I673 HydrophobicContact CG2-CD1 4.2Å; T634-I673 WeakPolarHBondContact OG1-CD1 3.36Å
635	R	67.9	Low	63	Low	198 Å²	198	108.2 Å²	108.2	75%	0.747	55%	0.55	S	S	*	.	H	α-helix	trans	-65	-40.6	174.9	-168.3	174.4	176.4	149.3	0.6	111.7	Q631 L632 A639	Q631-R635 VanDerWaalsContact O-CB 3.32Å; Q631-R635 WeakPolarHBondContact O-CB 3.5Å; Q631-R635 PolarHBondContact O-N 2.89Å; L632-R635 PolarHBondContact O-N 3.12Å; R635-A639 VanDerWaalsContact O-CB 3.32Å; R635-A639 WeakPolarHBondContact O-CB 3.36Å; R635-A639 PolarHBondContact O-N 3.29Å
636	E	68.7	Low	61.8	Low	99 Å²	99	107.8 Å²	107.8	46%	0.463	56%	0.556	S	S	.	*	H	α-helix	trans	-65.7	-38.8	172.7	-75	174.4	-174.6	0	0	112.3	L632 A639 R640	L632-E636 WeakPolarHBondContact O-CB 3.29Å; L632-E636 WeakPolarHBondContact O-CG 3.46Å; L632-E636 PolarHBondContact O-N 3.13Å; E636-A639 PolarHBondContact O-N 2.86Å; E636-R640 WeakPolarHBondContact O-CG 3.27Å; E636-R640 PolarHBondContact O-N 2.96Å
637	A	65.8	Low	60.5	Low	52 Å²	52	112.3 Å²	112.3	43%	0.43	58%	0.582	S	S	.	*	H	α-helix	trans	-68.5	-41.2	176.6	0	0	0	0	0	112.4	A633 T634 R640 Q641	A633-A637 VanDerWaalsContact O-CB 3.28Å; A633-A637 WeakPolarHBondContact O-CB 3.43Å; A633-A637 PolarHBondContact O-N 3.38Å; T634-A637 PolarHBondContact O-N 2.95Å; A637-R640 PolarHBondContact O-N 2.9Å; A637-Q641 PolarHBondContact O-N 3.47Å; A637-Q641 VanDerWaalsContact O-N 3.1Å
638	M	62.8	Low	58.9	Low	78 Å²	78	120.7 Å²	120.7	38%	0.384	62%	0.621	S	S	.	*	H	α-helix	trans	-64	-42.3	172.9	-79.6	-179.4	169.8	0	0	111.3	T634 R640 Q641 T642 L669	T634-M638 WeakPolarHBondContact O-CB 3.41Å; T634-M638 PolarHBondContact O-N 3.39Å; M638-R640 VanDerWaalsContact C-N 3.26Å; M638-R640 PolarHBondContact O-N 2.89Å; M638-Q641 PolarHBondContact O-N 3.45Å; M638-Q641 VanDerWaalsContact O-N 3.14Å; M638-T642 PolarHBondContact O-N 3.38Å; M638-T642 PolarHBondContact O-OG1 2.9Å; M638-L669 HydrophobicContact CE-CB 4.36Å
639	A	57.9	Low	57.7	Low	53 Å²	53	120.4 Å²	120.4	44%	0.438	63%	0.631	S	S	.	*	H	α-helix	trans	-63	-30.5	175.6	0	0	0	0	0	113	R635 E636 T642 V643	R635-A639 VanDerWaalsContact O-CB 3.32Å; R635-A639 WeakPolarHBondContact O-CB 3.36Å; R635-A639 PolarHBondContact O-N 3.29Å; E636-A639 PolarHBondContact O-N 2.86Å; A639-T642 PolarHBondContact O-OG1 3.34Å; A639-T642 VanDerWaalsContact O-OG1 3.06Å; A639-V643 VanDerWaalsContact O-CG2 3.3Å; A639-V643 WeakPolarHBondContact O-CG2 3Å
640	R	60.4	Low	55.8	Low	189 Å²	189	117.3 Å²	117.3	71%	0.713	63%	0.631	S	S	*	*	H	α-helix	trans	-75.6	-30.5	173.6	-73.5	175.7	-173.6	-178.5	4	113.2	E636 A637 M638	E636-R640 WeakPolarHBondContact O-CG 3.27Å; E636-R640 PolarHBondContact O-N 2.96Å; A637-R640 PolarHBondContact O-N 2.9Å; M638-R640 VanDerWaalsContact C-N 3.26Å; M638-R640 PolarHBondContact O-N 2.89Å
641	Q	56.7	Low	54.2	Low	164 Å²	164	120.6 Å²	120.6	77%	0.766	65%	0.651	S	S	*	*	H	α-helix	trans	-73.6	-24.9	176	-83.3	-178.8	-23.2	0	0	113.2	A637 M638	A637-Q641 PolarHBondContact O-N 3.47Å; A637-Q641 VanDerWaalsContact O-N 3.1Å; M638-Q641 PolarHBondContact O-N 3.45Å; M638-Q641 VanDerWaalsContact O-N 3.14Å
642	T	56.3	Low	52.6	Low	118 Å²	118	122 Å²	122	72%	0.724	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	-3.1	178.4	49.3	0	0	0	0	114.6	M638 A639	M638-T642 PolarHBondContact O-N 3.38Å; M638-T642 PolarHBondContact O-OG1 2.9Å; A639-T642 PolarHBondContact O-OG1 3.34Å; A639-T642 VanDerWaalsContact O-OG1 3.06Å
643	V	50.5	Low	51.4	Low	116 Å²	116	126.2 Å²	126.2	70%	0.703	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.8	19.9	-172.9	-176.5	0	0	0	0	112.8	A639	A639-V643 VanDerWaalsContact O-CG2 3.3Å; A639-V643 WeakPolarHBondContact O-CG2 3Å
644	V	46.8	Very low	49.8	Very low	125 Å²	125	128.6 Å²	128.6	76%	0.758	70%	0.697	S	S	*	*			trans	-128.6	89.1	174.7	-172.1	0	0	0	0	111.7
645	S	39.7	Very low	48.4	Very low	112 Å²	112	129.1 Å²	129.1	78%	0.783	70%	0.702	S	S	*	*			trans	-172.9	86.3	139.1	57	0	0	0	0	109.2
646	D	40.3	Very low	47.3	Very low	167 Å²	167	125.1 Å²	125.1	89%	0.893	70%	0.7	S	S	*	*			trans	-84.5	106.7	163.9	-91.1	-20.7	0	0	0	108.7
647	T	38.1	Very low	46.4	Very low	133 Å²	133	126.2 Å²	126.2	82%	0.816	71%	0.707	S	S	*	*			trans	-158.9	117.8	140.6	18.6	0	0	0	0	110.4
648	E	35.5	Very low	45.4	Very low	196 Å²	196	126.1 Å²	126.1	92%	0.916	70%	0.704	S	S	*	*			trans	92.7	120.7	160.8	-56.2	-166.5	169	0	0	119.9
649	L	41.7	Very low	44.5	Very low	170 Å²	170	128.2 Å²	128.2	89%	0.89	72%	0.715	S	S	*	*			trans	-84.1	140.9	-174.2	-69.9	150.9	0	0	0	111.8
650	S	31.8	Very low	43.9	Very low	103 Å²	103	130.5 Å²	130.5	72%	0.72	72%	0.72	S	S	*	*				167.5	126	117.4	51.1	0	0	0	0	113.9
651	I	37.7	Very low	43	Very low	161 Å²	161	127.5 Å²	127.5	83%	0.826	71%	0.714	S	S	*	*			trans	55.8	108.2	142.1	-49.3	161.6	0	0	0	115.6
652	V	35.8	Very low	42.1	Very low	121 Å²	121	125 Å²	125	73%	0.733	70%	0.702	S	S	*	*				-159.2	143.4	66.2	173	0	0	0	0	109.3	S654	V652-S654 PolarHBondContact O-N 2.7Å; V652-S654 VanDerWaalsContact O-N 3.12Å
653	E	45.5	Very low	41.4	Very low	195 Å²	195	122.2 Å²	122.2	91%	0.911	69%	0.691	S	S	*	*			trans	-47.1	108.3	165.6	-67.1	172.1	138.8	0	0	112.6
654	S	36.8	Very low	40.9	Very low	100 Å²	100	123.1 Å²	123.1	70%	0.699	69%	0.688	S	S	*	*			trans	-153.6	107.3	155	57.3	0	0	0	0	112.9	V652	V652-S654 PolarHBondContact O-N 2.7Å; V652-S654 VanDerWaalsContact O-N 3.12Å
655	S	39.9	Very low	40.5	Very low	62 Å²	62	120.5 Å²	120.5	43%	0.434	68%	0.675	S	S	.	*			trans	74.1	92.7	155.3	70.4	0	0	0	0	119	I657 S658	S655-I657 PolarHBondContact O-N 3.2Å; S655-S658 PolarHBondContact O-N 2.86Å; S655-S658 PolarHBondContact O-OG 3.48Å; S655-S658 WeakPolarHBondContact OG-CB 3.2Å; S655-S658 PolarHBondContact OG-OG 3.38Å
656	V	44.6	Very low	40.5	Very low	114 Å²	114	121.7 Å²	121.7	69%	0.691	67%	0.666	S	S	*	*	H	α-helix	trans	-51	-19.1	150.1	179.1	0	0	0	0	111.8	L660	V656-L660 HydrophobicContact CG1-CD1 4.09Å; V656-L660 WeakPolarHBondContact O-CB 3.46Å; V656-L660 WeakPolarHBondContact O-CG 3.46Å; V656-L660 PolarHBondContact O-N 2.95Å; V656-L660 VanDerWaalsContact O-N 3.11Å
657	I	49.3	Very low	40.4	Very low	122 Å²	122	116.3 Å²	116.3	63%	0.626	64%	0.642	S	S	*	*	H	α-helix	trans	-70.2	-35.7	173.7	-57.2	174.5	0	0	0	111.7	S655 L660 Q661	S655-I657 PolarHBondContact O-N 3.2Å; I657-L660 PolarHBondContact O-N 3.03Å; I657-Q661 WeakPolarHBondContact O-CB 3.43Å; I657-Q661 PolarHBondContact O-N 2.56Å
658	S	44.4	Very low	40.5	Very low	50 Å²	50	116.7 Å²	116.7	35%	0.35	63%	0.634	S	S	.	*	H	α-helix	trans	-72.3	-35.9	178.2	67.4	0	0	0	0	112.3	S655 Q661 E662	S655-S658 PolarHBondContact O-N 2.86Å; S655-S658 PolarHBondContact O-OG 3.48Å; S655-S658 WeakPolarHBondContact OG-CB 3.2Å; S655-S658 PolarHBondContact OG-OG 3.38Å; S658-Q661 PolarHBondContact O-N 2.91Å; S658-E662 WeakPolarHBondContact O-CB 3.39Å; S658-E662 WeakPolarHBondContact O-CG 3.35Å; S658-E662 PolarHBondContact O-N 2.89Å
659	L	45.2	Very low	40.7	Very low	121 Å²	121	113.2 Å²	113.2	63%	0.634	62%	0.622	S	S	*	*	H	α-helix	trans	-72.2	-32.6	174.6	-75.2	167.5	0	0	0	112.9	A663	L659-A663 VanDerWaalsContact O-CB 3.27Å; L659-A663 WeakPolarHBondContact O-CB 3.35Å; L659-A663 PolarHBondContact O-N 2.82Å
660	L	44.2	Very low	40.7	Very low	102 Å²	102	108 Å²	108	53%	0.534	60%	0.599	S	S	.	*	H	α-helix	trans	-72.3	-36.2	170.4	-77.9	167.6	0	0	0	111.8	V656 I657 A663 E664	V656-L660 HydrophobicContact CG1-CD1 4.09Å; V656-L660 WeakPolarHBondContact O-CB 3.46Å; V656-L660 WeakPolarHBondContact O-CG 3.46Å; V656-L660 PolarHBondContact O-N 2.95Å; V656-L660 VanDerWaalsContact O-N 3.11Å; I657-L660 PolarHBondContact O-N 3.03Å; L660-A663 PolarHBondContact O-N 3.02Å; L660-E664 WeakPolarHBondContact O-CB 3.5Å; L660-E664 WeakPolarHBondContact O-CG 3.4Å; L660-E664 PolarHBondContact O-N 3.4Å
661	Q	42.2	Very low	41.5	Very low	126 Å²	126	108.2 Å²	108.2	59%	0.589	59%	0.589	S	S	*	*	H	α-helix	trans	-74.9	-27.7	177.5	-158.3	166.8	17.3	0	0	112.1	I657 S658 S665	I657-Q661 WeakPolarHBondContact O-CB 3.43Å; I657-Q661 PolarHBondContact O-N 2.56Å; S658-Q661 PolarHBondContact O-N 2.91Å; Q661-S665 VanDerWaalsContact O-CB 3.27Å; Q661-S665 WeakPolarHBondContact O-CB 3.22Å; Q661-S665 PolarHBondContact O-N 2.78Å; Q661-S665 PolarHBondContact O-OG 3.02Å
662	E	38.6	Very low	42.2	Very low	111 Å²	111	107.1 Å²	107.1	52%	0.519	58%	0.584	S	S	.	*	H	α-helix	trans	-77	-31.6	167.6	-81.1	-170	162.3	0	0	113.3	S658 S665 K666	S658-E662 WeakPolarHBondContact O-CB 3.39Å; S658-E662 WeakPolarHBondContact O-CG 3.35Å; S658-E662 PolarHBondContact O-N 2.89Å; E662-S665 WeakPolarHBondContact CA-OG 3.47Å; E662-S665 PolarHBondContact O-OG 3.17Å; E662-K666 VanDerWaalsContact O-CB 3.29Å; E662-K666 WeakPolarHBondContact O-CB 3.31Å; E662-K666 WeakPolarHBondContact O-CG 3.07Å; E662-K666 PolarHBondContact O-N 2.64Å
663	A	40.7	Very low	43.5	Very low	60 Å²	60	103.2 Å²	103.2	50%	0.496	56%	0.559	S	S	.	*	H	α-helix	trans	-73.2	-30.8	170.4	0	0	0	0	0	112.2	L659 L660 S667	L659-A663 VanDerWaalsContact O-CB 3.27Å; L659-A663 WeakPolarHBondContact O-CB 3.35Å; L659-A663 PolarHBondContact O-N 2.82Å; L660-A663 PolarHBondContact O-N 3.02Å; A663-S667 WeakPolarHBondContact O-CB 3.15Å; A663-S667 PolarHBondContact O-N 3.34Å
664	E	40.1	Very low	44.8	Very low	134 Å²	134	94.7 Å²	94.7	63%	0.626	52%	0.521	S	S	*	.	H	α-helix	trans	-76.1	-38.5	171.6	-79.3	-179.5	167.1	0	0	112.1	L660 S667	L660-E664 WeakPolarHBondContact O-CB 3.5Å; L660-E664 WeakPolarHBondContact O-CG 3.4Å; L660-E664 PolarHBondContact O-N 3.4Å; E664-S667 VanDerWaalsContact O-CB 3.26Å; E664-S667 WeakPolarHBondContact O-CB 3.31Å; E664-S667 PolarHBondContact O-N 3.06Å; E664-S667 VanDerWaalsContact O-N 3.14Å; E664-S667 PolarHBondContact O-OG 3.23Å
665	S	38	Very low	46.8	Very low	71 Å²	71	90 Å²	90	50%	0.497	49%	0.488	S	S	.	.	H	α-helix	trans	-71.9	-29.8	174.4	70	0	0	0	0	112.7	Q661 E662 S667	Q661-S665 VanDerWaalsContact O-CB 3.27Å; Q661-S665 WeakPolarHBondContact O-CB 3.22Å; Q661-S665 PolarHBondContact O-N 2.78Å; Q661-S665 PolarHBondContact O-OG 3.02Å; E662-S665 WeakPolarHBondContact CA-OG 3.47Å; E662-S665 PolarHBondContact O-OG 3.17Å; S665-S667 VanDerWaalsContact C-N 3.34Å
666	K	40.3	Very low	48.8	Very low	136 Å²	136	91.6 Å²	91.6	59%	0.591	49%	0.485	S	S	*	.	G	3₁₀ helix	trans	-83.6	-5.8	168	-69.2	179.2	-179	169.8	0	113.9	E662 E668 L669	E662-K666 VanDerWaalsContact O-CB 3.29Å; E662-K666 WeakPolarHBondContact O-CB 3.31Å; E662-K666 WeakPolarHBondContact O-CG 3.07Å; E662-K666 PolarHBondContact O-N 2.64Å; K666-E668 PolarHBondContact O-N 3.47Å; K666-L669 PolarHBondContact O-N 3.06Å
667	S	38.8	Very low	50.9	Low	55 Å²	55	86.2 Å²	86.2	39%	0.385	45%	0.452	S	S	.	.	G	3₁₀ helix	trans	-68.7	-11.9	172.2	84.1	0	0	0	0	112.7	A663 E664 S665 L669 S670	A663-S667 WeakPolarHBondContact O-CB 3.15Å; A663-S667 PolarHBondContact O-N 3.34Å; E664-S667 VanDerWaalsContact O-CB 3.26Å; E664-S667 WeakPolarHBondContact O-CB 3.31Å; E664-S667 PolarHBondContact O-N 3.06Å; E664-S667 VanDerWaalsContact O-N 3.14Å; E664-S667 PolarHBondContact O-OG 3.23Å; S665-S667 VanDerWaalsContact C-N 3.34Å; S667-L669 PolarHBondContact O-N 3.48Å; S667-S670 VanDerWaalsContact O-CB 3.28Å; S667-S670 WeakPolarHBondContact O-CB 3.41Å; S667-S670 PolarHBondContact O-N 3.46Å; S667-S670 PolarHBondContact O-OG 3.15Å
668	E	39.6	Very low	52.8	Low	140 Å²	140	82 Å²	82	65%	0.654	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-60.1	-28.2	169.8	-66.9	-169.3	160.1	0	0	112.6	K666 S670 Q671	K666-E668 PolarHBondContact O-N 3.47Å; E668-S670 PolarHBondContact O-N 3.41Å; E668-Q671 WeakPolarHBondContact O-CB 3.46Å; E668-Q671 VanDerWaalsContact O-CG 3.32Å; E668-Q671 WeakPolarHBondContact O-CG 3.31Å; E668-Q671 PolarHBondContact O-N 3.38Å
669	L	39.1	Very low	55.1	Low	124 Å²	124	79.7 Å²	79.7	65%	0.649	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-73.3	-11.2	173	-88.3	134.6	0	0	0	114	M638 K666 S667 Q671	M638-L669 HydrophobicContact CE-CB 4.36Å; K666-L669 PolarHBondContact O-N 3.06Å; S667-L669 PolarHBondContact O-N 3.48Å; L669-Q671 PolarHBondContact O-N 3.24Å
670	S	42.7	Very low	57.3	Low	60 Å²	60	74.3 Å²	74.3	42%	0.42	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-77.4	-5.7	174.6	75.9	0	0	0	0	113.6	S667 E668 N672	S667-S670 VanDerWaalsContact O-CB 3.28Å; S667-S670 WeakPolarHBondContact O-CB 3.41Å; S667-S670 PolarHBondContact O-N 3.46Å; S667-S670 PolarHBondContact O-OG 3.15Å; E668-S670 PolarHBondContact O-N 3.41Å; S670-N672 VanDerWaalsContact C-N 3.26Å; S670-N672 PolarHBondContact O-N 3.26Å
671	Q	47.2	Very low	59.5	Low	108 Å²	108	69.5 Å²	69.5	51%	0.505	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-68.9	-16.4	-178.3	-69	-174.6	1.3	0	0	114.8	R598 E668 L669	R598-Q671 PolarHBondContact NH2-O 3.2Å; R598-Q671 VanDerWaalsContact NH2-O 3.07Å; E668-Q671 WeakPolarHBondContact O-CB 3.46Å; E668-Q671 VanDerWaalsContact O-CG 3.32Å; E668-Q671 WeakPolarHBondContact O-CG 3.31Å; E668-Q671 PolarHBondContact O-N 3.38Å; L669-Q671 PolarHBondContact O-N 3.24Å
672	N	52.6	Low	61.8	Low	137 Å²	137	63.5 Å²	63.5	73%	0.733	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-85.3	-3.8	-174.9	-76.3	-17.2	0	0	0	115.4	S670 S674	S670-N672 VanDerWaalsContact C-N 3.26Å; S670-N672 PolarHBondContact O-N 3.26Å; N672-S674 PolarHBondContact O-N 3.06Å
673	I	64.5	Low	64.1	Low	39 Å²	39	58.7 Å²	58.7	20%	0.2	31%	0.31	C	S	.	.			trans	-87	98.9	176.9	-48.2	176.7	0	0	0	108.7	L627 K630 Q631 T634	L627-I673 HydrophobicContact CD1-CG2 3.66Å; K630-I673 HydrophobicContact CB-CG2 4.2Å; Q631-I673 HydrophobicContact CG-CD1 4.14Å; Q631-I673 HydrophobicContact CG-CG2 4.49Å; T634-I673 HydrophobicContact CG2-CD1 4.2Å; T634-I673 WeakPolarHBondContact OG1-CD1 3.36Å
674	S	71.3	Confident	66.2	Low	16 Å²	16	60.6 Å²	60.6	11%	0.112	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-96.9	149.3	178.4	55.3	0	0	0	0	112.1	Y582 N672 G695	Y582-S674 WeakPolarHBondContact OH-CB 3.22Å; Y582-S674 PolarHBondContact OH-OG 3.09Å; N672-S674 PolarHBondContact O-N 3.06Å; S674-G695 WeakPolarHBondContact OG-CA 3.43Å; S674-G695 PolarHBondContact OG-N 3.26Å; S674-G695 VanDerWaalsContact OG-N 3.08Å
675	A	78.5	Confident	68.2	Low	2 Å²	2	60.5 Å²	60.5	2%	0.017	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-79.3	143	-178.6	0	0	0	0	0	110	L579 L627 E677	L579-A675 HydrophobicContact CD1-CB 3.5Å; L627-A675 HydrophobicContact CD1-CB 4.34Å; L627-A675 HydrophobicContact CD2-CB 4.2Å; A675-E677 PolarHBondContact O-N 3.07Å
676	R	83.9	Confident	70.1	Confident	95 Å²	95	57.3 Å²	57.3	36%	0.358	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-70.4	120.3	171.4	-173.2	174.7	-175.5	-167	1.4	109.4	T692 V693 E694	R676-T692 PolarHBondContact NH2-OG1 2.82Å; R676-T692 VanDerWaalsContact NH2-OG1 3.15Å; R676-V693 WeakPolarHBondContact CA-O 3.39Å; R676-E694 HydrophobicContact CB-CB 4.29Å; R676-E694 HydrophobicContact CB-CG 4.31Å; R676-E694 HydrophobicContact CG-CB 4.26Å
677	E	88.1	Confident	72.2	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.005	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	164.5	176.1	-69.7	-170.6	95.7	0	0	110.6	S577 H578 L579 Y582 W618 A675 T692 V693	S577-E677 VanDerWaalsContact CB-OE2 3.3Å; S577-E677 WeakPolarHBondContact CB-OE2 3.27Å; S577-E677 PolarHBondContact OG-OE2 3.39Å; H578-E677 PolarHBondContact N-OE1 3.3Å; L579-E677 WeakPolarHBondContact CB-OE1 3.11Å; L579-E677 HydrophobicContact CD1-CG 3.96Å; L579-E677 HydrophobicContact CG-CG 4.32Å; L579-E677 WeakPolarHBondContact CG-OE1 3.46Å; L579-E677 PolarHBondContact N-OE1 2.9Å; Y582-E677 HydrophobicContact CD2-CB 4.5Å; Y582-E677 VanDerWaalsContact CD2-OE2 3.31Å; Y582-E677 WeakPolarHBondContact CD2-OE2 3.44Å; Y582-E677 HydrophobicContact CE2-CB 4.48Å; W618-E677 HydrophobicContact CE3-CB 4.15Å; W618-E677 HydrophobicContact CZ3-CB 3.92Å; A675-E677 PolarHBondContact O-N 3.07Å; E677-T692 WeakPolarHBondContact O-CA 3.26Å; E677-V693 PolarHBondContact N-O 2.91Å; E677-V693 PolarHBondContact O-N 3.2Å
678	H	89.8	Confident	74.5	Confident	33 Å²	33	51.1 Å²	51.1	15%	0.153	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	145.4	-176.4	-54.8	-100.5	0	0	0	109	S619 H690 L691 T692	S619-H678 WeakPolarHBondContact CB-O 3.25Å; S619-H678 PolarHBondContact N-O 3.12Å; H678-H690 AromaticContact CG-NE2 3.83Å; H678-H690 AromaticContact ND1-CE1 3.8Å; H678-H690 AromaticContact ND1-NE2 3.43Å; H678-H690 PolarHBondContact ND1-NE2 3.04Å; H678-L691 VanDerWaalsContact CA-O 3.31Å; H678-L691 WeakPolarHBondContact CA-O 3.48Å; H678-T692 WeakPolarHBondContact CE1-CG2 3.4Å; H678-T692 WeakPolarHBondContact ND1-CG2 3.26Å
679	F	91.3	Very high	76.8	Confident	3 Å²	3	45.3 Å²	45.3	1%	0.013	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	157.5	168.3	70.6	-91.5	0	0	0	110.6	L592 L616 E617 W618 F681 L691 V693	L592-F679 HydrophobicContact CD2-CE2 4.35Å; L592-F679 HydrophobicContact CD2-CZ 4.08Å; L616-F679 HydrophobicContact CD1-CD2 3.76Å; L616-F679 HydrophobicContact CD1-CE2 3.73Å; L616-F679 HydrophobicContact CD2-CD2 4.3Å; L616-F679 HydrophobicContact CG-CD2 3.91Å; L616-F679 HydrophobicContact CG-CE2 4.38Å; E617-F679 WeakPolarHBondContact O-CA 3.33Å; W618-F679 HydrophobicContact CD2-CB 3.76Å; W618-F679 HydrophobicContact CE3-CB 3.73Å; W618-F679 HydrophobicContact CE3-CD1 4.21Å; W618-F679 HydrophobicContact CE3-CG 4.43Å; W618-F679 HydrophobicContact CG-CB 4.16Å; W618-F679 AromaticContact CH2-CD1 3.77Å; W618-F679 HydrophobicContact CH2-CD1 3.77Å; W618-F679 HydrophobicContact CH2-CE1 4.39Å; W618-F679 HydrophobicContact CZ2-CD1 4.2Å; W618-F679 HydrophobicContact CZ3-CB 4.19Å; W618-F679 AromaticContact CZ3-CD1 3.78Å; W618-F679 HydrophobicContact CZ3-CD1 3.78Å; W618-F679 HydrophobicContact CZ3-CG 4.43Å; F679-F681 HydrophobicContact CD2-CD1 4.44Å; F679-F681 AromaticContact CE2-CD1 3.87Å; F679-F681 HydrophobicContact CE2-CD1 3.87Å; F679-L691 HydrophobicContact CD1-CB 4.42Å; F679-L691 HydrophobicContact CE1-CB 3.97Å; F679-L691 HydrophobicContact CE2-CB 4.34Å; F679-L691 HydrophobicContact CE2-CD2 4.5Å; F679-L691 HydrophobicContact CZ-CB 3.93Å; F679-L691 HydrophobicContact CZ-CD2 3.94Å; F679-L691 HydrophobicContact CZ-CG 4.42Å; F679-L691 PolarHBondContact N-O 3.42Å; F679-L691 PolarHBondContact O-N 2.96Å; F679-V693 HydrophobicContact CD1-CG2 3.84Å; F679-V693 HydrophobicContact CE1-CG2 3.56Å
680	V	91.4	Very high	79.1	Confident	7 Å²	7	41.3 Å²	41.3	4%	0.042	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	142.2	178.3	168.5	0	0	0	0	108.7	L616 E617 V688 Y689 H690 W718	L616-V680 WeakPolarHBondContact CA-O 3.41Å; E617-V680 PolarHBondContact N-O 3.07Å; E617-V680 PolarHBondContact O-N 3.35Å; V680-V688 HydrophobicContact CG1-CG1 3.22Å; V680-Y689 WeakPolarHBondContact CA-O 3.45Å; V680-H690 HydrophobicContact CG2-CB 4.19Å; V680-W718 HydrophobicContact CB-CZ3 4.24Å; V680-W718 HydrophobicContact CG2-CE3 4.27Å; V680-W718 HydrophobicContact CG2-CH2 4.19Å; V680-W718 HydrophobicContact CG2-CZ3 3.54Å
681	F	91.6	Very high	81.3	Confident	1 Å²	1	38.9 Å²	38.9	0%	0.004	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	161.4	171.9	78	-95.7	0	0	0	111.4	F610 P611 I613 A615 L616 F679 Y689 L691	F610-F681 AromaticContact CE1-CE1 3.85Å; F610-F681 HydrophobicContact CE1-CE1 3.85Å; F610-F681 HydrophobicContact CE1-CE2 4.09Å; F610-F681 AromaticContact CE1-CZ 3.55Å; F610-F681 HydrophobicContact CE1-CZ 3.55Å; F610-F681 HydrophobicContact CE2-CE1 4.36Å; F610-F681 HydrophobicContact CE2-CZ 4.22Å; F610-F681 HydrophobicContact CZ-CD1 4.39Å; F610-F681 AromaticContact CZ-CE1 3.38Å; F610-F681 HydrophobicContact CZ-CE1 3.38Å; F610-F681 HydrophobicContact CZ-CE2 4.33Å; F610-F681 AromaticContact CZ-CZ 3.36Å; F610-F681 HydrophobicContact CZ-CZ 3.36Å; P611-F681 HydrophobicContact CB-CE2 4.33Å; I613-F681 HydrophobicContact CB-CD2 4.44Å; I613-F681 HydrophobicContact CG1-CD2 3.85Å; I613-F681 HydrophobicContact CG1-CE2 4.19Å; I613-F681 HydrophobicContact CG1-CG 4.34Å; I613-F681 HydrophobicContact CG2-CB 4Å; I613-F681 HydrophobicContact CG2-CD2 4.26Å; I613-F681 HydrophobicContact CG2-CG 4.45Å; A615-F681 CarbonylContact O-C 3.54Å; A615-F681 WeakPolarHBondContact O-CA 3.49Å; A615-F681 VanDerWaalsContact O-CB 3.3Å; A615-F681 WeakPolarHBondContact O-CB 3.4Å; L616-F681 HydrophobicContact CB-CB 4.12Å; L616-F681 HydrophobicContact CD1-CB 4.17Å; L616-F681 HydrophobicContact CG-CB 4.15Å; F679-F681 HydrophobicContact CD2-CD1 4.44Å; F679-F681 AromaticContact CE2-CD1 3.87Å; F679-F681 HydrophobicContact CE2-CD1 3.87Å; F681-Y689 HydrophobicContact CD2-CD2 4.05Å; F681-Y689 HydrophobicContact CD2-CG 4.49Å; F681-Y689 VanDerWaalsContact CE1-CB 3.45Å; F681-Y689 HydrophobicContact CE1-CD2 4.47Å; F681-Y689 AromaticContact CE1-CG 3.99Å; F681-Y689 HydrophobicContact CE1-CG 3.99Å; F681-Y689 AromaticContact CE2-CD2 3.45Å; F681-Y689 HydrophobicContact CE2-CD2 3.45Å; F681-Y689 VanDerWaalsContact CE2-CD2 3.45Å; F681-Y689 HydrophobicContact CE2-CE2 4.07Å; F681-Y689 AromaticContact CE2-CG 3.78Å; F681-Y689 HydrophobicContact CE2-CG 3.78Å; F681-Y689 HydrophobicContact CZ-CD1 4.07Å; F681-Y689 AromaticContact CZ-CD2 3.7Å; F681-Y689 HydrophobicContact CZ-CD2 3.7Å; F681-Y689 HydrophobicContact CZ-CE2 4.44Å; F681-Y689 AromaticContact CZ-CG 3.5Å; F681-Y689 HydrophobicContact CZ-CG 3.5Å; F681-Y689 VanDerWaalsContact CZ-CG 3.5Å; F681-Y689 PolarHBondContact N-O 3.21Å; F681-Y689 PolarHBondContact O-N 2.98Å; F681-L691 HydrophobicContact CD1-CD1 3.85Å; F681-L691 HydrophobicContact CE1-CD1 3.36Å; F681-L691 HydrophobicContact CE1-CD2 4.38Å; F681-L691 HydrophobicContact CZ-CD1 4.43Å
682	T	89.7	Confident	83.3	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	151.3	175.6	48	0	0	0	0	112.1	I613 T614 A615 Q687 V688 I713 I716	I613-T682 WeakPolarHBondContact CA-O 3.34Å; T614-T682 PolarHBondContact N-O 3.32Å; T614-T682 PolarHBondContact OG1-O 3.18Å; T614-T682 VanDerWaalsContact OG1-O 3.13Å; T614-T682 PolarHBondContact OG1-OG1 3.23Å; A615-T682 PolarHBondContact O-N 3.01Å; T682-Q687 VanDerWaalsContact CA-O 3.29Å; T682-Q687 WeakPolarHBondContact CA-O 3.39Å; T682-V688 HydrophobicContact CG2-CB 4.31Å; T682-V688 HydrophobicContact CG2-CG2 3.68Å; T682-I713 HydrophobicContact CG2-CB 4.29Å; T682-I713 HydrophobicContact CG2-CD1 3.57Å; T682-I713 HydrophobicContact CG2-CG2 4.16Å; T682-I716 HydrophobicContact CG2-CD1 3.65Å
683	D	87.9	Confident	84.9	Confident	11 Å²	11	27.5 Å²	27.5	6%	0.059	14%	0.137	C	C	.	.			trans	-97.1	-178.8	170.3	65.5	13.4	0	0	0	112.6	P611 A612 T614 D685 G686 Q687 Y689	P611-D683 HydrophobicContact CB-CB 3.97Å; A612-D683 VanDerWaalsContact O-CA 3.31Å; A612-D683 WeakPolarHBondContact O-CA 3.41Å; T614-D683 PolarHBondContact OG1-O 2.93Å; D683-D685 PolarHBondContact O-N 3.4Å; D683-D685 PolarHBondContact OD1-N 3.34Å; D683-D685 VanDerWaalsContact OD1-N 3.11Å; D683-G686 PolarHBondContact O-N 3Å; D683-G686 VanDerWaalsContact O-N 3.14Å; D683-G686 PolarHBondContact OD1-N 2.89Å; D683-G686 VanDerWaalsContact OD1-N 3.09Å; D683-Q687 PolarHBondContact N-O 3.22Å; D683-Q687 WeakPolarHBondContact OD1-CB 3.41Å; D683-Q687 PolarHBondContact OD1-N 2.89Å; D683-Y689 HydrophobicContact CB-CE2 3.99Å; D683-Y689 VanDerWaalsContact OD2-CE2 3.24Å; D683-Y689 WeakPolarHBondContact OD2-CE2 3.38Å; D683-Y689 PolarHBondContact OD2-OH 3.36Å
684	N	83.9	Confident	85.9	Confident	99 Å²	99	28.1 Å²	28.1	53%	0.529	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-26.6	178.1	-71.3	-14.6	0	0	0	113	T614 G686 S712	T614-N684 WeakPolarHBondContact CG2-OD1 3.39Å; N684-G686 VanDerWaalsContact C-N 3.26Å; N684-S712 PolarHBondContact O-OG 2.79Å
685	D	81.5	Confident	86.3	Confident	133 Å²	133	28.1 Å²	28.1	71%	0.711	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.7	1.2	179.6	-61.3	-36	0	0	0	112.2	D683 Q687	D683-D685 PolarHBondContact O-N 3.4Å; D683-D685 PolarHBondContact OD1-N 3.34Å; D683-D685 VanDerWaalsContact OD1-N 3.11Å; D685-Q687 VanDerWaalsContact C-N 3.3Å; D685-Q687 PolarHBondContact O-N 3.37Å
686	G	77.6	Confident	86.3	Confident	3 Å²	3	33 Å²	33	3%	0.031	17%	0.167	C	C	.	.			trans	77.4	11.4	179.4	0	0	0	0	0	114.2	D683 N684	D683-G686 PolarHBondContact O-N 3Å; D683-G686 VanDerWaalsContact O-N 3.14Å; D683-G686 PolarHBondContact OD1-N 2.89Å; D683-G686 VanDerWaalsContact OD1-N 3.09Å; N684-G686 VanDerWaalsContact C-N 3.26Å
687	Q	85.2	Confident	86.1	Confident	54 Å²	54	30.7 Å²	30.7	25%	0.252	17%	0.166	S	C	.	.	P	Polyproline II helix	trans	-75.4	132.4	176.9	-167.4	169.3	40.8	0	0	110.4	T682 D683 D685 Y689 I704	T682-Q687 VanDerWaalsContact CA-O 3.29Å; T682-Q687 WeakPolarHBondContact CA-O 3.39Å; D683-Q687 PolarHBondContact N-O 3.22Å; D683-Q687 WeakPolarHBondContact OD1-CB 3.41Å; D683-Q687 PolarHBondContact OD1-N 2.89Å; D685-Q687 VanDerWaalsContact C-N 3.3Å; D685-Q687 PolarHBondContact O-N 3.37Å; Q687-Y689 HydrophobicContact CB-CE2 4.01Å; Q687-Y689 HydrophobicContact CG-CE2 4.19Å; Q687-Y689 WeakPolarHBondContact O-CD2 3.49Å; Q687-Y689 PolarHBondContact OE1-OH 3.12Å; Q687-Y689 VanDerWaalsContact OE1-OH 3.11Å; Q687-I704 WeakPolarHBondContact CG-O 3.49Å
688	V	86.4	Confident	85.8	Confident	7 Å²	7	31.7 Å²	31.7	4%	0.042	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	119.7	-177.2	-177.9	0	0	0	0	110	V680 T682 R703 I704 L725	V680-V688 HydrophobicContact CG1-CG1 3.22Å; T682-V688 HydrophobicContact CG2-CB 4.31Å; T682-V688 HydrophobicContact CG2-CG2 3.68Å; V688-R703 WeakPolarHBondContact O-CA 3.47Å; V688-I704 HydrophobicContact CB-CB 4.22Å; V688-I704 HydrophobicContact CB-CD1 4.39Å; V688-I704 HydrophobicContact CG1-CD1 4.2Å; V688-I704 PolarHBondContact N-O 2.95Å; V688-I704 PolarHBondContact O-N 3.15Å; V688-L725 HydrophobicContact CG2-CD1 4.34Å
689	Y	87.8	Confident	85.5	Confident	18 Å²	18	36.5 Å²	36.5	7%	0.071	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	138.8	178.3	-63.6	-100.5	0	0	0	110.9	P611 V680 F681 D683 Q687 R703	P611-Y689 HydrophobicContact CG-CE1 4.27Å; P611-Y689 HydrophobicContact CG-CE2 4.4Å; V680-Y689 WeakPolarHBondContact CA-O 3.45Å; F681-Y689 HydrophobicContact CD2-CD2 4.05Å; F681-Y689 HydrophobicContact CD2-CG 4.49Å; F681-Y689 VanDerWaalsContact CE1-CB 3.45Å; F681-Y689 HydrophobicContact CE1-CD2 4.47Å; F681-Y689 AromaticContact CE1-CG 3.99Å; F681-Y689 HydrophobicContact CE1-CG 3.99Å; F681-Y689 AromaticContact CE2-CD2 3.45Å; F681-Y689 HydrophobicContact CE2-CD2 3.45Å; F681-Y689 VanDerWaalsContact CE2-CD2 3.45Å; F681-Y689 HydrophobicContact CE2-CE2 4.07Å; F681-Y689 AromaticContact CE2-CG 3.78Å; F681-Y689 HydrophobicContact CE2-CG 3.78Å; F681-Y689 HydrophobicContact CZ-CD1 4.07Å; F681-Y689 AromaticContact CZ-CD2 3.7Å; F681-Y689 HydrophobicContact CZ-CD2 3.7Å; F681-Y689 HydrophobicContact CZ-CE2 4.44Å; F681-Y689 AromaticContact CZ-CG 3.5Å; F681-Y689 HydrophobicContact CZ-CG 3.5Å; F681-Y689 VanDerWaalsContact CZ-CG 3.5Å; F681-Y689 PolarHBondContact N-O 3.21Å; F681-Y689 PolarHBondContact O-N 2.98Å; D683-Y689 HydrophobicContact CB-CE2 3.99Å; D683-Y689 VanDerWaalsContact OD2-CE2 3.24Å; D683-Y689 WeakPolarHBondContact OD2-CE2 3.38Å; D683-Y689 PolarHBondContact OD2-OH 3.36Å; Q687-Y689 HydrophobicContact CB-CE2 4.01Å; Q687-Y689 HydrophobicContact CG-CE2 4.19Å; Q687-Y689 WeakPolarHBondContact O-CD2 3.49Å; Q687-Y689 PolarHBondContact OE1-OH 3.12Å; Q687-Y689 VanDerWaalsContact OE1-OH 3.11Å; Y689-R703 HydrophobicContact CD1-CG 3.82Å; Y689-R703 HydrophobicContact CE1-CG 4.07Å
690	H	88.7	Confident	84.9	Confident	41 Å²	41	40.3 Å²	40.3	19%	0.19	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	117.2	177.4	172.5	-121.7	0	0	0	111.2	H678 V680 S701 A702	H678-H690 AromaticContact CG-NE2 3.83Å; H678-H690 AromaticContact ND1-CE1 3.8Å; H678-H690 AromaticContact ND1-NE2 3.43Å; H678-H690 PolarHBondContact ND1-NE2 3.04Å; V680-H690 HydrophobicContact CG2-CB 4.19Å; H690-S701 WeakPolarHBondContact ND1-CB 3.39Å; H690-S701 WeakPolarHBondContact O-CB 3.21Å; H690-S701 PolarHBondContact O-N 3.49Å; H690-A702 HydrophobicContact CB-CB 4.3Å; H690-A702 PolarHBondContact N-O 3.14Å; H690-A702 PolarHBondContact O-N 3.08Å
691	L	89.1	Confident	84.1	Confident	8 Å²	8	42.8 Å²	42.8	4%	0.042	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	145.8	-177.1	-77.2	76.5	0	0	0	111.3	M606 F610 H678 F679 F681 V698 K699	M606-L691 HydrophobicContact CE-CD2 4.08Å; F610-L691 HydrophobicContact CE2-CD2 4.46Å; F610-L691 HydrophobicContact CZ-CD2 4.35Å; H678-L691 VanDerWaalsContact CA-O 3.31Å; H678-L691 WeakPolarHBondContact CA-O 3.48Å; F679-L691 HydrophobicContact CD1-CB 4.42Å; F679-L691 HydrophobicContact CE1-CB 3.97Å; F679-L691 HydrophobicContact CE2-CB 4.34Å; F679-L691 HydrophobicContact CE2-CD2 4.5Å; F679-L691 HydrophobicContact CZ-CB 3.93Å; F679-L691 HydrophobicContact CZ-CD2 3.94Å; F679-L691 HydrophobicContact CZ-CG 4.42Å; F679-L691 PolarHBondContact N-O 3.42Å; F679-L691 PolarHBondContact O-N 2.96Å; F681-L691 HydrophobicContact CD1-CD1 3.85Å; F681-L691 HydrophobicContact CE1-CD1 3.36Å; F681-L691 HydrophobicContact CE1-CD2 4.38Å; F681-L691 HydrophobicContact CZ-CD1 4.43Å; L691-V698 HydrophobicContact CD2-CG1 3.81Å; L691-K699 WeakPolarHBondContact CA-O 3.49Å
692	T	87.9	Confident	83.4	Confident	6 Å²	6	44.8 Å²	44.8	4%	0.037	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	134.1	170.5	74.8	0	0	0	0	111.2	R676 E677 H678 V698 K699 S701	R676-T692 PolarHBondContact NH2-OG1 2.82Å; R676-T692 VanDerWaalsContact NH2-OG1 3.15Å; E677-T692 WeakPolarHBondContact O-CA 3.26Å; H678-T692 WeakPolarHBondContact CE1-CG2 3.4Å; H678-T692 WeakPolarHBondContact ND1-CG2 3.26Å; T692-V698 WeakPolarHBondContact O-CA 3.38Å; T692-K699 PolarHBondContact N-O 2.97Å; T692-K699 PolarHBondContact O-N 2.93Å; T692-S701 WeakPolarHBondContact CG2-OG 3.21Å
693	V	87.4	Confident	83	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	129.9	177.7	178.9	0	0	0	0	109.3	Y582 L594 W618 R676 E677 F679 V698	Y582-V693 HydrophobicContact CD1-CG1 4.33Å; Y582-V693 HydrophobicContact CD2-CG1 3.99Å; Y582-V693 HydrophobicContact CE1-CG1 4.17Å; Y582-V693 HydrophobicContact CE2-CG1 3.8Å; Y582-V693 HydrophobicContact CG-CG1 4.22Å; L594-V693 HydrophobicContact CD2-CG1 3.61Å; L594-V693 HydrophobicContact CD2-CG2 4.04Å; W618-V693 HydrophobicContact CH2-CB 4.47Å; W618-V693 HydrophobicContact CH2-CG2 4.07Å; W618-V693 HydrophobicContact CZ3-CB 4.42Å; W618-V693 HydrophobicContact CZ3-CG2 4.23Å; R676-V693 WeakPolarHBondContact CA-O 3.39Å; E677-V693 PolarHBondContact N-O 2.91Å; E677-V693 PolarHBondContact O-N 3.2Å; F679-V693 HydrophobicContact CD1-CG2 3.84Å; F679-V693 HydrophobicContact CE1-CG2 3.56Å; V693-V698 HydrophobicContact CG2-CG1 4.44Å; V693-V698 HydrophobicContact CG2-CG2 4.27Å
694	E	85.3	Confident	82.5	Confident	53 Å²	53	53.7 Å²	53.7	25%	0.248	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	103.1	170.3	-173.6	174.5	-171.5	0	0	109.2	K630 R676 N696 S697	K630-E694 IonicContact NZ-OE1 3.42Å; K630-E694 PolarHBondContact NZ-OE1 3.43Å; R676-E694 HydrophobicContact CB-CB 4.29Å; R676-E694 HydrophobicContact CB-CG 4.31Å; R676-E694 HydrophobicContact CG-CB 4.26Å; E694-N696 PolarHBondContact O-N 2.92Å; E694-S697 PolarHBondContact N-O 3.18Å; E694-S697 WeakPolarHBondContact O-CB 3.44Å; E694-S697 PolarHBondContact O-N 3.25Å; E694-S697 PolarHBondContact O-OG 3.37Å
695	G	79.9	Confident	81.8	Confident	15 Å²	15	53.4 Å²	53.4	16%	0.155	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.1	-126.4	-171.2	0	0	0	0	0	111.5	Y582 S674 S697	Y582-G695 PolarHBondContact OH-N 2.72Å; S674-G695 WeakPolarHBondContact OG-CA 3.43Å; S674-G695 PolarHBondContact OG-N 3.26Å; S674-G695 VanDerWaalsContact OG-N 3.08Å; G695-S697 PolarHBondContact O-N 2.68Å
696	N	78.3	Confident	81.1	Confident	104 Å²	104	50.1 Å²	50.1	56%	0.556	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-1.7	176	-68.7	7.2	0	0	0	113.3	L603 R604 E694	L603-N696 WeakPolarHBondContact CD2-OD1 3.47Å; R604-N696 PolarHBondContact NE-O 2.91Å; R604-N696 PolarHBondContact NH2-O 2.96Å; E694-N696 PolarHBondContact O-N 2.92Å
697	S	79.4	Confident	80.6	Confident	48 Å²	48	53.1 Å²	53.1	34%	0.336	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	119.1	-177.1	75.9	0	0	0	0	111.8	E694 G695	E694-S697 PolarHBondContact N-O 3.18Å; E694-S697 WeakPolarHBondContact O-CB 3.44Å; E694-S697 PolarHBondContact O-N 3.25Å; E694-S697 PolarHBondContact O-OG 3.37Å; G695-S697 PolarHBondContact O-N 2.68Å
698	V	82.8	Confident	79.5	Confident	21 Å²	21	54.6 Å²	54.6	13%	0.127	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	126.3	174.7	-175.1	0	0	0	0	108.4	L594 R604 M606 L691 T692 V693	L594-V698 HydrophobicContact CD2-CG2 3.84Å; R604-V698 PolarHBondContact NH1-O 3.13Å; M606-V698 HydrophobicContact CE-CG1 4.44Å; L691-V698 HydrophobicContact CD2-CG1 3.81Å; T692-V698 WeakPolarHBondContact O-CA 3.38Å; V693-V698 HydrophobicContact CG2-CG1 4.44Å; V693-V698 HydrophobicContact CG2-CG2 4.27Å
699	K	82.6	Confident	78.7	Confident	135 Å²	135	57.8 Å²	57.8	59%	0.587	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.6	133.4	-178.8	-63.4	-175.4	179.5	-177.6	0	111.5	L691 T692	L691-K699 WeakPolarHBondContact CA-O 3.49Å; T692-K699 PolarHBondContact N-O 2.97Å; T692-K699 PolarHBondContact O-N 2.93Å
700	D	79.3	Confident	78.1	Confident	82 Å²	82	58.3 Å²	58.3	44%	0.439	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	128	169.5	-167.7	-1.3	0	0	0	109	R703	D700-R703 IonicContact OD2-CZ 2.8Å; D700-R703 IonicContact OD2-NE 2.81Å; D700-R703 PolarHBondContact OD2-NE 3.03Å; D700-R703 VanDerWaalsContact OD2-NE 3.13Å; D700-R703 IonicContact OD2-NH2 3.72Å; D700-R703 PolarHBondContact OD2-NH2 3.08Å
701	S	73.4	Confident	77.6	Confident	59 Å²	59	57.3 Å²	57.3	41%	0.413	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	-41.6	-171.3	-59.8	0	0	0	0	113.5	H690 T692	H690-S701 WeakPolarHBondContact ND1-CB 3.39Å; H690-S701 WeakPolarHBondContact O-CB 3.21Å; H690-S701 PolarHBondContact O-N 3.49Å; T692-S701 WeakPolarHBondContact CG2-OG 3.21Å
702	A	78	Confident	77.5	Confident	44 Å²	44	59 Å²	59	36%	0.364	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	149.1	-179.8	0	0	0	0	0	111	H690	H690-A702 HydrophobicContact CB-CB 4.3Å; H690-A702 PolarHBondContact N-O 3.14Å; H690-A702 PolarHBondContact O-N 3.08Å
703	R	79.9	Confident	77.6	Confident	144 Å²	144	58.9 Å²	58.9	54%	0.543	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	129.5	171.1	-58.9	-178.2	-170	-176.3	0.8	108.4	V688 Y689 D700	V688-R703 WeakPolarHBondContact O-CA 3.47Å; Y689-R703 HydrophobicContact CD1-CG 3.82Å; Y689-R703 HydrophobicContact CE1-CG 4.07Å; D700-R703 IonicContact OD2-CZ 2.8Å; D700-R703 IonicContact OD2-NE 2.81Å; D700-R703 PolarHBondContact OD2-NE 3.03Å; D700-R703 VanDerWaalsContact OD2-NE 3.13Å; D700-R703 IonicContact OD2-NH2 3.72Å; D700-R703 PolarHBondContact OD2-NH2 3.08Å
704	I	77.6	Confident	77.8	Confident	53 Å²	53	60.2 Å²	60.2	27%	0.272	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	124.2	178.6	-57.6	118.4	0	0	0	107.6	Q687 V688 W735	Q687-I704 WeakPolarHBondContact CG-O 3.49Å; V688-I704 HydrophobicContact CB-CB 4.22Å; V688-I704 HydrophobicContact CB-CD1 4.39Å; V688-I704 HydrophobicContact CG1-CD1 4.2Å; V688-I704 PolarHBondContact N-O 2.95Å; V688-I704 PolarHBondContact O-N 3.15Å; I704-W735 HydrophobicContact CB-CH2 4Å; I704-W735 HydrophobicContact CB-CZ3 4.43Å; I704-W735 HydrophobicContact CD1-CH2 3.47Å; I704-W735 VanDerWaalsContact CD1-CH2 3.47Å; I704-W735 HydrophobicContact CD1-CZ3 3.91Å; I704-W735 HydrophobicContact CG1-CH2 3.6Å; I704-W735 HydrophobicContact CG1-CZ3 4.33Å; I704-W735 HydrophobicContact CG2-CH2 3.61Å; I704-W735 HydrophobicContact CG2-CZ2 4.22Å; I704-W735 HydrophobicContact CG2-CZ3 4.12Å
705	P	69.6	Low	78.1	Confident	93 Å²	93	58.3 Å²	58.3	60%	0.604	36%	0.357	S	S	*	.	P	Polyproline II helix	trans	-64.6	151.3	-180	27.1	-33.3	0	0	0	111.3
706	P	66.4	Low	78.7	Confident	65 Å²	65	58 Å²	58	42%	0.422	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-59.5	142.3	176.4	23.6	-32.1	0	0	0	111.2
707	D	67.7	Low	79.4	Confident	65 Å²	65	53.2 Å²	53.2	35%	0.348	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-74.7	125.4	169.9	-151.4	-14.3	0	0	0	107.7	S709 M710 N733 S742	D707-S709 PolarHBondContact O-N 2.96Å; D707-M710 HydrophobicContact CB-CG 4.34Å; D707-M710 PolarHBondContact O-N 3.25Å; D707-N733 PolarHBondContact OD2-ND2 2.9Å; D707-S742 PolarHBondContact OD2-OG 3Å; D707-S742 VanDerWaalsContact OD2-OG 3.06Å
708	G	62.7	Low	79.9	Confident	85 Å²	85	52.3 Å²	52.3	88%	0.876	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-6.1	-167.9	0	0	0	0	0	115.6
709	S	69.3	Low	80.3	Confident	75 Å²	75	53 Å²	53	52%	0.524	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-4.6	176.4	67.1	0	0	0	0	114.6	D707	D707-S709 PolarHBondContact O-N 2.96Å
710	M	74.6	Confident	80.4	Confident	29 Å²	29	48.4 Å²	48.4	14%	0.143	31%	0.308	C	S	.	.			trans	-100.5	136.4	-174.7	-72.7	-95.2	130.5	0	0	111.3	D707 D727 N731 N733	D707-M710 HydrophobicContact CB-CG 4.34Å; D707-M710 PolarHBondContact O-N 3.25Å; M710-D727 HydrophobicContact SD-CB 4.49Å; M710-N731 HydrophobicContact CE-CB 3.67Å; M710-N733 HydrophobicContact CE-CB 3.51Å; M710-N733 HydrophobicContact SD-CB 3.72Å
711	G	79	Confident	80.8	Confident	20 Å²	20	48.8 Å²	48.8	21%	0.206	31%	0.31	C	S	.	.			trans	-75	-164.7	166.9	0	0	0	0	0	112.2	I713 D727	G711-I713 PolarHBondContact O-N 2.7Å; G711-D727 PolarHBondContact N-OD2 2.87Å; G711-D727 VanDerWaalsContact N-OD2 3.08Å
712	S	87.2	Confident	81.6	Confident	42 Å²	42	47.1 Å²	47.1	29%	0.294	30%	0.297	S	S	.	.	S	Bend	trans	-62.3	123.1	174.7	-167.3	0	0	0	0	110.4	N684 D727 M728	N684-S712 PolarHBondContact O-OG 2.79Å; S712-D727 WeakPolarHBondContact O-CA 3.42Å; S712-M728 PolarHBondContact O-N 3Å
713	I	90.2	Very high	82.2	Confident	5 Å²	5	45.1 Å²	45.1	3%	0.026	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	128.7	-176.4	-61	169.3	0	0	0	109.2	T614 T682 G711 I716 L725	T614-I713 WeakPolarHBondContact CB-O 3.44Å; T614-I713 PolarHBondContact OG1-O 3.05Å; T614-I713 VanDerWaalsContact OG1-O 3.07Å; T682-I713 HydrophobicContact CG2-CB 4.29Å; T682-I713 HydrophobicContact CG2-CD1 3.57Å; T682-I713 HydrophobicContact CG2-CG2 4.16Å; G711-I713 PolarHBondContact O-N 2.7Å; I713-I716 HydrophobicContact CG2-CG1 4.12Å; I713-L725 HydrophobicContact CD1-CD1 4.12Å; I713-L725 HydrophobicContact CG2-CB 4.45Å
714	T	90.2	Very high	82.8	Confident	28 Å²	28	38.3 Å²	38.3	17%	0.172	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	-26.2	-173.6	56	0	0	0	0	112.5	G726 M728 W751 V752	T714-G726 PolarHBondContact N-O 3.33Å; T714-G726 PolarHBondContact OG1-O 3.21Å; T714-G726 VanDerWaalsContact OG1-O 3.12Å; T714-M728 HydrophobicContact CG2-CB 4.07Å; T714-W751 HydrophobicContact CG2-CZ2 4.5Å; T714-V752 WeakPolarHBondContact CB-O 3.27Å; T714-V752 PolarHBondContact OG1-O 2.97Å
715	C	91.3	Very high	83.4	Confident	13 Å²	13	36.1 Å²	36.1	9%	0.088	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	151.9	179.9	58.1	0	0	0	0	112.3	G726	C715-G726 PolarHBondContact N-O 2.88Å; C715-G726 PolarHBondContact O-N 2.75Å
716	I	93	Very high	84.5	Confident	7 Å²	7	31.7 Å²	31.7	4%	0.036	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	140.4	-178.1	-57.3	173.9	0	0	0	108.6	A615 E617 T682 I713 L723 V724 L725	A615-I716 HydrophobicContact CB-CB 4.4Å; A615-I716 HydrophobicContact CB-CD1 3.81Å; A615-I716 HydrophobicContact CB-CG1 3.64Å; E617-I716 HydrophobicContact CB-CB 4.3Å; E617-I716 HydrophobicContact CB-CG2 4.02Å; T682-I716 HydrophobicContact CG2-CD1 3.65Å; I713-I716 HydrophobicContact CG2-CG1 4.12Å; I716-L723 HydrophobicContact CG2-CD1 3.55Å; I716-L723 HydrophobicContact CG2-CG 4.31Å; I716-V724 WeakPolarHBondContact CA-O 3.47Å; I716-L725 HydrophobicContact CB-CD2 4.28Å; I716-L725 HydrophobicContact CD1-CD2 4.11Å; I716-L725 HydrophobicContact CG1-CD2 3.65Å; I716-L725 HydrophobicContact CG2-CD2 3.94Å
717	A	93.3	Very high	85.7	Confident	4 Å²	4	28.6 Å²	28.6	3%	0.033	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	138.7	169.3	0	0	0	0	0	110.6	V724 I755 F757	A717-V724 PolarHBondContact N-O 3.33Å; A717-V724 PolarHBondContact O-N 2.89Å; A717-I755 HydrophobicContact CB-CB 4.07Å; A717-I755 HydrophobicContact CB-CG2 3.58Å; A717-F757 HydrophobicContact CB-CD2 3.83Å; A717-F757 HydrophobicContact CB-CE2 3.93Å
718	W	91.1	Very high	86.7	Confident	30 Å²	30	29.9 Å²	29.9	11%	0.114	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	125.8	-177.2	-167.1	-6.7	0	0	0	111.4	E617 S619 P620 V680 G720 L723 L737	E617-W718 HydrophobicContact CG-CB 4.15Å; S619-W718 VanDerWaalsContact CA-CE3 3.49Å; S619-W718 VanDerWaalsContact CB-CH2 3.43Å; S619-W718 WeakPolarHBondContact OG-CH2 3.46Å; S619-W718 WeakPolarHBondContact OG-CZ2 3.41Å; P620-W718 HydrophobicContact CG-CG 4.28Å; V680-W718 HydrophobicContact CB-CZ3 4.24Å; V680-W718 HydrophobicContact CG2-CE3 4.27Å; V680-W718 HydrophobicContact CG2-CH2 4.19Å; V680-W718 HydrophobicContact CG2-CZ3 3.54Å; W718-G720 PolarHBondContact NE1-O 3.15Å; W718-L723 HydrophobicContact CB-CD1 3.66Å; W718-L723 HydrophobicContact CD2-CD1 4.04Å; W718-L723 HydrophobicContact CE3-CD1 4.29Å; W718-L723 HydrophobicContact CG-CD1 3.78Å; W718-L737 HydrophobicContact CZ2-CD1 3.55Å
719	K	89.4	Confident	87.9	Confident	36 Å²	36	31 Å²	31	16%	0.157	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	120.9	171	-174.5	169.6	-175.8	176.4	0	112.7	D721 T722 F757 A758 G760 N763	K719-D721 PolarHBondContact O-N 3.02Å; K719-T722 PolarHBondContact N-O 3.13Å; K719-T722 PolarHBondContact O-N 3.25Å; K719-F757 HydrophobicContact CB-CB 4.13Å; K719-F757 HydrophobicContact CB-CD1 3.83Å; K719-F757 HydrophobicContact CB-CD2 3.49Å; K719-F757 VanDerWaalsContact CB-CD2 3.49Å; K719-F757 HydrophobicContact CB-CE1 4.03Å; K719-F757 HydrophobicContact CB-CE2 3.72Å; K719-F757 HydrophobicContact CB-CG 3.55Å; K719-F757 HydrophobicContact CB-CZ 3.97Å; K719-F757 HydrophobicContact CD-CB 3.73Å; K719-F757 HydrophobicContact CD-CD1 3.82Å; K719-F757 HydrophobicContact CD-CG 3.82Å; K719-F757 HydrophobicContact CG-CD1 4.45Å; K719-F757 HydrophobicContact CG-CG 4.34Å; K719-A758 PolarHBondContact NZ-O 2.96Å; K719-G760 WeakPolarHBondContact CE-O 3.14Å; K719-G760 PolarHBondContact NZ-O 2.96Å; K719-N763 WeakPolarHBondContact CE-O 3.11Å; K719-N763 PolarHBondContact NZ-O 3.19Å
720	G	85.8	Confident	88.8	Confident	38 Å²	38	27.4 Å²	27.4	39%	0.392	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.3	-123.4	-178.1	0	0	0	0	0	110.7	W718	W718-G720 PolarHBondContact NE1-O 3.15Å
721	D	87.6	Confident	89.6	Confident	90 Å²	90	27.6 Å²	27.6	48%	0.481	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	4.3	179	-59.1	-25	0	0	0	112.8	K719 L737 K738	K719-D721 PolarHBondContact O-N 3.02Å; D721-L737 WeakPolarHBondContact O-CB 3.46Å; D721-L737 WeakPolarHBondContact O-CG 3.31Å; D721-L737 PolarHBondContact O-N 3.49Å; D721-K738 HydrophobicContact CB-CB 4.11Å
722	T	89.7	Confident	90.3	Very high	23 Å²	23	26.7 Å²	26.7	14%	0.141	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	125.2	-177.1	-48.8	0	0	0	0	111.1	K719 V724 W735 F757 T779	K719-T722 PolarHBondContact N-O 3.13Å; K719-T722 PolarHBondContact O-N 3.25Å; T722-V724 HydrophobicContact CG2-CG2 4.28Å; T722-W735 WeakPolarHBondContact CA-O 3.49Å; T722-F757 HydrophobicContact CG2-CZ 4.31Å; T722-T779 HydrophobicContact CG2-CG2 4.46Å
723	L	90.4	Very high	90.4	Very high	3 Å²	3	25 Å²	25	2%	0.016	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	131.6	173.2	-173.2	69.2	0	0	0	108.9	I716 W718 L725 W735	I716-L723 HydrophobicContact CG2-CD1 3.55Å; I716-L723 HydrophobicContact CG2-CG 4.31Å; W718-L723 HydrophobicContact CB-CD1 3.66Å; W718-L723 HydrophobicContact CD2-CD1 4.04Å; W718-L723 HydrophobicContact CE3-CD1 4.29Å; W718-L723 HydrophobicContact CG-CD1 3.78Å; L723-L725 HydrophobicContact CD2-CD2 4.35Å; L723-L725 HydrophobicContact CG-CD2 4.32Å; L723-W735 HydrophobicContact CB-CB 4.34Å; L723-W735 HydrophobicContact CD2-CE3 3.8Å; L723-W735 HydrophobicContact CD2-CZ3 4.11Å; L723-W735 PolarHBondContact N-O 2.84Å; L723-W735 PolarHBondContact O-N 3.5Å
724	V	92.3	Very high	90.5	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	129.9	179.2	-173.5	0	0	0	0	109.6	I716 A717 T722 N733 F734 I755 F757 T779	I716-V724 WeakPolarHBondContact CA-O 3.47Å; A717-V724 PolarHBondContact N-O 3.33Å; A717-V724 PolarHBondContact O-N 2.89Å; T722-V724 HydrophobicContact CG2-CG2 4.28Å; V724-N733 VanDerWaalsContact CA-O 3.27Å; V724-N733 WeakPolarHBondContact CA-O 3.4Å; V724-F734 HydrophobicContact CG1-CD1 4.11Å; V724-F734 HydrophobicContact CG1-CE1 3.85Å; V724-F734 HydrophobicContact CG1-CZ 4.4Å; V724-F734 HydrophobicContact CG2-CD1 3.63Å; V724-F734 HydrophobicContact CG2-CE1 3.84Å; V724-I755 HydrophobicContact CG1-CD1 4.12Å; V724-F757 HydrophobicContact CG2-CE2 4.12Å; V724-F757 HydrophobicContact CG2-CZ 3.67Å; V724-T779 HydrophobicContact CG2-CG2 4.25Å
725	L	91.6	Very high	90.4	Very high	8 Å²	8	26.1 Å²	26.1	4%	0.042	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	134.4	179.1	-50.6	174.1	0	0	0	109	V688 I713 I716 L723 L732 N733	V688-L725 HydrophobicContact CG2-CD1 4.34Å; I713-L725 HydrophobicContact CD1-CD1 4.12Å; I713-L725 HydrophobicContact CG2-CB 4.45Å; I716-L725 HydrophobicContact CB-CD2 4.28Å; I716-L725 HydrophobicContact CD1-CD2 4.11Å; I716-L725 HydrophobicContact CG1-CD2 3.65Å; I716-L725 HydrophobicContact CG2-CD2 3.94Å; L723-L725 HydrophobicContact CD2-CD2 4.35Å; L723-L725 HydrophobicContact CG-CD2 4.32Å; L725-L732 CarbonylContact O-C 3.37Å; L725-L732 WeakPolarHBondContact O-CA 3.43Å; L725-N733 HydrophobicContact CB-CB 4.1Å; L725-N733 HydrophobicContact CD1-CB 4.47Å; L725-N733 PolarHBondContact N-O 3.49Å; L725-N733 PolarHBondContact O-N 2.69Å
726	G	92.4	Very high	90.2	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	141.2	170.9	0	0	0	0	0	110.7	T714 C715	T714-G726 PolarHBondContact N-O 3.33Å; T714-G726 PolarHBondContact OG1-O 3.21Å; T714-G726 VanDerWaalsContact OG1-O 3.12Å; C715-G726 PolarHBondContact N-O 2.88Å; C715-G726 PolarHBondContact O-N 2.75Å
727	D	90.8	Very high	89.8	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	176	-179.5	73	11.1	0	0	0	113.6	M710 G711 S712 D729 G730 N731 V752	M710-D727 HydrophobicContact SD-CB 4.49Å; G711-D727 PolarHBondContact N-OD2 2.87Å; G711-D727 VanDerWaalsContact N-OD2 3.08Å; S712-D727 WeakPolarHBondContact O-CA 3.42Å; D727-D729 VanDerWaalsContact C-N 3.27Å; D727-D729 PolarHBondContact O-N 2.96Å; D727-D729 PolarHBondContact OD1-N 3.44Å; D727-G730 PolarHBondContact OD1-N 2.85Å; D727-N731 PolarHBondContact N-O 3.09Å; D727-N731 PolarHBondContact OD1-N 3.04Å; D727-N731 VanDerWaalsContact OD2-CB 3.32Å; D727-N731 WeakPolarHBondContact OD2-CB 3.38Å; D727-N731 PolarHBondContact OD2-ND2 3.07Å; D727-V752 WeakPolarHBondContact O-CG2 3.27Å; D727-V752 PolarHBondContact O-N 2.77Å
728	M	89.7	Confident	89.3	Confident	92 Å²	92	38.7 Å²	38.7	45%	0.453	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-23.2	177	-170.5	174.5	-72.3	0	0	113.4	S712 T714 W751	S712-M728 PolarHBondContact O-N 3Å; T714-M728 HydrophobicContact CG2-CB 4.07Å; M728-W751 HydrophobicContact CE-CZ2 4.43Å; M728-W751 HydrophobicContact CG-CD2 4.36Å; M728-W751 HydrophobicContact CG-CG 4.3Å; M728-W751 WeakPolarHBondContact O-CA 3.37Å; M728-W751 WeakPolarHBondContact O-CB 3.49Å
729	D	88.3	Confident	88.6	Confident	107 Å²	107	39.2 Å²	39.2	57%	0.572	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89	-7.3	-177.6	-64	-46.8	0	0	0	113.2	D727	D727-D729 VanDerWaalsContact C-N 3.27Å; D727-D729 PolarHBondContact O-N 2.96Å; D727-D729 PolarHBondContact OD1-N 3.44Å
730	G	88.1	Confident	88.2	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.245	C	C	.	.	S	Bend	trans	95.9	10.9	178.2	0	0	0	0	0	114.5	D727 T747 S750	D727-G730 PolarHBondContact OD1-N 2.85Å; G730-T747 WeakPolarHBondContact O-CB 3.44Å; G730-T747 PolarHBondContact O-OG1 3.22Å; G730-S750 WeakPolarHBondContact CA-O 3.41Å
731	N	90.9	Very high	88.1	Confident	34 Å²	34	49.4 Å²	49.4	18%	0.182	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	146.5	175.4	-48.9	-54.1	0	0	0	111.2	M710 D727 I745 P746	M710-N731 HydrophobicContact CE-CB 3.67Å; D727-N731 PolarHBondContact N-O 3.09Å; D727-N731 PolarHBondContact OD1-N 3.04Å; D727-N731 VanDerWaalsContact OD2-CB 3.32Å; D727-N731 WeakPolarHBondContact OD2-CB 3.38Å; D727-N731 PolarHBondContact OD2-ND2 3.07Å; N731-I745 WeakPolarHBondContact CA-O 3.44Å; N731-P746 VanDerWaalsContact OD1-CA 3.23Å; N731-P746 WeakPolarHBondContact OD1-CA 3.38Å; N731-P746 WeakPolarHBondContact OD1-CB 3.07Å
732	L	92.5	Very high	87.9	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	125	173.3	-66	179.5	0	0	0	109.9	L725 F734 G744 I745 T747 V752 I755 A768 W777	L725-L732 CarbonylContact O-C 3.37Å; L725-L732 WeakPolarHBondContact O-CA 3.43Å; L732-F734 HydrophobicContact CB-CE2 3.84Å; L732-F734 HydrophobicContact CB-CZ 4.16Å; L732-F734 HydrophobicContact CD1-CE2 4.48Å; L732-F734 HydrophobicContact CD1-CZ 4.15Å; L732-G744 CarbonylContact O-C 3.6Å; L732-G744 WeakPolarHBondContact O-CA 3.4Å; L732-I745 PolarHBondContact N-O 3.03Å; L732-I745 PolarHBondContact O-N 3.39Å; L732-T747 HydrophobicContact CB-CG2 4.47Å; L732-T747 HydrophobicContact CD1-CG2 3.92Å; L732-T747 HydrophobicContact CG-CG2 3.93Å; L732-V752 HydrophobicContact CD2-CG1 4.22Å; L732-V752 HydrophobicContact CD2-CG2 4.15Å; L732-I755 HydrophobicContact CD2-CD1 3.65Å; L732-I755 HydrophobicContact CD2-CG1 4.45Å; L732-A768 HydrophobicContact CD1-CB 4.2Å; L732-A768 HydrophobicContact CD2-CB 4.49Å; L732-W777 HydrophobicContact CD1-CD2 4.3Å; L732-W777 HydrophobicContact CD1-CG 4.45Å; L732-W777 HydrophobicContact CD1-CZ2 4.43Å
733	N	90.8	Very high	87.8	Confident	7 Å²	7	53.5 Å²	53.5	4%	0.037	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	122.7	171.1	-152.3	-14.2	0	0	0	110.7	D707 M710 V724 L725 R743 G744	D707-N733 PolarHBondContact OD2-ND2 2.9Å; M710-N733 HydrophobicContact CE-CB 3.51Å; M710-N733 HydrophobicContact SD-CB 3.72Å; V724-N733 VanDerWaalsContact CA-O 3.27Å; V724-N733 WeakPolarHBondContact CA-O 3.4Å; L725-N733 HydrophobicContact CB-CB 4.1Å; L725-N733 HydrophobicContact CD1-CB 4.47Å; L725-N733 PolarHBondContact N-O 3.49Å; L725-N733 PolarHBondContact O-N 2.69Å; N733-R743 PolarHBondContact OD1-N 3.05Å; N733-R743 PolarHBondContact OD1-O 2.79Å; N733-G744 PolarHBondContact OD1-N 3.17Å
734	F	90.9	Very high	87.6	Confident	10 Å²	10	55.3 Å²	55.3	4%	0.044	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	112.6	173.5	-63.7	-83.9	0	0	0	109.6	V724 L732 S742 R743 I745 L766 W777 T779 V782	V724-F734 HydrophobicContact CG1-CD1 4.11Å; V724-F734 HydrophobicContact CG1-CE1 3.85Å; V724-F734 HydrophobicContact CG1-CZ 4.4Å; V724-F734 HydrophobicContact CG2-CD1 3.63Å; V724-F734 HydrophobicContact CG2-CE1 3.84Å; L732-F734 HydrophobicContact CB-CE2 3.84Å; L732-F734 HydrophobicContact CB-CZ 4.16Å; L732-F734 HydrophobicContact CD1-CE2 4.48Å; L732-F734 HydrophobicContact CD1-CZ 4.15Å; F734-S742 CarbonylContact O-C 3.59Å; F734-S742 WeakPolarHBondContact O-CA 3.47Å; F734-R743 PolarHBondContact N-O 2.93Å; F734-R743 PolarHBondContact O-N 2.88Å; F734-I745 HydrophobicContact CD2-CD1 4.26Å; F734-I745 HydrophobicContact CD2-CG1 4.47Å; F734-I745 HydrophobicContact CE2-CD1 4.09Å; F734-I745 HydrophobicContact CE2-CG1 4.48Å; F734-L766 HydrophobicContact CE1-CD2 3.56Å; F734-L766 HydrophobicContact CZ-CD2 4.16Å; F734-W777 HydrophobicContact CE2-CE3 4.42Å; F734-W777 HydrophobicContact CZ-CD2 4.43Å; F734-W777 HydrophobicContact CZ-CE3 4.21Å; F734-T779 HydrophobicContact CD1-CG2 3.83Å; F734-T779 HydrophobicContact CE1-CG2 3.69Å; F734-V782 HydrophobicContact CB-CG1 4.26Å; F734-V782 HydrophobicContact CD1-CG1 4.37Å; F734-V782 HydrophobicContact CD2-CG1 3.32Å; F734-V782 HydrophobicContact CE2-CG1 3.65Å; F734-V782 HydrophobicContact CG-CG1 3.71Å; F734-V782 HydrophobicContact CZ-CG1 4.33Å
735	W	88.3	Confident	87.4	Confident	47 Å²	47	57.3 Å²	57.3	18%	0.178	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	113.9	-179.2	-167.9	11	0	0	0	111.2	I704 T722 L723 L737	I704-W735 HydrophobicContact CB-CH2 4Å; I704-W735 HydrophobicContact CB-CZ3 4.43Å; I704-W735 HydrophobicContact CD1-CH2 3.47Å; I704-W735 VanDerWaalsContact CD1-CH2 3.47Å; I704-W735 HydrophobicContact CD1-CZ3 3.91Å; I704-W735 HydrophobicContact CG1-CH2 3.6Å; I704-W735 HydrophobicContact CG1-CZ3 4.33Å; I704-W735 HydrophobicContact CG2-CH2 3.61Å; I704-W735 HydrophobicContact CG2-CZ2 4.22Å; I704-W735 HydrophobicContact CG2-CZ3 4.12Å; T722-W735 WeakPolarHBondContact CA-O 3.49Å; L723-W735 HydrophobicContact CB-CB 4.34Å; L723-W735 HydrophobicContact CD2-CE3 3.8Å; L723-W735 HydrophobicContact CD2-CZ3 4.11Å; L723-W735 PolarHBondContact N-O 2.84Å; L723-W735 PolarHBondContact O-N 3.5Å; W735-L737 HydrophobicContact CD2-CD2 3.95Å; W735-L737 HydrophobicContact CE3-CD2 4.16Å; W735-L737 HydrophobicContact CG-CD2 4.41Å; W735-L737 HydrophobicContact CH2-CD2 4.23Å; W735-L737 HydrophobicContact CZ2-CD2 4.14Å; W735-L737 HydrophobicContact CZ3-CD2 4.28Å
736	D	87.5	Confident	87.2	Confident	65 Å²	65	60.1 Å²	60.1	35%	0.348	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	110.7	167.7	178.5	9.1	0	0	0	109.5	K738 G739 R740 V741	D736-K738 VanDerWaalsContact C-N 3.32Å; D736-K738 WeakPolarHBondContact OD1-CB 3.21Å; D736-K738 PolarHBondContact OD1-N 3.33Å; D736-G739 VanDerWaalsContact CG-N 3.35Å; D736-G739 PolarHBondContact OD1-N 3.05Å; D736-G739 PolarHBondContact OD2-N 2.98Å; D736-R740 WeakPolarHBondContact O-CA 3.15Å; D736-R740 PolarHBondContact O-N 2.86Å; D736-V741 PolarHBondContact N-O 3.41Å; D736-V741 PolarHBondContact O-N 3.4Å; D736-V741 VanDerWaalsContact O-N 3.15Å
737	L	83.9	Confident	86.8	Confident	53 Å²	53	61 Å²	61	28%	0.277	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-27.9	-179.4	-61	174.3	0	0	0	112.2	W718 D721 W735	W718-L737 HydrophobicContact CZ2-CD1 3.55Å; D721-L737 WeakPolarHBondContact O-CB 3.46Å; D721-L737 WeakPolarHBondContact O-CG 3.31Å; D721-L737 PolarHBondContact O-N 3.49Å; W735-L737 HydrophobicContact CD2-CD2 3.95Å; W735-L737 HydrophobicContact CE3-CD2 4.16Å; W735-L737 HydrophobicContact CG-CD2 4.41Å; W735-L737 HydrophobicContact CH2-CD2 4.23Å; W735-L737 HydrophobicContact CZ2-CD2 4.14Å; W735-L737 HydrophobicContact CZ3-CD2 4.28Å
738	K	82.6	Confident	86.5	Confident	169 Å²	169	69.2 Å²	69.2	74%	0.735	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-45.9	178.8	-173.9	-179.2	178.9	-175.8	0	110.6	D721 D736 R740	D721-K738 HydrophobicContact CB-CB 4.11Å; D736-K738 VanDerWaalsContact C-N 3.32Å; D736-K738 WeakPolarHBondContact OD1-CB 3.21Å; D736-K738 PolarHBondContact OD1-N 3.33Å; K738-R740 VanDerWaalsContact C-N 3.33Å
739	G	77.5	Confident	86.2	Confident	42 Å²	42	66.1 Å²	66.1	43%	0.433	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-18.5	174.7	0	0	0	0	0	114.1	D736 V741	D736-G739 VanDerWaalsContact CG-N 3.35Å; D736-G739 PolarHBondContact OD1-N 3.05Å; D736-G739 PolarHBondContact OD2-N 2.98Å; G739-V741 PolarHBondContact O-N 2.96Å
740	R	81.7	Confident	86.1	Confident	216 Å²	216	62.8 Å²	62.8	82%	0.815	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	38.7	-168.9	-58.5	-176.9	178.3	-175.3	-0.4	112.7	D736 K738	D736-R740 WeakPolarHBondContact O-CA 3.15Å; D736-R740 PolarHBondContact O-N 2.86Å; K738-R740 VanDerWaalsContact C-N 3.33Å
741	V	82.6	Confident	86.2	Confident	72 Å²	72	67.9 Å²	67.9	44%	0.436	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	124.2	-179	178.9	0	0	0	0	109.6	D736 G739 R743	D736-V741 PolarHBondContact N-O 3.41Å; D736-V741 PolarHBondContact O-N 3.4Å; D736-V741 VanDerWaalsContact O-N 3.15Å; G739-V741 PolarHBondContact O-N 2.96Å; V741-R743 HydrophobicContact CG1-CG 4.38Å
742	S	84.6	Confident	86.4	Confident	52 Å²	52	66.2 Å²	66.2	36%	0.364	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	145.3	168.3	58.2	0	0	0	0	110.7	D707 F734	D707-S742 PolarHBondContact OD2-OG 3Å; D707-S742 VanDerWaalsContact OD2-OG 3.06Å; F734-S742 CarbonylContact O-C 3.59Å; F734-S742 WeakPolarHBondContact O-CA 3.47Å
743	R	85.9	Confident	86.3	Confident	147 Å²	147	72.3 Å²	72.3	56%	0.555	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.9	104.4	174.1	-68.6	-175.5	-177.5	170.7	1.4	109	N733 F734 V741	N733-R743 PolarHBondContact OD1-N 3.05Å; N733-R743 PolarHBondContact OD1-O 2.79Å; F734-R743 PolarHBondContact N-O 2.93Å; F734-R743 PolarHBondContact O-N 2.88Å; V741-R743 HydrophobicContact CG1-CG 4.38Å
744	G	86.3	Confident	86.4	Confident	40 Å²	40	73.5 Å²	73.5	41%	0.412	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	127.6	171.8	0	0	0	0	0	111.7	L732 N733	L732-G744 CarbonylContact O-C 3.6Å; L732-G744 WeakPolarHBondContact O-CA 3.4Å; N733-G744 PolarHBondContact OD1-N 3.17Å
745	I	88.5	Confident	86.6	Confident	42 Å²	42	73.2 Å²	73.2	22%	0.215	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	119.1	174.2	-61.8	-174.8	0	0	0	109.2	N731 L732 F734 T747 W777 V782	N731-I745 WeakPolarHBondContact CA-O 3.44Å; L732-I745 PolarHBondContact N-O 3.03Å; L732-I745 PolarHBondContact O-N 3.39Å; F734-I745 HydrophobicContact CD2-CD1 4.26Å; F734-I745 HydrophobicContact CD2-CG1 4.47Å; F734-I745 HydrophobicContact CE2-CD1 4.09Å; F734-I745 HydrophobicContact CE2-CG1 4.48Å; I745-T747 PolarHBondContact O-N 3Å; I745-W777 HydrophobicContact CD1-CZ3 3.97Å; I745-W777 HydrophobicContact CG2-CH2 3.85Å; I745-W777 HydrophobicContact CG2-CZ3 4.2Å; I745-V782 HydrophobicContact CD1-CB 4.32Å; I745-V782 HydrophobicContact CD1-CG1 3.32Å; I745-V782 HydrophobicContact CG1-CG1 4.38Å
746	P	86.9	Confident	86.8	Confident	68 Å²	68	72.4 Å²	72.4	44%	0.442	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	113.9	168.6	30.2	-31	0	0	0	109.3	N731 H748	N731-P746 VanDerWaalsContact OD1-CA 3.23Å; N731-P746 WeakPolarHBondContact OD1-CA 3.38Å; N731-P746 WeakPolarHBondContact OD1-CB 3.07Å; P746-H748 VanDerWaalsContact C-N 3.25Å; P746-H748 PolarHBondContact O-N 3.31Å
747	T	84.8	Confident	87.1	Confident	19 Å²	19	70.8 Å²	70.8	12%	0.117	35%	0.345	C	S	.	.			trans	-81.2	-9.9	-179.7	71.6	0	0	0	0	112.6	G730 L732 I745 R749 W777	G730-T747 WeakPolarHBondContact O-CB 3.44Å; G730-T747 PolarHBondContact O-OG1 3.22Å; L732-T747 HydrophobicContact CB-CG2 4.47Å; L732-T747 HydrophobicContact CD1-CG2 3.92Å; L732-T747 HydrophobicContact CG-CG2 3.93Å; I745-T747 PolarHBondContact O-N 3Å; T747-R749 PolarHBondContact O-N 3.41Å; T747-R749 VanDerWaalsContact O-N 3.13Å; T747-R749 WeakPolarHBondContact OG1-CB 3.23Å; T747-R749 WeakPolarHBondContact OG1-CG 3.46Å; T747-R749 PolarHBondContact OG1-N 2.99Å; T747-W777 HydrophobicContact CG2-CH2 4.17Å; T747-W777 HydrophobicContact CG2-CZ2 3.61Å
748	H	84.2	Confident	87.5	Confident	171 Å²	171	68.3 Å²	68.3	79%	0.792	33%	0.333	S	S	*	.			trans	54.5	23.2	-171.6	-55	-69.7	0	0	0	113.3	P746	P746-H748 VanDerWaalsContact C-N 3.25Å; P746-H748 PolarHBondContact O-N 3.31Å
749	R	84.3	Confident	87.8	Confident	27 Å²	27	61.6 Å²	61.6	10%	0.102	31%	0.306	C	S	.	.			trans	-93.7	-179.1	171.8	-55.9	-68.6	-102.6	132.2	4.3	109.7	T747 Y770 D772 E775 L788	T747-R749 PolarHBondContact O-N 3.41Å; T747-R749 VanDerWaalsContact O-N 3.13Å; T747-R749 WeakPolarHBondContact OG1-CB 3.23Å; T747-R749 WeakPolarHBondContact OG1-CG 3.46Å; T747-R749 PolarHBondContact OG1-N 2.99Å; R749-Y770 HydrophobicContact CB-CD1 3.5Å; R749-Y770 VanDerWaalsContact CB-CD1 3.5Å; R749-Y770 HydrophobicContact CB-CD2 4.42Å; R749-Y770 HydrophobicContact CB-CE1 3.66Å; R749-Y770 HydrophobicContact CB-CG 3.88Å; R749-Y770 HydrophobicContact CG-CD1 4.21Å; R749-Y770 HydrophobicContact CG-CD2 4.42Å; R749-Y770 HydrophobicContact CG-CE1 4.05Å; R749-Y770 HydrophobicContact CG-CE2 4.33Å; R749-Y770 HydrophobicContact CG-CG 4.37Å; R749-D772 IonicContact CZ-OD1 3.32Å; R749-D772 IonicContact CZ-OD2 3.94Å; R749-D772 IonicContact NH1-OD1 3Å; R749-D772 PolarHBondContact NH1-OD1 3.33Å; R749-D772 VanDerWaalsContact NH1-OD1 3.13Å; R749-D772 IonicContact NH1-OD2 2.7Å; R749-D772 PolarHBondContact NH1-OD2 2.94Å; R749-E775 WeakPolarHBondContact CD-OE1 3.07Å; R749-E775 IonicContact CZ-OE1 3.15Å; R749-E775 IonicContact NE-OE1 2.72Å; R749-E775 PolarHBondContact NE-OE1 3.4Å; R749-E775 IonicContact NH2-OE1 2.81Å; R749-L788 PolarHBondContact NH2-O 3.08Å; R749-L788 VanDerWaalsContact NH2-O 3.13Å
750	S	86.4	Confident	88.2	Confident	37 Å²	37	61.6 Å²	61.6	26%	0.259	31%	0.306	S	S	.	.	S	Bend	trans	-83.1	-175.4	173.9	58.7	0	0	0	0	111.5	G730 V752 Y770 N771 D772	G730-S750 WeakPolarHBondContact CA-O 3.41Å; S750-V752 PolarHBondContact O-N 3.45Å; S750-Y770 VanDerWaalsContact O-CD1 3.29Å; S750-Y770 WeakPolarHBondContact O-CD1 3.27Å; S750-N771 WeakPolarHBondContact OG-CB 3.29Å; S750-N771 PolarHBondContact OG-N 3.07Å; S750-D772 PolarHBondContact OG-N 2.77Å; S750-D772 PolarHBondContact OG-OD1 3.43Å
751	W	89.9	Confident	88.1	Confident	107 Å²	107	61.9 Å²	61.9	41%	0.405	31%	0.313	S	S	.	.			trans	-40.6	124	175.6	176.9	7.2	0	0	0	114.3	T714 M728 R753 Y770 N771	T714-W751 HydrophobicContact CG2-CZ2 4.5Å; M728-W751 HydrophobicContact CE-CZ2 4.43Å; M728-W751 HydrophobicContact CG-CD2 4.36Å; M728-W751 HydrophobicContact CG-CG 4.3Å; M728-W751 WeakPolarHBondContact O-CA 3.37Å; M728-W751 WeakPolarHBondContact O-CB 3.49Å; W751-R753 PolarHBondContact O-N 3.03Å; W751-Y770 VanDerWaalsContact O-CA 3.3Å; W751-Y770 WeakPolarHBondContact O-CA 3.28Å; W751-N771 PolarHBondContact O-N 3.22Å
752	V	93.4	Very high	88	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	115.6	171	-163.4	0	0	0	0	110.8	T714 D727 L732 S750 I755 M769 Y770	T714-V752 WeakPolarHBondContact CB-O 3.27Å; T714-V752 PolarHBondContact OG1-O 2.97Å; D727-V752 WeakPolarHBondContact O-CG2 3.27Å; D727-V752 PolarHBondContact O-N 2.77Å; L732-V752 HydrophobicContact CD2-CG1 4.22Å; L732-V752 HydrophobicContact CD2-CG2 4.15Å; S750-V752 PolarHBondContact O-N 3.45Å; V752-I755 HydrophobicContact CG1-CD1 4.02Å; V752-I755 HydrophobicContact CG1-CG1 3.84Å; V752-M769 CarbonylContact C-O 3.56Å; V752-Y770 HydrophobicContact CG2-CD1 3.97Å; V752-Y770 HydrophobicContact CG2-CE1 3.73Å
753	R	91.5	Very high	88.1	Confident	127 Å²	127	59.4 Å²	59.4	48%	0.479	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-37.4	-178.2	-62.4	-169.2	81.8	-169.1	0.5	113.7	W751 M769 N771	W751-R753 PolarHBondContact O-N 3.03Å; R753-M769 HydrophobicContact CB-CE 3.52Å; R753-M769 HydrophobicContact CG-CE 4.42Å; R753-M769 PolarHBondContact N-O 2.79Å; R753-N771 WeakPolarHBondContact CD-OD1 3.39Å
754	K	92.1	Very high	88.3	Confident	32 Å²	32	54 Å²	54	14%	0.139	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	138	-173.4	-167.1	178.5	-174.1	-170.2	0	110.7	R756 M769 D800 V801	K754-R756 HydrophobicContact CG-CG 4.46Å; K754-M769 HydrophobicContact CB-CB 4.28Å; K754-M769 HydrophobicContact CB-CE 3.79Å; K754-M769 PolarHBondContact O-N 2.86Å; K754-D800 WeakPolarHBondContact CD-OD1 3.33Å; K754-D800 WeakPolarHBondContact CE-OD1 3.37Å; K754-D800 VanDerWaalsContact NZ-CG 3.3Å; K754-D800 IonicContact NZ-OD1 2.72Å; K754-D800 PolarHBondContact NZ-OD1 3.21Å; K754-D800 IonicContact NZ-OD2 3.76Å; K754-D800 PolarHBondContact NZ-OD2 3.36Å; K754-V801 HydrophobicContact CD-CG2 4.22Å; K754-V801 WeakPolarHBondContact CE-O 3.49Å; K754-V801 PolarHBondContact NZ-O 3.21Å
755	I	95.3	Very high	88.7	Confident	5 Å²	5	55 Å²	55	3%	0.026	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	135.8	172.4	-61.4	167.7	0	0	0	108.9	A717 V724 L732 V752 L766 I767 A768	A717-I755 HydrophobicContact CB-CB 4.07Å; A717-I755 HydrophobicContact CB-CG2 3.58Å; V724-I755 HydrophobicContact CG1-CD1 4.12Å; L732-I755 HydrophobicContact CD2-CD1 3.65Å; L732-I755 HydrophobicContact CD2-CG1 4.45Å; V752-I755 HydrophobicContact CG1-CD1 4.02Å; V752-I755 HydrophobicContact CG1-CG1 3.84Å; I755-L766 HydrophobicContact CG2-CD1 3.54Å; I755-I767 VanDerWaalsContact CA-O 3.32Å; I755-I767 WeakPolarHBondContact CA-O 3.29Å; I755-A768 HydrophobicContact CG1-CB 4.29Å
756	R	93.4	Very high	88.9	Confident	30 Å²	30	53 Å²	53	11%	0.113	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	136.1	174.1	-67.6	-67	-167.3	172.1	4.5	111	R471 E522 K754 L766 I767 W803	R471-R756 VanDerWaalsContact CZ-CZ 3.49Å; R471-R756 VanDerWaalsContact CZ-NH2 3.26Å; R471-R756 VanDerWaalsContact NH1-CZ 3.33Å; R471-R756 VanDerWaalsContact NH2-NH1 3.19Å; E522-R756 IonicContact OE1-CZ 2.65Å; E522-R756 IonicContact OE1-NH1 2.78Å; E522-R756 IonicContact OE1-NH2 2.98Å; E522-R756 PolarHBondContact OE1-NH2 2.9Å; K754-R756 HydrophobicContact CG-CG 4.46Å; R756-L766 CarbonylContact O-C 3.32Å; R756-L766 WeakPolarHBondContact O-CA 3.21Å; R756-I767 HydrophobicContact CB-CG2 4.08Å; R756-I767 PolarHBondContact N-O 2.91Å; R756-I767 PolarHBondContact O-N 2.83Å; R756-W803 PolarHBondContact O-NE1 2.85Å
757	F	93.7	Very high	89.3	Confident	31 Å²	31	49.8 Å²	49.8	14%	0.136	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	144.1	171.3	-82.4	-80.5	0	0	0	111.8	A717 K719 T722 V724 K765 L766 T779	A717-F757 HydrophobicContact CB-CD2 3.83Å; A717-F757 HydrophobicContact CB-CE2 3.93Å; K719-F757 HydrophobicContact CB-CB 4.13Å; K719-F757 HydrophobicContact CB-CD1 3.83Å; K719-F757 HydrophobicContact CB-CD2 3.49Å; K719-F757 VanDerWaalsContact CB-CD2 3.49Å; K719-F757 HydrophobicContact CB-CE1 4.03Å; K719-F757 HydrophobicContact CB-CE2 3.72Å; K719-F757 HydrophobicContact CB-CG 3.55Å; K719-F757 HydrophobicContact CB-CZ 3.97Å; K719-F757 HydrophobicContact CD-CB 3.73Å; K719-F757 HydrophobicContact CD-CD1 3.82Å; K719-F757 HydrophobicContact CD-CG 3.82Å; K719-F757 HydrophobicContact CG-CD1 4.45Å; K719-F757 HydrophobicContact CG-CG 4.34Å; T722-F757 HydrophobicContact CG2-CZ 4.31Å; V724-F757 HydrophobicContact CG2-CE2 4.12Å; V724-F757 HydrophobicContact CG2-CZ 3.67Å; F757-K765 WeakPolarHBondContact CD1-O 3.4Å; F757-L766 HydrophobicContact CD1-CB 4.07Å; F757-L766 HydrophobicContact CE1-CB 4.29Å; F757-T779 HydrophobicContact CE1-CG2 3.68Å; F757-T779 HydrophobicContact CZ-CG2 4.11Å
758	A	92.6	Very high	89.8	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.008	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-62.7	146.4	171	0	0	0	0	0	111.1	K719 N763 K765 W803	K719-A758 PolarHBondContact NZ-O 2.96Å; A758-N763 VanDerWaalsContact CB-ND2 3.33Å; A758-N763 WeakPolarHBondContact CB-ND2 3.4Å; A758-K765 HydrophobicContact CB-CB 4.01Å; A758-K765 WeakPolarHBondContact CB-O 3.44Å; A758-K765 PolarHBondContact N-O 3.43Å; A758-W803 HydrophobicContact CB-CD2 3.58Å; A758-W803 HydrophobicContact CB-CE3 3.6Å; A758-W803 HydrophobicContact CB-CG 4.27Å; A758-W803 HydrophobicContact CB-CH2 3.82Å; A758-W803 HydrophobicContact CB-CZ2 3.79Å; A758-W803 HydrophobicContact CB-CZ3 3.71Å
759	P	89.1	Confident	90.3	Very high	27 Å²	27	41 Å²	41	18%	0.175	21%	0.205	C	C	.	.	S	Bend	trans	-71.2	163.1	175	30.4	-35.2	0	0	0	111.6	P475 N763 W803	P475-P759 HydrophobicContact CB-CB 3.58Å; P475-P759 HydrophobicContact CG-CB 4.28Å; P759-N763 PolarHBondContact O-ND2 3.24Å; P759-W803 VanDerWaalsContact CD-CB 3.46Å; P759-W803 HydrophobicContact CG-CB 4.34Å
760	G	84.3	Confident	90.7	Very high	42 Å²	42	39.8 Å²	39.8	43%	0.433	20%	0.201	S	C	.	.	S	Bend	trans	108.8	140.8	178.3	0	0	0	0	0	113.7	K719 G762 N763	K719-G760 WeakPolarHBondContact CE-O 3.14Å; K719-G760 PolarHBondContact NZ-O 2.96Å; G760-G762 PolarHBondContact O-N 3.13Å; G760-N763 PolarHBondContact O-N 2.76Å
761	K	81	Confident	90.8	Very high	222 Å²	222	41.7 Å²	41.7	97%	0.965	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.8	123.6	178.6	-172.7	-179.4	178.9	-174.4	0	109.4	N763	K761-N763 PolarHBondContact O-N 2.85Å
762	G	80	Confident	90.6	Very high	47 Å²	47	38.1 Å²	38.1	49%	0.485	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.8	-6.1	179.4	0	0	0	0	0	115.6	G760 Q764 K780	G760-G762 PolarHBondContact O-N 3.13Å; G762-Q764 PolarHBondContact O-N 2.88Å; G762-K780 PolarHBondContact O-NZ 3.48Å
763	N	87.7	Confident	90.5	Very high	26 Å²	26	38.2 Å²	38.2	14%	0.139	20%	0.198	C	C	.	.			trans	-73.1	118.6	169.5	-172.9	0.6	0	0	0	109	K719 A758 P759 G760 K761 K765 S806	K719-N763 WeakPolarHBondContact CE-O 3.11Å; K719-N763 PolarHBondContact NZ-O 3.19Å; A758-N763 VanDerWaalsContact CB-ND2 3.33Å; A758-N763 WeakPolarHBondContact CB-ND2 3.4Å; P759-N763 PolarHBondContact O-ND2 3.24Å; G760-N763 PolarHBondContact O-N 2.76Å; K761-N763 PolarHBondContact O-N 2.85Å; N763-K765 WeakPolarHBondContact OD1-CB 3.27Å; N763-K765 VanDerWaalsContact OD1-CD 3.27Å; N763-K765 WeakPolarHBondContact OD1-CD 3.48Å; N763-K765 VanDerWaalsContact OD1-CG 3.27Å; N763-K765 WeakPolarHBondContact OD1-CG 3.23Å; N763-K765 PolarHBondContact OD1-N 3.47Å; N763-S806 WeakPolarHBondContact ND2-CB 3.37Å; N763-S806 PolarHBondContact ND2-O 3.36Å
764	Q	89.9	Confident	90.6	Very high	33 Å²	33	32.2 Å²	32.2	15%	0.154	18%	0.175	C	C	.	.			trans	-113.2	26	-175.1	-76.8	-61.1	-3.1	0	0	111.9	G762 T779 K780	G762-Q764 PolarHBondContact O-N 2.88Å; Q764-T779 WeakPolarHBondContact CB-OG1 3.31Å; Q764-T779 WeakPolarHBondContact O-CG2 3.32Å; Q764-T779 PolarHBondContact O-N 3.37Å; Q764-T779 PolarHBondContact O-OG1 2.97Å; Q764-T779 PolarHBondContact OE1-OG1 2.86Å; Q764-K780 HydrophobicContact CB-CD 4.23Å; Q764-K780 HydrophobicContact CB-CG 3.75Å; Q764-K780 HydrophobicContact CG-CD 4.4Å; Q764-K780 HydrophobicContact CG-CG 4Å
765	K	93.2	Very high	90.6	Very high	61 Å²	61	31 Å²	31	27%	0.265	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	143.7	175.4	-63.7	165.6	171.7	-172.8	0	110.3	F757 A758 N763 W777 W803 M823	F757-K765 WeakPolarHBondContact CD1-O 3.4Å; A758-K765 HydrophobicContact CB-CB 4.01Å; A758-K765 WeakPolarHBondContact CB-O 3.44Å; A758-K765 PolarHBondContact N-O 3.43Å; N763-K765 WeakPolarHBondContact OD1-CB 3.27Å; N763-K765 VanDerWaalsContact OD1-CD 3.27Å; N763-K765 WeakPolarHBondContact OD1-CD 3.48Å; N763-K765 VanDerWaalsContact OD1-CG 3.27Å; N763-K765 WeakPolarHBondContact OD1-CG 3.23Å; N763-K765 PolarHBondContact OD1-N 3.47Å; K765-W777 CarbonylContact C-O 3.53Å; K765-W777 VanDerWaalsContact CA-O 3.32Å; K765-W777 WeakPolarHBondContact CA-O 3.32Å; K765-W803 HydrophobicContact CB-CH2 4.27Å; K765-M823 HydrophobicContact CD-CE 3.33Å; K765-M823 HydrophobicContact CD-SD 3.52Å; K765-M823 VanDerWaalsContact CD-SD 3.52Å; K765-M823 VanDerWaalsContact CE-CE 3.4Å; K765-M823 HydrophobicContact CG-CE 4.14Å; K765-M823 VanDerWaalsContact NZ-CE 3.29Å; K765-M823 PolarHBondContact NZ-SD 3.24Å
766	L	94	Very high	90.6	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	159.4	172.7	77.4	121.3	0	0	0	111.2	F734 I755 R756 F757 A768 V776 W777 T779	F734-L766 HydrophobicContact CE1-CD2 3.56Å; F734-L766 HydrophobicContact CZ-CD2 4.16Å; I755-L766 HydrophobicContact CG2-CD1 3.54Å; R756-L766 CarbonylContact O-C 3.32Å; R756-L766 WeakPolarHBondContact O-CA 3.21Å; F757-L766 HydrophobicContact CD1-CB 4.07Å; F757-L766 HydrophobicContact CE1-CB 4.29Å; L766-A768 HydrophobicContact CD1-CB 4.2Å; L766-V776 CarbonylContact O-C 3.56Å; L766-V776 VanDerWaalsContact O-CA 3.28Å; L766-V776 WeakPolarHBondContact O-CA 3.37Å; L766-V776 WeakPolarHBondContact O-CG1 3.27Å; L766-W777 HydrophobicContact CD1-CB 4.37Å; L766-W777 HydrophobicContact CD2-CB 3.58Å; L766-W777 HydrophobicContact CG-CB 3.82Å; L766-W777 PolarHBondContact N-O 3.5Å; L766-W777 PolarHBondContact O-N 2.88Å; L766-T779 HydrophobicContact CD2-CG2 3.15Å; L766-T779 HydrophobicContact CG-CG2 4.5Å
767	I	95.3	Very high	90.6	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	132.3	167	-166.3	167.9	0	0	0	108.7	I755 R756 E775 V801 W803 V809 L811 M825	I755-I767 VanDerWaalsContact CA-O 3.32Å; I755-I767 WeakPolarHBondContact CA-O 3.29Å; R756-I767 HydrophobicContact CB-CG2 4.08Å; R756-I767 PolarHBondContact N-O 2.91Å; R756-I767 PolarHBondContact O-N 2.83Å; I767-E775 CarbonylContact C-O 3.53Å; I767-E775 WeakPolarHBondContact CA-O 3.25Å; I767-V801 HydrophobicContact CD1-CB 4.07Å; I767-V801 HydrophobicContact CD1-CG1 4.21Å; I767-V801 HydrophobicContact CD1-CG2 4.47Å; I767-V801 HydrophobicContact CG2-CG2 4.04Å; I767-W803 HydrophobicContact CB-CZ2 3.92Å; I767-W803 HydrophobicContact CG2-CZ2 4.49Å; I767-V809 HydrophobicContact CD1-CB 4.09Å; I767-V809 HydrophobicContact CD1-CG1 4.03Å; I767-L811 HydrophobicContact CD1-CD2 4.08Å; I767-M825 HydrophobicContact CD1-CE 3.4Å; I767-M825 HydrophobicContact CG1-CE 3.92Å
768	A	94.6	Very high	90.6	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	124.9	173.2	0	0	0	0	0	109	L732 I755 L766 Y770 A774 E775	L732-A768 HydrophobicContact CD1-CB 4.2Å; L732-A768 HydrophobicContact CD2-CB 4.49Å; I755-A768 HydrophobicContact CG1-CB 4.29Å; L766-A768 HydrophobicContact CD1-CB 4.2Å; A768-Y770 HydrophobicContact CB-CE2 3.91Å; A768-Y770 WeakPolarHBondContact O-CE2 3.38Å; A768-A774 CarbonylContact O-C 3.53Å; A768-A774 VanDerWaalsContact O-CA 3.29Å; A768-A774 WeakPolarHBondContact O-CA 3.15Å; A768-E775 PolarHBondContact N-O 3.07Å; A768-E775 PolarHBondContact O-N 3.28Å
769	M	94.5	Very high	90.4	Very high	6 Å²	6	31.1 Å²	31.1	3%	0.03	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	130.8	177	-178.7	178	77.3	0	0	110.1	V752 R753 K754 I798 V801	V752-M769 CarbonylContact C-O 3.56Å; R753-M769 HydrophobicContact CB-CE 3.52Å; R753-M769 HydrophobicContact CG-CE 4.42Å; R753-M769 PolarHBondContact N-O 2.79Å; K754-M769 HydrophobicContact CB-CB 4.28Å; K754-M769 HydrophobicContact CB-CE 3.79Å; K754-M769 PolarHBondContact O-N 2.86Å; M769-I798 HydrophobicContact CG-CG2 4.35Å; M769-I798 HydrophobicContact SD-CG2 3.98Å; M769-V801 HydrophobicContact CB-CG1 4.1Å; M769-V801 HydrophobicContact CB-CG2 3.76Å; M769-V801 HydrophobicContact CG-CG1 4.14Å; M769-V801 HydrophobicContact CG-CG2 4.49Å; M769-V801 HydrophobicContact SD-CB 4.5Å; M769-V801 HydrophobicContact SD-CG1 3.85Å; M769-V801 HydrophobicContact SD-CG2 4.2Å
770	Y	92.6	Very high	90.3	Very high	1 Å²	1	36 Å²	36	0%	0.004	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	169.6	178.7	-51.3	-89.2	0	0	0	110	R749 S750 W751 V752 A768 D772 G773 E775	R749-Y770 HydrophobicContact CB-CD1 3.5Å; R749-Y770 VanDerWaalsContact CB-CD1 3.5Å; R749-Y770 HydrophobicContact CB-CD2 4.42Å; R749-Y770 HydrophobicContact CB-CE1 3.66Å; R749-Y770 HydrophobicContact CB-CG 3.88Å; R749-Y770 HydrophobicContact CG-CD1 4.21Å; R749-Y770 HydrophobicContact CG-CD2 4.42Å; R749-Y770 HydrophobicContact CG-CE1 4.05Å; R749-Y770 HydrophobicContact CG-CE2 4.33Å; R749-Y770 HydrophobicContact CG-CG 4.37Å; S750-Y770 VanDerWaalsContact O-CD1 3.29Å; S750-Y770 WeakPolarHBondContact O-CD1 3.27Å; W751-Y770 VanDerWaalsContact O-CA 3.3Å; W751-Y770 WeakPolarHBondContact O-CA 3.28Å; V752-Y770 HydrophobicContact CG2-CD1 3.97Å; V752-Y770 HydrophobicContact CG2-CE1 3.73Å; A768-Y770 HydrophobicContact CB-CE2 3.91Å; A768-Y770 WeakPolarHBondContact O-CE2 3.38Å; Y770-D772 PolarHBondContact O-N 3.31Å; Y770-G773 WeakPolarHBondContact CA-O 3.37Å; Y770-G773 PolarHBondContact N-O 3.04Å; Y770-G773 VanDerWaalsContact O-O 3.11Å; Y770-E775 HydrophobicContact CD2-CG 4.3Å; Y770-E775 HydrophobicContact CE2-CB 3.89Å; Y770-E775 HydrophobicContact CE2-CG 3.64Å; Y770-E775 PolarHBondContact OH-OE2 3.41Å
771	N	88.4	Confident	90.3	Very high	77 Å²	77	40.2 Å²	40.2	41%	0.412	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-30.2	173.6	-79.2	-18.8	0	0	0	113.1	S750 W751 R753	S750-N771 WeakPolarHBondContact OG-CB 3.29Å; S750-N771 PolarHBondContact OG-N 3.07Å; W751-N771 PolarHBondContact O-N 3.22Å; R753-N771 WeakPolarHBondContact CD-OD1 3.39Å
772	D	86.5	Confident	90.6	Very high	33 Å²	33	30.6 Å²	30.6	18%	0.176	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.4	13	-175.5	73.6	-39.1	0	0	0	114.4	R749 S750 Y770 R789 S790	R749-D772 IonicContact CZ-OD1 3.32Å; R749-D772 IonicContact CZ-OD2 3.94Å; R749-D772 IonicContact NH1-OD1 3Å; R749-D772 PolarHBondContact NH1-OD1 3.33Å; R749-D772 VanDerWaalsContact NH1-OD1 3.13Å; R749-D772 IonicContact NH1-OD2 2.7Å; R749-D772 PolarHBondContact NH1-OD2 2.94Å; S750-D772 PolarHBondContact OG-N 2.77Å; S750-D772 PolarHBondContact OG-OD1 3.43Å; Y770-D772 PolarHBondContact O-N 3.31Å; D772-R789 IonicContact OD2-CZ 3.89Å; D772-R789 IonicContact OD2-NE 2.91Å; D772-R789 PolarHBondContact OD2-NE 3.39Å; D772-R789 IonicContact OD2-NH2 2.82Å; D772-R789 PolarHBondContact OD2-NH2 3.23Å; D772-R789 VanDerWaalsContact OD2-NH2 3.12Å; D772-S790 PolarHBondContact O-N 2.9Å
773	G	90.6	Very high	91.1	Very high	2 Å²	2	34.3 Å²	34.3	2%	0.021	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	155.6	-160.8	175.2	0	0	0	0	0	115.2	Y770 L788	Y770-G773 WeakPolarHBondContact CA-O 3.37Å; Y770-G773 PolarHBondContact N-O 3.04Å; Y770-G773 VanDerWaalsContact O-O 3.11Å; G773-L788 CarbonylContact C-O 3.48Å; G773-L788 WeakPolarHBondContact CA-O 3.31Å
774	A	93.1	Very high	91.3	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	151.9	178.5	0	0	0	0	0	111.1	A768 L788 I798 V801 L811 M825	A768-A774 CarbonylContact O-C 3.53Å; A768-A774 VanDerWaalsContact O-CA 3.29Å; A768-A774 WeakPolarHBondContact O-CA 3.15Å; A774-L788 PolarHBondContact N-O 3.35Å; A774-L788 PolarHBondContact O-N 3.3Å; A774-I798 HydrophobicContact CB-CD1 3.56Å; A774-V801 HydrophobicContact CB-CG1 4.43Å; A774-L811 HydrophobicContact CB-CD2 4.49Å; A774-M825 HydrophobicContact CB-CE 4.27Å
775	E	93.9	Very high	91.4	Very high	8 Å²	8	39.9 Å²	39.9	4%	0.037	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	146.3	178.4	-59.7	-173.7	163.6	0	0	111.4	R749 I767 A768 Y770 W777 M784 S786 S787	R749-E775 WeakPolarHBondContact CD-OE1 3.07Å; R749-E775 IonicContact CZ-OE1 3.15Å; R749-E775 IonicContact NE-OE1 2.72Å; R749-E775 PolarHBondContact NE-OE1 3.4Å; R749-E775 IonicContact NH2-OE1 2.81Å; I767-E775 CarbonylContact C-O 3.53Å; I767-E775 WeakPolarHBondContact CA-O 3.25Å; A768-E775 PolarHBondContact N-O 3.07Å; A768-E775 PolarHBondContact O-N 3.28Å; Y770-E775 HydrophobicContact CD2-CG 4.3Å; Y770-E775 HydrophobicContact CE2-CB 3.89Å; Y770-E775 HydrophobicContact CE2-CG 3.64Å; Y770-E775 PolarHBondContact OH-OE2 3.41Å; E775-W777 PolarHBondContact OE2-NE1 3.16Å; E775-W777 VanDerWaalsContact OE2-NE1 3.16Å; E775-M784 HydrophobicContact CG-SD 4.5Å; E775-S786 CarbonylContact C-O 3.57Å; E775-S786 VanDerWaalsContact CA-O 3.31Å; E775-S786 WeakPolarHBondContact CA-O 3.21Å; E775-S787 WeakPolarHBondContact CG-OG 3.18Å; E775-S787 PolarHBondContact OE1-OG 3.22Å
776	V	94.7	Very high	91.2	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	129.9	171.6	-175	0	0	0	0	108.8	L766 V785 S786 W803 V809 M823 M825	L766-V776 CarbonylContact O-C 3.56Å; L766-V776 VanDerWaalsContact O-CA 3.28Å; L766-V776 WeakPolarHBondContact O-CA 3.37Å; L766-V776 WeakPolarHBondContact O-CG1 3.27Å; V776-V785 HydrophobicContact CB-CB 4.49Å; V776-V785 HydrophobicContact CG1-CB 4.43Å; V776-V785 PolarHBondContact O-N 3.35Å; V776-S786 WeakPolarHBondContact CB-OG 3.48Å; V776-S786 VanDerWaalsContact CG2-OG 3.27Å; V776-S786 WeakPolarHBondContact CG2-OG 3.39Å; V776-S786 PolarHBondContact N-O 3.12Å; V776-S786 PolarHBondContact O-N 2.97Å; V776-W803 HydrophobicContact CG1-CH2 3.91Å; V776-W803 HydrophobicContact CG1-CZ2 4.23Å; V776-V809 HydrophobicContact CG2-CG1 4.38Å; V776-M823 HydrophobicContact CG1-CE 3.92Å; V776-M825 HydrophobicContact CG2-CE 3.3Å; V776-M825 HydrophobicContact CG2-SD 4.09Å
777	W	93.8	Very high	91	Very high	17 Å²	17	39.7 Å²	39.7	6%	0.064	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	146.2	-179.1	-70.3	75.6	0	0	0	110.6	L732 F734 I745 T747 K765 L766 E775 Q783 M784	L732-W777 HydrophobicContact CD1-CD2 4.3Å; L732-W777 HydrophobicContact CD1-CG 4.45Å; L732-W777 HydrophobicContact CD1-CZ2 4.43Å; F734-W777 HydrophobicContact CE2-CE3 4.42Å; F734-W777 HydrophobicContact CZ-CD2 4.43Å; F734-W777 HydrophobicContact CZ-CE3 4.21Å; I745-W777 HydrophobicContact CD1-CZ3 3.97Å; I745-W777 HydrophobicContact CG2-CH2 3.85Å; I745-W777 HydrophobicContact CG2-CZ3 4.2Å; T747-W777 HydrophobicContact CG2-CH2 4.17Å; T747-W777 HydrophobicContact CG2-CZ2 3.61Å; K765-W777 CarbonylContact C-O 3.53Å; K765-W777 VanDerWaalsContact CA-O 3.32Å; K765-W777 WeakPolarHBondContact CA-O 3.32Å; L766-W777 HydrophobicContact CD1-CB 4.37Å; L766-W777 HydrophobicContact CD2-CB 3.58Å; L766-W777 HydrophobicContact CG-CB 3.82Å; L766-W777 PolarHBondContact N-O 3.5Å; L766-W777 PolarHBondContact O-N 2.88Å; E775-W777 PolarHBondContact OE2-NE1 3.16Å; E775-W777 VanDerWaalsContact OE2-NE1 3.16Å; W777-Q783 WeakPolarHBondContact CA-O 3.34Å; W777-Q783 VanDerWaalsContact CE3-C 3.43Å; W777-M784 HydrophobicContact CD2-CB 4.09Å; W777-M784 HydrophobicContact CE3-CB 4.2Å; W777-M784 HydrophobicContact CH2-CB 4.03Å; W777-M784 HydrophobicContact CZ2-CB 3.92Å; W777-M784 HydrophobicContact CZ2-CG 4.42Å; W777-M784 HydrophobicContact CZ3-CB 4.17Å
778	D	92	Very high	90.8	Very high	39 Å²	39	40 Å²	40	21%	0.209	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	118.1	166.6	-168.6	-24	0	0	0	109.1	K780 V782 Q783 V785	D778-K780 VanDerWaalsContact C-N 3.34Å; D778-K780 WeakPolarHBondContact OD1-CB 3.3Å; D778-K780 PolarHBondContact OD1-N 3.18Å; D778-V782 WeakPolarHBondContact O-CA 3.44Å; D778-V782 PolarHBondContact O-N 2.89Å; D778-Q783 PolarHBondContact N-O 3.26Å; D778-Q783 PolarHBondContact O-N 2.79Å; D778-Q783 VanDerWaalsContact O-N 3.15Å; D778-V785 HydrophobicContact CB-CG2 4.01Å
779	T	89.3	Confident	90.4	Very high	12 Å²	12	45.4 Å²	45.4	7%	0.074	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-13.8	-178.9	66.3	0	0	0	0	114.3	T722 V724 F734 F757 Q764 L766	T722-T779 HydrophobicContact CG2-CG2 4.46Å; V724-T779 HydrophobicContact CG2-CG2 4.25Å; F734-T779 HydrophobicContact CD1-CG2 3.83Å; F734-T779 HydrophobicContact CE1-CG2 3.69Å; F757-T779 HydrophobicContact CE1-CG2 3.68Å; F757-T779 HydrophobicContact CZ-CG2 4.11Å; Q764-T779 WeakPolarHBondContact CB-OG1 3.31Å; Q764-T779 WeakPolarHBondContact O-CG2 3.32Å; Q764-T779 PolarHBondContact O-N 3.37Å; Q764-T779 PolarHBondContact O-OG1 2.97Å; Q764-T779 PolarHBondContact OE1-OG1 2.86Å; L766-T779 HydrophobicContact CD2-CG2 3.15Å; L766-T779 HydrophobicContact CG-CG2 4.5Å
780	K	86.3	Confident	89.9	Confident	129 Å²	129	46.6 Å²	46.6	56%	0.561	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-52.7	176.7	-72.2	178.2	-177.5	175.9	0	110.9	G762 Q764 D778	G762-K780 PolarHBondContact O-NZ 3.48Å; Q764-K780 HydrophobicContact CB-CD 4.23Å; Q764-K780 HydrophobicContact CB-CG 3.75Å; Q764-K780 HydrophobicContact CG-CD 4.4Å; Q764-K780 HydrophobicContact CG-CG 4Å; D778-K780 VanDerWaalsContact C-N 3.34Å; D778-K780 WeakPolarHBondContact OD1-CB 3.3Å; D778-K780 PolarHBondContact OD1-N 3.18Å
781	E	85.1	Confident	88.9	Confident	131 Å²	131	50 Å²	50	61%	0.612	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-13.2	178.3	-57.7	-53.3	139.9	0	0	112.1	Q783	E781-Q783 HydrophobicContact CB-CG 4.28Å
782	V	87.9	Confident	88.2	Confident	20 Å²	20	56 Å²	56	12%	0.121	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.4	52.7	-175.6	-154.9	0	0	0	0	111.3	F734 I745 D778	F734-V782 HydrophobicContact CB-CG1 4.26Å; F734-V782 HydrophobicContact CD1-CG1 4.37Å; F734-V782 HydrophobicContact CD2-CG1 3.32Å; F734-V782 HydrophobicContact CE2-CG1 3.65Å; F734-V782 HydrophobicContact CG-CG1 3.71Å; F734-V782 HydrophobicContact CZ-CG1 4.33Å; I745-V782 HydrophobicContact CD1-CB 4.32Å; I745-V782 HydrophobicContact CD1-CG1 3.32Å; I745-V782 HydrophobicContact CG1-CG1 4.38Å; D778-V782 WeakPolarHBondContact O-CA 3.44Å; D778-V782 PolarHBondContact O-N 2.89Å
783	Q	90.6	Very high	87.5	Confident	126 Å²	126	59.3 Å²	59.3	59%	0.589	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.7	148.4	-177.7	-69.1	-175.7	-2.3	0	0	112	W777 D778 E781	W777-Q783 WeakPolarHBondContact CA-O 3.34Å; W777-Q783 VanDerWaalsContact CE3-C 3.43Å; D778-Q783 PolarHBondContact N-O 3.26Å; D778-Q783 PolarHBondContact O-N 2.79Å; D778-Q783 VanDerWaalsContact O-N 3.15Å; E781-Q783 HydrophobicContact CB-CG 4.28Å
784	M	90.9	Very high	87.1	Confident	98 Å²	98	60.6 Å²	60.6	48%	0.483	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	125.6	172.5	-178.9	-170.8	60.2	0	0	109.8	E775 W777	E775-M784 HydrophobicContact CG-SD 4.5Å; W777-M784 HydrophobicContact CD2-CB 4.09Å; W777-M784 HydrophobicContact CE3-CB 4.2Å; W777-M784 HydrophobicContact CH2-CB 4.03Å; W777-M784 HydrophobicContact CZ2-CB 3.92Å; W777-M784 HydrophobicContact CZ2-CG 4.42Å; W777-M784 HydrophobicContact CZ3-CB 4.17Å
785	V	91.4	Very high	86.5	Confident	77 Å²	77	64.3 Å²	64.3	47%	0.467	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	-43.9	179.6	179.7	0	0	0	0	111.2	V776 D778 M823	V776-V785 HydrophobicContact CB-CB 4.49Å; V776-V785 HydrophobicContact CG1-CB 4.43Å; V776-V785 PolarHBondContact O-N 3.35Å; D778-V785 HydrophobicContact CB-CG2 4.01Å; V785-M823 HydrophobicContact CG1-CE 3.99Å
786	S	90.4	Very high	86.1	Confident	12 Å²	12	64.7 Å²	64.7	8%	0.084	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	154.1	-179.7	64.9	0	0	0	0	111.1	E775 V776 M823	E775-S786 CarbonylContact C-O 3.57Å; E775-S786 VanDerWaalsContact CA-O 3.31Å; E775-S786 WeakPolarHBondContact CA-O 3.21Å; V776-S786 WeakPolarHBondContact CB-OG 3.48Å; V776-S786 VanDerWaalsContact CG2-OG 3.27Å; V776-S786 WeakPolarHBondContact CG2-OG 3.39Å; V776-S786 PolarHBondContact N-O 3.12Å; V776-S786 PolarHBondContact O-N 2.97Å; S786-M823 VanDerWaalsContact CB-O 3.27Å; S786-M823 WeakPolarHBondContact CB-O 2.97Å; S786-M823 PolarHBondContact OG-O 3.26Å
787	S	90.3	Very high	85.9	Confident	46 Å²	46	71.6 Å²	71.6	32%	0.322	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	134.8	179.8	-177.3	0	0	0	0	110.4	E775	E775-S787 WeakPolarHBondContact CG-OG 3.18Å; E775-S787 PolarHBondContact OE1-OG 3.22Å
788	L	89.1	Confident	85.8	Confident	7 Å²	7	71.3 Å²	71.3	4%	0.037	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	122.3	176.3	-171.5	67.9	0	0	0	108.6	R749 G773 A774 N793 V794 I798 L811 M825	R749-L788 PolarHBondContact NH2-O 3.08Å; R749-L788 VanDerWaalsContact NH2-O 3.13Å; G773-L788 CarbonylContact C-O 3.48Å; G773-L788 WeakPolarHBondContact CA-O 3.31Å; A774-L788 PolarHBondContact N-O 3.35Å; A774-L788 PolarHBondContact O-N 3.3Å; L788-N793 HydrophobicContact CD1-CB 4.47Å; L788-V794 HydrophobicContact CD1-CG1 3.57Å; L788-V794 HydrophobicContact CD1-CG2 4.13Å; L788-V794 HydrophobicContact CD2-CG2 4.47Å; L788-V794 HydrophobicContact CG-CG1 4.31Å; L788-V794 HydrophobicContact CG-CG2 4.07Å; L788-I798 HydrophobicContact CD2-CD1 4Å; L788-L811 HydrophobicContact CD2-CD1 3.5Å; L788-M825 HydrophobicContact CB-CB 4.3Å; L788-M825 HydrophobicContact CB-SD 3.92Å
789	R	87.9	Confident	85.7	Confident	112 Å²	112	70.9 Å²	70.9	42%	0.423	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	127.9	-178.2	-168.6	173.1	-164	-165	2.5	112.3	D772 N793 V794	D772-R789 IonicContact OD2-CZ 3.89Å; D772-R789 IonicContact OD2-NE 2.91Å; D772-R789 PolarHBondContact OD2-NE 3.39Å; D772-R789 IonicContact OD2-NH2 2.82Å; D772-R789 PolarHBondContact OD2-NH2 3.23Å; D772-R789 VanDerWaalsContact OD2-NH2 3.12Å; R789-N793 PolarHBondContact O-N 3.02Å; R789-V794 PolarHBondContact O-N 3.18Å
790	S	82.9	Confident	85.9	Confident	32 Å²	32	71.2 Å²	71.2	22%	0.224	36%	0.36	C	S	.	.	B	Isolated β-bridge	trans	-67.6	139.9	173.8	-166.6	0	0	0	0	111	D772 R792 V794 F796	D772-S790 PolarHBondContact O-N 2.9Å; S790-R792 VanDerWaalsContact C-N 3.27Å; S790-R792 PolarHBondContact O-N 3.44Å; S790-V794 CarbonylContact C-O 3.35Å; S790-F796 WeakPolarHBondContact CB-O 3.32Å; S790-F796 PolarHBondContact OG-O 2.65Å
791	G	72.8	Confident	86.3	Confident	73 Å²	73	65.1 Å²	65.1	75%	0.753	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.5	-25.9	-177.1	0	0	0	0	0	115.6	V794	G791-V794 PolarHBondContact N-O 3.02Å
792	R	73.9	Confident	86.8	Confident	203 Å²	203	59.4 Å²	59.4	77%	0.766	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-53	177.1	-167.4	179.4	-176.4	172.6	1.5	112.4	S790	S790-R792 VanDerWaalsContact C-N 3.27Å; S790-R792 PolarHBondContact O-N 3.44Å
793	N	71.5	Confident	87	Confident	102 Å²	102	58.8 Å²	58.8	55%	0.545	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-36.7	-173.9	-63.8	26.3	0	0	0	111.3	L788 R789	L788-N793 HydrophobicContact CD1-CB 4.47Å; R789-N793 PolarHBondContact O-N 3.02Å
794	V	81.4	Confident	86.9	Confident	29 Å²	29	53 Å²	53	18%	0.176	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-130.9	155.3	-180	-67.5	0	0	0	0	110.7	L788 R789 S790 G791 F796	L788-V794 HydrophobicContact CD1-CG1 3.57Å; L788-V794 HydrophobicContact CD1-CG2 4.13Å; L788-V794 HydrophobicContact CD2-CG2 4.47Å; L788-V794 HydrophobicContact CG-CG1 4.31Å; L788-V794 HydrophobicContact CG-CG2 4.07Å; R789-V794 PolarHBondContact O-N 3.18Å; S790-V794 CarbonylContact C-O 3.35Å; G791-V794 PolarHBondContact N-O 3.02Å; V794-F796 HydrophobicContact CB-CD1 4.11Å; V794-F796 HydrophobicContact CB-CE1 3.73Å; V794-F796 HydrophobicContact CB-CE2 4.38Å; V794-F796 HydrophobicContact CB-CZ 3.89Å; V794-F796 HydrophobicContact CG1-CE1 3.84Å; V794-F796 HydrophobicContact CG1-CZ 3.83Å; V794-F796 HydrophobicContact CG2-CD2 4.48Å; V794-F796 HydrophobicContact CG2-CE1 4.42Å; V794-F796 HydrophobicContact CG2-CE2 4.2Å; V794-F796 HydrophobicContact CG2-CZ 4.16Å
795	T	80.3	Confident	86.7	Confident	77 Å²	77	49.7 Å²	49.7	47%	0.472	26%	0.262	S	S	.	.	S	Bend	trans	-94.2	-18.5	-177.1	51.6	0	0	0	0	113.7	K61	K61-T795 HydrophobicContact CB-CG2 4.12Å; K61-T795 WeakPolarHBondContact O-CG2 3.47Å
796	F	86.6	Confident	86.5	Confident	16 Å²	16	48.8 Å²	48.8	7%	0.07	26%	0.259	C	S	.	.	S	Bend	trans	-90.7	160.3	177.2	58.4	-96.2	0	0	0	112.1	S790 V794 I798 D814 D815	S790-F796 WeakPolarHBondContact CB-O 3.32Å; S790-F796 PolarHBondContact OG-O 2.65Å; V794-F796 HydrophobicContact CB-CD1 4.11Å; V794-F796 HydrophobicContact CB-CE1 3.73Å; V794-F796 HydrophobicContact CB-CE2 4.38Å; V794-F796 HydrophobicContact CB-CZ 3.89Å; V794-F796 HydrophobicContact CG1-CE1 3.84Å; V794-F796 HydrophobicContact CG1-CZ 3.83Å; V794-F796 HydrophobicContact CG2-CD2 4.48Å; V794-F796 HydrophobicContact CG2-CE1 4.42Å; V794-F796 HydrophobicContact CG2-CE2 4.2Å; V794-F796 HydrophobicContact CG2-CZ 4.16Å; F796-I798 HydrophobicContact CE2-CG1 4.49Å; F796-D814 WeakPolarHBondContact CA-OD1 3.14Å; F796-D815 HydrophobicContact CB-CB 4.25Å
797	R	88.8	Confident	86.3	Confident	146 Å²	146	51.1 Å²	51.1	55%	0.551	27%	0.27	S	S	*	.	P	Polyproline II helix	trans	-100.7	150.6	169.4	-61.3	-178.1	-63.3	159.9	0.9	110.4	S813 D814	R797-S813 CarbonylContact O-C 3.59Å; R797-S813 VanDerWaalsContact O-CA 3.23Å; R797-S813 WeakPolarHBondContact O-CA 3.39Å; R797-S813 WeakPolarHBondContact O-CB 3.35Å; R797-D814 WeakPolarHBondContact CB-OD2 3.25Å; R797-D814 IonicContact CZ-OD2 2.77Å; R797-D814 PolarHBondContact N-OD1 3.48Å; R797-D814 IonicContact NE-OD2 3.16Å; R797-D814 PolarHBondContact NE-OD2 3.29Å; R797-D814 IonicContact NH2-OD2 2.77Å; R797-D814 PolarHBondContact NH2-OD2 3.28Å; R797-D814 PolarHBondContact O-N 3.25Å
798	I	91.4	Very high	86.3	Confident	11 Å²	11	50 Å²	50	6%	0.056	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	124.6	-179.6	-54.9	174.4	0	0	0	108.3	M769 A774 L788 F796 V801 L811	M769-I798 HydrophobicContact CG-CG2 4.35Å; M769-I798 HydrophobicContact SD-CG2 3.98Å; A774-I798 HydrophobicContact CB-CD1 3.56Å; L788-I798 HydrophobicContact CD2-CD1 4Å; F796-I798 HydrophobicContact CE2-CG1 4.49Å; I798-V801 HydrophobicContact CG2-CG1 3.64Å; I798-L811 HydrophobicContact CD1-CD1 4.45Å
799	L	91.5	Very high	86.5	Confident	30 Å²	30	49.7 Å²	49.7	16%	0.157	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	-42.3	178.8	-64	-179.4	0	0	0	111.6	P466 F468 A812 D814	P466-L799 HydrophobicContact CB-CD1 3.53Å; F468-L799 HydrophobicContact CD2-CD1 4.4Å; L799-A812 PolarHBondContact N-O 3.08Å; L799-D814 HydrophobicContact CD1-CB 4.24Å; L799-D814 HydrophobicContact CD2-CB 4.14Å; L799-D814 HydrophobicContact CG-CB 4.18Å
800	D	92.7	Very high	86.8	Confident	19 Å²	19	44.3 Å²	44.3	10%	0.102	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	157.6	-178.9	-163.9	17	0	0	0	112	I470 K754 A812	I470-D800 HydrophobicContact CG1-CB 3.94Å; I470-D800 WeakPolarHBondContact CG1-OD2 3.37Å; I470-D800 PolarHBondContact N-OD2 3.13Å; K754-D800 WeakPolarHBondContact CD-OD1 3.33Å; K754-D800 WeakPolarHBondContact CE-OD1 3.37Å; K754-D800 VanDerWaalsContact NZ-CG 3.3Å; K754-D800 IonicContact NZ-OD1 2.72Å; K754-D800 PolarHBondContact NZ-OD1 3.21Å; K754-D800 IonicContact NZ-OD2 3.76Å; K754-D800 PolarHBondContact NZ-OD2 3.36Å; D800-A812 HydrophobicContact CB-CB 4.29Å; D800-A812 PolarHBondContact N-O 2.98Å; D800-A812 PolarHBondContact O-N 3.16Å
801	V	95	Very high	87.3	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	146.6	-178.7	-59.3	0	0	0	0	112.9	K754 I767 M769 A774 I798 I810 L811	K754-V801 HydrophobicContact CD-CG2 4.22Å; K754-V801 WeakPolarHBondContact CE-O 3.49Å; K754-V801 PolarHBondContact NZ-O 3.21Å; I767-V801 HydrophobicContact CD1-CB 4.07Å; I767-V801 HydrophobicContact CD1-CG1 4.21Å; I767-V801 HydrophobicContact CD1-CG2 4.47Å; I767-V801 HydrophobicContact CG2-CG2 4.04Å; M769-V801 HydrophobicContact CB-CG1 4.1Å; M769-V801 HydrophobicContact CB-CG2 3.76Å; M769-V801 HydrophobicContact CG-CG1 4.14Å; M769-V801 HydrophobicContact CG-CG2 4.49Å; M769-V801 HydrophobicContact SD-CB 4.5Å; M769-V801 HydrophobicContact SD-CG1 3.85Å; M769-V801 HydrophobicContact SD-CG2 4.2Å; A774-V801 HydrophobicContact CB-CG1 4.43Å; I798-V801 HydrophobicContact CG2-CG1 3.64Å; V801-I810 WeakPolarHBondContact CA-O 3.5Å; V801-L811 HydrophobicContact CB-CD2 4.36Å; V801-L811 HydrophobicContact CG1-CD2 3.57Å
802	D	94.9	Very high	88.2	Confident	11 Å²	11	39.4 Å²	39.4	6%	0.059	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	177.1	166.9	-148.2	-9.7	0	0	0	111.2	I470 R471 M472 I810	I470-D802 HydrophobicContact CD1-CB 4.35Å; R471-D802 IonicContact NH1-OD1 3.65Å; R471-D802 IonicContact NH1-OD2 3.93Å; R471-D802 PolarHBondContact NH1-OD2 3.44Å; R471-D802 VanDerWaalsContact NH1-OD2 3.17Å; M472-D802 PolarHBondContact N-OD2 3.35Å; D802-I810 PolarHBondContact N-O 3.32Å; D802-I810 PolarHBondContact O-N 3.47Å
803	W	92.7	Very high	89	Confident	8 Å²	8	29.7 Å²	29.7	3%	0.03	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	136	174.2	-71.6	86.7	0	0	0	111.3	M472 R756 A758 P759 K765 I767 V776 V809 M823	M472-W803 WeakPolarHBondContact CB-O 3.25Å; M472-W803 WeakPolarHBondContact CG-O 3.33Å; R756-W803 PolarHBondContact O-NE1 2.85Å; A758-W803 HydrophobicContact CB-CD2 3.58Å; A758-W803 HydrophobicContact CB-CE3 3.6Å; A758-W803 HydrophobicContact CB-CG 4.27Å; A758-W803 HydrophobicContact CB-CH2 3.82Å; A758-W803 HydrophobicContact CB-CZ2 3.79Å; A758-W803 HydrophobicContact CB-CZ3 3.71Å; P759-W803 VanDerWaalsContact CD-CB 3.46Å; P759-W803 HydrophobicContact CG-CB 4.34Å; K765-W803 HydrophobicContact CB-CH2 4.27Å; I767-W803 HydrophobicContact CB-CZ2 3.92Å; I767-W803 HydrophobicContact CG2-CZ2 4.49Å; V776-W803 HydrophobicContact CG1-CH2 3.91Å; V776-W803 HydrophobicContact CG1-CZ2 4.23Å; W803-V809 HydrophobicContact CD2-CG1 4.13Å; W803-V809 HydrophobicContact CE3-CG1 3.78Å; W803-V809 HydrophobicContact CH2-CG1 3.71Å; W803-V809 HydrophobicContact CZ2-CG1 4.06Å; W803-V809 HydrophobicContact CZ3-CG1 3.57Å; W803-M823 HydrophobicContact CH2-CG 4.22Å; W803-M823 HydrophobicContact CZ3-CG 4.03Å
804	C	88.1	Confident	89.8	Confident	5 Å²	5	27.2 Å²	27.2	3%	0.034	14%	0.142	C	C	.	.	S	Bend	trans	-88.2	-53.6	173.1	-172.8	0	0	0	0	111.4	L502 K808 I810 V820	L502-C804 HydrophobicContact CD1-CB 4.33Å; L502-C804 WeakPolarHBondContact CD1-SG 3.45Å; C804-K808 HydrophobicContact CB-CB 4.24Å; C804-K808 PolarHBondContact N-O 3.46Å; C804-I810 HydrophobicContact CB-CD1 3.81Å; C804-I810 HydrophobicContact CB-CG1 3.78Å; C804-V820 HydrophobicContact CB-CG1 4.42Å
805	T	86.6	Confident	90.1	Very high	28 Å²	28	26.4 Å²	26.4	17%	0.172	14%	0.136	C	C	.	.	S	Bend	trans	-133.9	-178.1	180	57	0	0	0	0	109	V10 D807 K808	V10-T805 HydrophobicContact CB-CG2 4.39Å; V10-T805 HydrophobicContact CG2-CG2 4.08Å; T805-D807 WeakPolarHBondContact CB-OD1 3.23Å; T805-D807 PolarHBondContact O-N 3.34Å; T805-D807 VanDerWaalsContact O-N 3.14Å; T805-D807 PolarHBondContact OG1-OD1 3.15Å; T805-K808 WeakPolarHBondContact OG1-CB 3.33Å; T805-K808 WeakPolarHBondContact OG1-CG 3.34Å; T805-K808 PolarHBondContact OG1-N 3.03Å
806	S	87.1	Confident	90.4	Very high	58 Å²	58	22.7 Å²	22.7	41%	0.406	11%	0.114	S	C	.	.	S	Bend	trans	-63.2	-18	-179.7	45.4	0	0	0	0	114.5	N763	N763-S806 WeakPolarHBondContact ND2-CB 3.37Å; N763-S806 PolarHBondContact ND2-O 3.36Å
807	D	87.1	Confident	90.6	Very high	61 Å²	61	22 Å²	22	33%	0.326	11%	0.11	S	C	.	.	S	Bend	trans	-124.2	-3.3	-171	63.7	-47.8	0	0	0	113.6	T805 M823	T805-D807 WeakPolarHBondContact CB-OD1 3.23Å; T805-D807 PolarHBondContact O-N 3.34Å; T805-D807 VanDerWaalsContact O-N 3.14Å; T805-D807 PolarHBondContact OG1-OD1 3.15Å; D807-M823 WeakPolarHBondContact O-CG 3.37Å; D807-M823 PolarHBondContact O-N 2.78Å
808	K	89.8	Confident	90.8	Very high	22 Å²	22	15 Å²	15	10%	0.096	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	136.2	-176.8	-62.6	-178.7	176.6	66.3	0	112.7	V10 C804 T805 V820 L821	V10-K808 HydrophobicContact CB-CD 4.22Å; V10-K808 HydrophobicContact CG1-CD 4.22Å; C804-K808 HydrophobicContact CB-CB 4.24Å; C804-K808 PolarHBondContact N-O 3.46Å; T805-K808 WeakPolarHBondContact OG1-CB 3.33Å; T805-K808 WeakPolarHBondContact OG1-CG 3.34Å; T805-K808 PolarHBondContact OG1-N 3.03Å; K808-V820 HydrophobicContact CB-CG1 4.37Å; K808-V820 HydrophobicContact CD-CG1 4.3Å; K808-L821 CarbonylContact C-O 3.57Å; K808-L821 VanDerWaalsContact CA-O 3.23Å; K808-L821 WeakPolarHBondContact CA-O 3.18Å; K808-L821 WeakPolarHBondContact CB-O 3.34Å
809	V	93.2	Very high	90.8	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	148.2	-179.3	-61.6	0	0	0	0	110.3	I767 V776 W803 V820 L821 M825	I767-V809 HydrophobicContact CD1-CB 4.09Å; I767-V809 HydrophobicContact CD1-CG1 4.03Å; V776-V809 HydrophobicContact CG2-CG1 4.38Å; W803-V809 HydrophobicContact CD2-CG1 4.13Å; W803-V809 HydrophobicContact CE3-CG1 3.78Å; W803-V809 HydrophobicContact CH2-CG1 3.71Å; W803-V809 HydrophobicContact CZ2-CG1 4.06Å; W803-V809 HydrophobicContact CZ3-CG1 3.57Å; V809-V820 CarbonylContact O-C 3.57Å; V809-V820 WeakPolarHBondContact O-CA 3.26Å; V809-L821 HydrophobicContact CG2-CB 4.02Å; V809-L821 PolarHBondContact N-O 3.3Å; V809-L821 PolarHBondContact O-N 3.21Å; V809-M825 HydrophobicContact CB-CE 4.47Å; V809-M825 HydrophobicContact CG1-CE 4.36Å; V809-M825 HydrophobicContact CG2-CE 4.03Å; V809-M825 HydrophobicContact CG2-CG 4.08Å
810	I	94.4	Very high	90.8	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	125.8	175.7	-52	177.5	0	0	0	107.7	I470 M472 L488 L502 V801 D802 C804 I818 R819 V820	I470-I810 HydrophobicContact CD1-CB 4.21Å; I470-I810 HydrophobicContact CD1-CG2 3.63Å; M472-I810 HydrophobicContact CB-CD1 4.37Å; M472-I810 HydrophobicContact CG-CD1 4.5Å; M472-I810 HydrophobicContact SD-CD1 4.02Å; L488-I810 HydrophobicContact CD1-CD1 3.87Å; L488-I810 HydrophobicContact CD2-CD1 4.43Å; L488-I810 HydrophobicContact CD2-CG2 4.14Å; L502-I810 HydrophobicContact CD1-CD1 3.81Å; V801-I810 WeakPolarHBondContact CA-O 3.5Å; D802-I810 PolarHBondContact N-O 3.32Å; D802-I810 PolarHBondContact O-N 3.47Å; C804-I810 HydrophobicContact CB-CD1 3.81Å; C804-I810 HydrophobicContact CB-CG1 3.78Å; I810-I818 HydrophobicContact CG2-CG2 3.58Å; I810-R819 CarbonylContact C-O 3.55Å; I810-R819 WeakPolarHBondContact CA-O 3.46Å; I810-V820 HydrophobicContact CG1-CG2 4.44Å
811	L	93.3	Very high	90.7	Very high	1 Å²	1	12.6 Å²	12.6	1%	0.005	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	120.8	176.9	-52.9	179.4	0	0	0	109	I767 A774 L788 I798 V801 I818 R819 L821 M825	I767-L811 HydrophobicContact CD1-CD2 4.08Å; A774-L811 HydrophobicContact CB-CD2 4.49Å; L788-L811 HydrophobicContact CD2-CD1 3.5Å; I798-L811 HydrophobicContact CD1-CD1 4.45Å; V801-L811 HydrophobicContact CB-CD2 4.36Å; V801-L811 HydrophobicContact CG1-CD2 3.57Å; L811-I818 CarbonylContact O-C 3.51Å; L811-I818 WeakPolarHBondContact O-CA 3.27Å; L811-R819 HydrophobicContact CB-CB 4.48Å; L811-R819 PolarHBondContact N-O 2.82Å; L811-R819 PolarHBondContact O-N 3.39Å; L811-L821 HydrophobicContact CD1-CD1 3.76Å; L811-M825 HydrophobicContact CD2-CE 4.45Å
812	A	92.6	Very high	90.4	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	133.3	167.4	0	0	0	0	0	109.2	F468 I470 L799 D800 I818	F468-A812 HydrophobicContact CB-CB 4.25Å; F468-A812 HydrophobicContact CD2-CB 4.27Å; I470-A812 HydrophobicContact CD1-CB 4.07Å; I470-A812 HydrophobicContact CG1-CB 4.38Å; I470-A812 HydrophobicContact CG2-CB 3.93Å; L799-A812 PolarHBondContact N-O 3.08Å; D800-A812 HydrophobicContact CB-CB 4.29Å; D800-A812 PolarHBondContact N-O 2.98Å; D800-A812 PolarHBondContact O-N 3.16Å; A812-I818 HydrophobicContact CB-CG1 4.32Å
813	S	90.9	Very high	90	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	162.7	-173	45.1	0	0	0	0	113.4	R797 D815 G816 C817 R819	R797-S813 CarbonylContact O-C 3.59Å; R797-S813 VanDerWaalsContact O-CA 3.23Å; R797-S813 WeakPolarHBondContact O-CA 3.39Å; R797-S813 WeakPolarHBondContact O-CB 3.35Å; S813-D815 VanDerWaalsContact C-N 3.28Å; S813-D815 WeakPolarHBondContact CB-OD1 3.25Å; S813-D815 PolarHBondContact O-N 3.12Å; S813-D815 PolarHBondContact OG-OD1 2.86Å; S813-G816 PolarHBondContact O-N 2.89Å; S813-C817 PolarHBondContact N-O 3.39Å; S813-C817 PolarHBondContact OG-O 3.31Å; S813-R819 PolarHBondContact OG-NH1 3.25Å
814	D	88.6	Confident	89.7	Confident	49 Å²	49	20.6 Å²	20.6	26%	0.262	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-7.9	-178.1	68.7	-15.5	0	0	0	114.7	P466 F796 R797 L799 G816	P466-D814 WeakPolarHBondContact CG-O 3.32Å; F796-D814 WeakPolarHBondContact CA-OD1 3.14Å; R797-D814 WeakPolarHBondContact CB-OD2 3.25Å; R797-D814 IonicContact CZ-OD2 2.77Å; R797-D814 PolarHBondContact N-OD1 3.48Å; R797-D814 IonicContact NE-OD2 3.16Å; R797-D814 PolarHBondContact NE-OD2 3.29Å; R797-D814 IonicContact NH2-OD2 2.77Å; R797-D814 PolarHBondContact NH2-OD2 3.28Å; R797-D814 PolarHBondContact O-N 3.25Å; L799-D814 HydrophobicContact CD1-CB 4.24Å; L799-D814 HydrophobicContact CD2-CB 4.14Å; L799-D814 HydrophobicContact CG-CB 4.18Å; D814-G816 PolarHBondContact O-N 3.32Å
815	D	86.1	Confident	89.5	Confident	12 Å²	12	20.8 Å²	20.8	6%	0.064	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	16.7	167.5	66.8	-7.1	0	0	0	113.1	H40 F796 S813 C817 R819	H40-D815 HydrophobicContact CB-CB 4.41Å; H40-D815 PolarHBondContact CD2-O 3.39Å; H40-D815 PolarHBondContact NE2-O 3.14Å; F796-D815 HydrophobicContact CB-CB 4.25Å; S813-D815 VanDerWaalsContact C-N 3.28Å; S813-D815 WeakPolarHBondContact CB-OD1 3.25Å; S813-D815 PolarHBondContact O-N 3.12Å; S813-D815 PolarHBondContact OG-OD1 2.86Å; D815-C817 PolarHBondContact O-N 3.24Å; D815-C817 WeakPolarHBondContact OD1-CB 3.49Å; D815-C817 PolarHBondContact OD1-N 3.26Å; D815-R819 IonicContact OD1-NH1 3.92Å; D815-R819 PolarHBondContact OD1-NH1 3.29Å; D815-R819 IonicContact OD2-CZ 3.51Å; D815-R819 IonicContact OD2-NH1 3.79Å; D815-R819 PolarHBondContact OD2-NH1 3.05Å; D815-R819 IonicContact OD2-NH2 2.66Å; D815-R819 PolarHBondContact OD2-NH2 3.2Å
816	G	86.9	Confident	89.2	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.14	C	C	.	.	S	Bend	trans	74.6	6.6	177.1	0	0	0	0	0	115	G17 S813 D814	G17-G816 WeakPolarHBondContact CA-O 3.37Å; S813-G816 PolarHBondContact O-N 2.89Å; D814-G816 PolarHBondContact O-N 3.32Å
817	C	90.9	Very high	88.6	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.14	C	C	.	.			trans	-101.6	155.5	-177.2	-61.1	0	0	0	0	113	T14 L15 S813 D815	T14-C817 HydrophobicContact CG2-CB 4Å; L15-C817 CarbonylContact O-C 3.54Å; L15-C817 VanDerWaalsContact O-CA 3.27Å; L15-C817 WeakPolarHBondContact O-CA 3.37Å; S813-C817 PolarHBondContact N-O 3.39Å; S813-C817 PolarHBondContact OG-O 3.31Å; D815-C817 PolarHBondContact O-N 3.24Å; D815-C817 WeakPolarHBondContact OD1-CB 3.49Å; D815-C817 PolarHBondContact OD1-N 3.26Å
818	I	92.7	Very high	87.9	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	120.6	167.1	-66	171.5	0	0	0	108.4	L15 L463 I470 L488 V490 I810 L811 A812	L15-I818 HydrophobicContact CB-CB 4.27Å; L15-I818 HydrophobicContact CD1-CB 4.45Å; L15-I818 PolarHBondContact N-O 2.91Å; L15-I818 PolarHBondContact O-N 2.95Å; L463-I818 HydrophobicContact CD1-CB 4.03Å; L463-I818 HydrophobicContact CD1-CD1 3.72Å; L463-I818 HydrophobicContact CD1-CG1 3.68Å; L463-I818 HydrophobicContact CD2-CD1 3.99Å; I470-I818 HydrophobicContact CG2-CD1 4.03Å; L488-I818 HydrophobicContact CD2-CD1 4.32Å; L488-I818 HydrophobicContact CD2-CG2 3.87Å; V490-I818 HydrophobicContact CB-CD1 4.28Å; V490-I818 HydrophobicContact CG1-CD1 3.8Å; V490-I818 HydrophobicContact CG2-CD1 3.44Å; V490-I818 VanDerWaalsContact CG2-CD1 3.44Å; I810-I818 HydrophobicContact CG2-CG2 3.58Å; L811-I818 CarbonylContact O-C 3.51Å; L811-I818 WeakPolarHBondContact O-CA 3.27Å; A812-I818 HydrophobicContact CB-CG1 4.32Å
819	R	91.9	Very high	87.3	Confident	3 Å²	3	24.7 Å²	24.7	1%	0.011	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	120.6	-175.4	-63.1	-178.7	169.7	85.4	-3.4	110.6	T14 E58 I810 L811 S813 D815 L821	T14-R819 HydrophobicContact CG2-CG 3.84Å; E58-R819 IonicContact OE1-NE 3.65Å; E58-R819 PolarHBondContact OE1-NE 2.82Å; I810-R819 CarbonylContact C-O 3.55Å; I810-R819 WeakPolarHBondContact CA-O 3.46Å; L811-R819 HydrophobicContact CB-CB 4.48Å; L811-R819 PolarHBondContact N-O 2.82Å; L811-R819 PolarHBondContact O-N 3.39Å; S813-R819 PolarHBondContact OG-NH1 3.25Å; D815-R819 IonicContact OD1-NH1 3.92Å; D815-R819 PolarHBondContact OD1-NH1 3.29Å; D815-R819 IonicContact OD2-CZ 3.51Å; D815-R819 IonicContact OD2-NH1 3.79Å; D815-R819 PolarHBondContact OD2-NH1 3.05Å; D815-R819 IonicContact OD2-NH2 2.66Å; D815-R819 PolarHBondContact OD2-NH2 3.2Å; R819-L821 HydrophobicContact CB-CD1 4.37Å; R819-L821 HydrophobicContact CB-CD2 4.05Å; R819-L821 HydrophobicContact CB-CG 3.99Å
820	V	91.6	Very high	86.5	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	106	167.7	-175.9	0	0	0	0	107.1	V10 A12 R13 L502 C804 K808 V809 I810	V10-V820 HydrophobicContact CG1-CG1 4.27Å; A12-V820 CarbonylContact C-O 3.6Å; A12-V820 WeakPolarHBondContact CA-O 3.4Å; A12-V820 WeakPolarHBondContact CB-O 3.21Å; R13-V820 HydrophobicContact CG-CB 4.18Å; R13-V820 HydrophobicContact CG-CG2 4.3Å; R13-V820 PolarHBondContact N-O 3.05Å; R13-V820 PolarHBondContact O-N 3.38Å; L502-V820 HydrophobicContact CD1-CG2 4.33Å; L502-V820 HydrophobicContact CD2-CG2 4.16Å; C804-V820 HydrophobicContact CB-CG1 4.42Å; K808-V820 HydrophobicContact CB-CG1 4.37Å; K808-V820 HydrophobicContact CD-CG1 4.3Å; V809-V820 CarbonylContact O-C 3.57Å; V809-V820 WeakPolarHBondContact O-CA 3.26Å; I810-V820 HydrophobicContact CG1-CG2 4.44Å
821	L	90.6	Very high	85.7	Confident	6 Å²	6	32.2 Å²	32.2	3%	0.031	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	157.6	-175	-55.3	-178.8	0	0	0	110.8	K808 V809 L811 R819 K826 A828	K808-L821 CarbonylContact C-O 3.57Å; K808-L821 VanDerWaalsContact CA-O 3.23Å; K808-L821 WeakPolarHBondContact CA-O 3.18Å; K808-L821 WeakPolarHBondContact CB-O 3.34Å; V809-L821 HydrophobicContact CG2-CB 4.02Å; V809-L821 PolarHBondContact N-O 3.3Å; V809-L821 PolarHBondContact O-N 3.21Å; L811-L821 HydrophobicContact CD1-CD1 3.76Å; R819-L821 HydrophobicContact CB-CD1 4.37Å; R819-L821 HydrophobicContact CB-CD2 4.05Å; R819-L821 HydrophobicContact CB-CG 3.99Å; L821-K826 WeakPolarHBondContact CD2-O 3.25Å; L821-A828 HydrophobicContact CD2-CB 3.79Å
822	E	88.8	Confident	84.9	Confident	111 Å²	111	33 Å²	33	52%	0.519	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	162.2	162.5	-62.3	-161.9	156.8	0	0	111	S824 M825	E822-S824 PolarHBondContact O-N 2.88Å; E822-M825 PolarHBondContact O-N 3.43Å
823	M	86.6	Confident	83.7	Confident	21 Å²	21	38 Å²	38	10%	0.103	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-26.8	175.2	-81.8	179.9	62.4	0	0	114.8	K765 V776 V785 S786 W803 D807 M825	K765-M823 HydrophobicContact CD-CE 3.33Å; K765-M823 HydrophobicContact CD-SD 3.52Å; K765-M823 VanDerWaalsContact CD-SD 3.52Å; K765-M823 VanDerWaalsContact CE-CE 3.4Å; K765-M823 HydrophobicContact CG-CE 4.14Å; K765-M823 VanDerWaalsContact NZ-CE 3.29Å; K765-M823 PolarHBondContact NZ-SD 3.24Å; V776-M823 HydrophobicContact CG1-CE 3.92Å; V785-M823 HydrophobicContact CG1-CE 3.99Å; S786-M823 VanDerWaalsContact CB-O 3.27Å; S786-M823 WeakPolarHBondContact CB-O 2.97Å; S786-M823 PolarHBondContact OG-O 3.26Å; W803-M823 HydrophobicContact CH2-CG 4.22Å; W803-M823 HydrophobicContact CZ3-CG 4.03Å; D807-M823 WeakPolarHBondContact O-CG 3.37Å; D807-M823 PolarHBondContact O-N 2.78Å; M823-M825 PolarHBondContact O-N 3.35Å
824	S	85.6	Confident	82.6	Confident	55 Å²	55	44 Å²	44	39%	0.385	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-11	176.1	61.6	0	0	0	0	113.4	E822 K826	E822-S824 PolarHBondContact O-N 2.88Å; S824-K826 PolarHBondContact O-N 3.4Å
825	M	84.2	Confident	81.6	Confident	10 Å²	10	43 Å²	43	5%	0.049	21%	0.213	C	C	.	.			trans	51	38.8	-178.5	-64.4	177.7	167.2	0	0	112.7	I767 A774 V776 L788 V809 L811 E822 M823	I767-M825 HydrophobicContact CD1-CE 3.4Å; I767-M825 HydrophobicContact CG1-CE 3.92Å; A774-M825 HydrophobicContact CB-CE 4.27Å; V776-M825 HydrophobicContact CG2-CE 3.3Å; V776-M825 HydrophobicContact CG2-SD 4.09Å; L788-M825 HydrophobicContact CB-CB 4.3Å; L788-M825 HydrophobicContact CB-SD 3.92Å; V809-M825 HydrophobicContact CB-CE 4.47Å; V809-M825 HydrophobicContact CG1-CE 4.36Å; V809-M825 HydrophobicContact CG2-CE 4.03Å; V809-M825 HydrophobicContact CG2-CG 4.08Å; L811-M825 HydrophobicContact CD2-CE 4.45Å; E822-M825 PolarHBondContact O-N 3.43Å; M823-M825 PolarHBondContact O-N 3.35Å
826	K	80.6	Confident	80.6	Confident	156 Å²	156	49 Å²	49	68%	0.678	24%	0.241	S	C	*	.			trans	-90.7	176.5	173.2	-69.6	-175.9	178.9	178.5	0	110	L821 S824	L821-K826 WeakPolarHBondContact CD2-O 3.25Å; S824-K826 PolarHBondContact O-N 3.4Å
827	S	73.6	Confident	79.9	Confident	59 Å²	59	51.7 Å²	51.7	41%	0.413	26%	0.255	S	S	.	.			trans	-49.3	145.9	178.3	174.1	0	0	0	0	112.5	C829	S827-C829 PolarHBondContact O-N 3.01Å; S827-C829 PolarHBondContact OG-N 3.14Å; S827-C829 VanDerWaalsContact OG-N 3.09Å; S827-C829 PolarHBondContact OG-SG 2.83Å
828	A	73.8	Confident	78.9	Confident	2 Å²	2	54.7 Å²	54.7	2%	0.017	27%	0.274	C	S	.	.	S	Bend	trans	-80.1	4.2	173.1	0	0	0	0	0	113.5	T14 E58 L821 F830	T14-A828 VanDerWaalsContact OG1-CB 3.3Å; T14-A828 WeakPolarHBondContact OG1-CB 3.36Å; E58-A828 PolarHBondContact OE2-N 2.72Å; E58-A828 VanDerWaalsContact OE2-N 3.11Å; L821-A828 HydrophobicContact CD2-CB 3.79Å; A828-F830 WeakPolarHBondContact O-CD1 3.45Å
829	C	77.3	Confident	78.1	Confident	33 Å²	33	59.6 Å²	59.6	22%	0.223	30%	0.296	C	S	.	.			trans	-70.1	136.2	173.5	-58.3	0	0	0	0	111.1	V56 E58 S827	V56-C829 PolarHBondContact O-SG 3.1Å; E58-C829 PolarHBondContact N-SG 2.85Å; S827-C829 PolarHBondContact O-N 3.01Å; S827-C829 PolarHBondContact OG-N 3.14Å; S827-C829 VanDerWaalsContact OG-N 3.09Å; S827-C829 PolarHBondContact OG-SG 2.83Å
830	F	76.6	Confident	77.4	Confident	33 Å²	33	63 Å²	63	15%	0.145	32%	0.318	C	S	.	.			trans	-139.9	165.1	176.9	53.7	-93.3	0	0	0	109.7	Q55 A828 M832 Q835	Q55-F830 PolarHBondContact NE2-O 2.45Å; A828-F830 WeakPolarHBondContact O-CD1 3.45Å; F830-M832 HydrophobicContact CD2-SD 4.4Å; F830-M832 HydrophobicContact CE2-CE 4.48Å; F830-M832 HydrophobicContact CE2-SD 3.62Å; F830-M832 HydrophobicContact CZ-SD 4.26Å; F830-Q835 HydrophobicContact CD2-CB 4.09Å; F830-Q835 HydrophobicContact CE2-CB 3.61Å; F830-Q835 HydrophobicContact CE2-CG 4.01Å; F830-Q835 HydrophobicContact CZ-CB 4.33Å; F830-Q835 HydrophobicContact CZ-CG 4.23Å
831	R	77.5	Confident	77.1	Confident	126 Å²	126	63 Å²	63	48%	0.475	32%	0.319	S	S	.	.			trans	-78	130.9	169.9	-58.8	170.7	52.7	110.1	0.4	109	A102 D833 E834	A102-R831 WeakPolarHBondContact O-CG 3.36Å; R831-D833 WeakPolarHBondContact CB-OD1 3.46Å; R831-D833 IonicContact CZ-OD2 2.65Å; R831-D833 IonicContact NE-OD1 2.97Å; R831-D833 PolarHBondContact NE-OD1 3.35Å; R831-D833 IonicContact NE-OD2 3.45Å; R831-D833 PolarHBondContact NE-OD2 3.32Å; R831-D833 IonicContact NH2-OD2 3.35Å; R831-D833 PolarHBondContact NH2-OD2 2.76Å; R831-D833 PolarHBondContact O-N 3.07Å; R831-D833 VanDerWaalsContact O-N 3.12Å; R831-E834 HydrophobicContact CB-CG 4.42Å; R831-E834 WeakPolarHBondContact O-CB 3.49Å; R831-E834 PolarHBondContact O-N 3.19Å
832	M	75.8	Confident	77	Confident	18 Å²	18	64 Å²	64	9%	0.089	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-62.9	-21.9	-171.4	-68.6	-61.6	-57.9	0	0	113.8	L54 Q55 A101 F830 E834 Q835 L837 L846	L54-M832 HydrophobicContact CB-CE 3.83Å; L54-M832 WeakPolarHBondContact O-CE 3.42Å; Q55-M832 HydrophobicContact CB-SD 3.85Å; Q55-M832 HydrophobicContact CG-SD 3.96Å; A101-M832 PolarHBondContact O-N 3.39Å; F830-M832 HydrophobicContact CD2-SD 4.4Å; F830-M832 HydrophobicContact CE2-CE 4.48Å; F830-M832 HydrophobicContact CE2-SD 3.62Å; F830-M832 HydrophobicContact CZ-SD 4.26Å; M832-E834 PolarHBondContact O-N 3.44Å; M832-Q835 PolarHBondContact O-N 3.16Å; M832-L837 HydrophobicContact CE-CD2 4.28Å; M832-L846 HydrophobicContact CB-CD2 4.08Å; M832-L846 HydrophobicContact CG-CD2 4.07Å
833	D	67.4	Low	76.9	Confident	104 Å²	104	58.7 Å²	58.7	56%	0.556	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-66.3	-19.7	173.6	53.8	-9	0	0	0	113.5	R831	R831-D833 WeakPolarHBondContact CB-OD1 3.46Å; R831-D833 IonicContact CZ-OD2 2.65Å; R831-D833 IonicContact NE-OD1 2.97Å; R831-D833 PolarHBondContact NE-OD1 3.35Å; R831-D833 IonicContact NE-OD2 3.45Å; R831-D833 PolarHBondContact NE-OD2 3.32Å; R831-D833 IonicContact NH2-OD2 3.35Å; R831-D833 PolarHBondContact NH2-OD2 2.76Å; R831-D833 PolarHBondContact O-N 3.07Å; R831-D833 VanDerWaalsContact O-N 3.12Å
834	E	67.6	Low	76.8	Confident	126 Å²	126	57.7 Å²	57.7	59%	0.589	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-89.6	-8.6	-179.1	-62.6	177.3	177.3	0	0	113.7	R831 M832	R831-E834 HydrophobicContact CB-CG 4.42Å; R831-E834 WeakPolarHBondContact O-CB 3.49Å; R831-E834 PolarHBondContact O-N 3.19Å; M832-E834 PolarHBondContact O-N 3.44Å
835	Q	68.4	Low	76.9	Confident	27 Å²	27	55.3 Å²	55.3	13%	0.126	28%	0.275	C	S	.	.			trans	-100.3	129	-175.1	-167.7	-174.4	17.9	0	0	112.3	L54 F830 M832 L837	L54-Q835 PolarHBondContact O-OE1 3.14Å; F830-Q835 HydrophobicContact CD2-CB 4.09Å; F830-Q835 HydrophobicContact CE2-CB 3.61Å; F830-Q835 HydrophobicContact CE2-CG 4.01Å; F830-Q835 HydrophobicContact CZ-CB 4.33Å; F830-Q835 HydrophobicContact CZ-CG 4.23Å; M832-Q835 PolarHBondContact O-N 3.16Å; Q835-L837 PolarHBondContact O-N 3.14Å
836	E	65.2	Low	76.9	Confident	139 Å²	139	56.7 Å²	56.7	65%	0.65	28%	0.283	S	S	*	.			trans	-80.5	109.7	163	-74.6	162.8	-140.3	0	0	108.4	K9	K9-E836 IonicContact NZ-OE1 3.76Å
837	L	70.6	Confident	77	Confident	56 Å²	56	49.9 Å²	49.9	29%	0.293	25%	0.253	S	S	.	.			trans	-70.8	147.5	173	-63	175.5	0	0	0	109.9	L54 M832 Q835 V841	L54-L837 HydrophobicContact CD2-CD1 4.44Å; L54-L837 HydrophobicContact CD2-CD2 3.97Å; M832-L837 HydrophobicContact CE-CD2 4.28Å; Q835-L837 PolarHBondContact O-N 3.14Å; L837-V841 HydrophobicContact CD1-CB 4.35Å; L837-V841 HydrophobicContact CD1-CG2 4.04Å
838	T	70.8	Confident	77.5	Confident	64 Å²	64	51.5 Å²	51.5	39%	0.393	26%	0.261	S	S	.	.	S	Bend	trans	-71.1	-39.5	178	32.1	0	0	0	0	113.4	Q52 S504	Q52-T838 PolarHBondContact OE1-OG1 3.09Å; S504-T838 VanDerWaalsContact CA-CG2 3.47Å
839	E	74.9	Confident	77.9	Confident	103 Å²	103	53.9 Å²	53.9	48%	0.481	28%	0.276	S	S	.	.	S	Bend	trans	-125.1	137.3	173.6	-66.3	-173.1	170.1	0	0	107.9	T50 Q52 V841	T50-E839 HydrophobicContact CG2-CB 4.13Å; T50-E839 WeakPolarHBondContact CG2-OE2 3.45Å; Q52-E839 PolarHBondContact NE2-O 3.11Å; E839-V841 PolarHBondContact O-N 2.94Å
840	P	78.6	Confident	78.2	Confident	73 Å²	73	57.7 Å²	57.7	47%	0.474	29%	0.286	S	S	.	.			trans	-64.9	132.2	178.6	28.7	-34.6	0	0	0	109.6	S893	P840-S893 WeakPolarHBondContact O-CB 3.1Å
841	V	84.8	Confident	78.6	Confident	2 Å²	2	56.3 Å²	56.3	1%	0.012	28%	0.28	C	S	.	.			trans	-103.7	138.3	-179.1	177.5	0	0	0	0	109.6	D47 L54 L837 E839 C843 Q890	D47-V841 HydrophobicContact CB-CG1 4.07Å; D47-V841 HydrophobicContact CB-CG2 4.2Å; D47-V841 VanDerWaalsContact CG-CG1 3.49Å; L54-V841 HydrophobicContact CD2-CG2 3.93Å; L837-V841 HydrophobicContact CD1-CB 4.35Å; L837-V841 HydrophobicContact CD1-CG2 4.04Å; E839-V841 PolarHBondContact O-N 2.94Å; V841-C843 HydrophobicContact CG1-CB 4.17Å; V841-C843 PolarHBondContact O-N 2.87Å; V841-Q890 VanDerWaalsContact O-CD 3.29Å; V841-Q890 PolarHBondContact O-NE2 3.43Å; V841-Q890 PolarHBondContact O-OE1 2.98Å; V841-Q890 VanDerWaalsContact O-OE1 3.05Å
842	W	87.8	Confident	79.1	Confident	25 Å²	25	50.3 Å²	50.3	10%	0.095	26%	0.258	C	S	.	.			trans	-77.1	100.7	165.4	177.2	-97.1	0	0	0	109.5	P844 L855 L859 Q890 S893 L894 L919 Y920	W842-P844 HydrophobicContact CH2-CG 4.08Å; W842-P844 HydrophobicContact CZ2-CG 3.54Å; W842-L855 HydrophobicContact CH2-CD2 4.01Å; W842-L855 HydrophobicContact CZ3-CD2 4.2Å; W842-L859 HydrophobicContact CH2-CD1 3.81Å; W842-L859 HydrophobicContact CZ2-CD1 4.47Å; W842-Q890 HydrophobicContact CE3-CB 4.25Å; W842-Q890 HydrophobicContact CZ3-CB 4.07Å; W842-Q890 WeakPolarHBondContact CZ3-O 3.48Å; W842-S893 WeakPolarHBondContact CA-OG 3.29Å; W842-S893 PolarHBondContact N-OG 3.15Å; W842-L894 HydrophobicContact CD2-CD2 3.51Å; W842-L894 HydrophobicContact CD2-CG 4.24Å; W842-L894 HydrophobicContact CE3-CD1 4.39Å; W842-L894 HydrophobicContact CE3-CD2 3.44Å; W842-L894 VanDerWaalsContact CE3-CD2 3.44Å; W842-L894 HydrophobicContact CE3-CG 3.64Å; W842-L894 HydrophobicContact CG-CD2 4.13Å; W842-L894 HydrophobicContact CH2-CD1 4.39Å; W842-L894 HydrophobicContact CH2-CD2 4.1Å; W842-L894 HydrophobicContact CH2-CG 4.43Å; W842-L894 HydrophobicContact CZ2-CD2 4.15Å; W842-L894 HydrophobicContact CZ3-CD1 3.98Å; W842-L894 HydrophobicContact CZ3-CD2 3.74Å; W842-L894 HydrophobicContact CZ3-CG 3.75Å; W842-L919 HydrophobicContact CZ2-CB 3.92Å; W842-L919 HydrophobicContact CZ2-CD1 4.41Å; W842-L919 PolarHBondContact NE1-O 2.87Å; W842-Y920 HydrophobicContact CZ2-CE2 4.28Å
843	C	86.3	Confident	79.6	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.257	C	S	.	.			trans	-153.3	93.9	170.1	-169.9	0	0	0	0	109.3	V841 Y845 L846	V841-C843 HydrophobicContact CG1-CB 4.17Å; V841-C843 PolarHBondContact O-N 2.87Å; C843-Y845 PolarHBondContact O-N 3.37Å; C843-L846 HydrophobicContact CB-CD1 3.86Å; C843-L846 HydrophobicContact CB-CG 3.95Å; C843-L846 PolarHBondContact O-N 3.39Å
844	P	85.9	Confident	80.4	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.006	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-58.5	-16	-179.7	-26.9	35.5	0	0	0	114.7	W842 L847 S852 Y920	W842-P844 HydrophobicContact CH2-CG 4.08Å; W842-P844 HydrophobicContact CZ2-CG 3.54Å; P844-L847 WeakPolarHBondContact O-CB 3.24Å; P844-L847 PolarHBondContact O-N 2.72Å; P844-S852 VanDerWaalsContact O-CB 3.22Å; P844-S852 WeakPolarHBondContact O-CB 3.37Å; P844-S852 PolarHBondContact O-OG 2.84Å; P844-Y920 HydrophobicContact CB-CD1 3.89Å; P844-Y920 HydrophobicContact CB-CE1 3.37Å; P844-Y920 HydrophobicContact CB-CE2 4.13Å; P844-Y920 HydrophobicContact CB-CG 4.48Å; P844-Y920 VanDerWaalsContact CB-CZ 3.5Å; P844-Y920 HydrophobicContact CG-CD1 4.2Å; P844-Y920 HydrophobicContact CG-CD2 4.12Å; P844-Y920 HydrophobicContact CG-CE1 3.94Å; P844-Y920 HydrophobicContact CG-CE2 3.83Å; P844-Y920 HydrophobicContact CG-CG 4.29Å
845	Y	86.8	Confident	81.3	Confident	5 Å²	5	39.2 Å²	39.2	2%	0.02	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-80.2	-15.8	-179.8	-62.3	-111.9	0	0	0	113.3	Q32 E72 Y82 L84 C843 L847 Y920	Q32-Y845 HydrophobicContact CB-CD1 4.35Å; Q32-Y845 HydrophobicContact CB-CD2 3.73Å; Q32-Y845 HydrophobicContact CB-CE1 4.25Å; Q32-Y845 HydrophobicContact CB-CE2 3.64Å; Q32-Y845 HydrophobicContact CB-CG 4.13Å; E72-Y845 HydrophobicContact CG-CE1 3.85Å; Y82-Y845 HydrophobicContact CD1-CD1 4.09Å; Y82-Y845 AromaticContact CD1-CE1 3.49Å; Y82-Y845 HydrophobicContact CD1-CE1 3.49Å; Y82-Y845 VanDerWaalsContact CD1-CE1 3.49Å; Y82-Y845 HydrophobicContact CD1-CE2 4.34Å; Y82-Y845 AromaticContact CD1-CZ 3.61Å; Y82-Y845 HydrophobicContact CE1-CE1 4.36Å; Y82-Y845 HydrophobicContact CG-CD1 4.39Å; Y82-Y845 HydrophobicContact CG-CE1 4.23Å; L84-Y845 VanDerWaalsContact CD2-CB 3.41Å; L84-Y845 HydrophobicContact CD2-CD1 3.94Å; L84-Y845 HydrophobicContact CD2-CG 3.78Å; L84-Y845 HydrophobicContact CG-CG 4.43Å; C843-Y845 PolarHBondContact O-N 3.37Å; Y845-L847 VanDerWaalsContact C-N 3.28Å; Y845-Y920 WeakPolarHBondContact CE2-O 3.06Å; Y845-Y920 PolarHBondContact OH-O 2.97Å
846	L	84.3	Confident	82.3	Confident	39 Å²	39	38.2 Å²	38.2	20%	0.204	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-78.7	-17.4	173.1	-64.9	176.7	0	0	0	112	L84 M832 C843	L84-L846 HydrophobicContact CD1-CD2 3.61Å; L84-L846 HydrophobicContact CD1-CG 4.36Å; M832-L846 HydrophobicContact CB-CD2 4.08Å; M832-L846 HydrophobicContact CG-CD2 4.07Å; C843-L846 HydrophobicContact CB-CD1 3.86Å; C843-L846 HydrophobicContact CB-CG 3.95Å; C843-L846 PolarHBondContact O-N 3.39Å
847	L	83.3	Confident	83.2	Confident	12 Å²	12	31.9 Å²	31.9	6%	0.063	17%	0.17	C	C	.	.	S	Bend	trans	-75.3	153.3	176.5	-60.8	175.7	0	0	0	111	P844 Y845 A851 L855 L886 L887 Q890	P844-L847 WeakPolarHBondContact O-CB 3.24Å; P844-L847 PolarHBondContact O-N 2.72Å; Y845-L847 VanDerWaalsContact C-N 3.28Å; L847-A851 HydrophobicContact CB-CB 4.23Å; L847-L855 HydrophobicContact CD1-CD2 3.84Å; L847-L886 HydrophobicContact CD2-CB 4.05Å; L847-L886 HydrophobicContact CD2-CD2 4.02Å; L847-L887 HydrophobicContact CD1-CD2 3.53Å; L847-L887 HydrophobicContact CD2-CD2 4.49Å; L847-Q890 HydrophobicContact CD1-CG 4.12Å; L847-Q890 HydrophobicContact CD2-CG 4.1Å; L847-Q890 HydrophobicContact CG-CG 4.32Å
848	V	82.6	Confident	83.9	Confident	94 Å²	94	29.4 Å²	29.4	57%	0.57	16%	0.156	S	C	*	.			trans	-55	139.5	168.3	-178	0	0	0	0	109.2	R850 A851 S852	V848-R850 VanDerWaalsContact C-N 3.31Å; V848-R850 PolarHBondContact O-N 2.72Å; V848-R850 VanDerWaalsContact O-N 3.07Å; V848-A851 HydrophobicContact CB-CB 4.49Å; V848-A851 WeakPolarHBondContact O-CA 3.46Å; V848-A851 WeakPolarHBondContact O-CB 3.21Å; V848-A851 PolarHBondContact O-N 2.95Å; V848-S852 PolarHBondContact O-N 2.8Å
849	P	83.8	Confident	84.6	Confident	52 Å²	52	26.5 Å²	26.5	34%	0.338	14%	0.138	S	C	.	.	H	α-helix	trans	-46.5	-45.1	-173.4	-38.1	39.5	0	0	0	116.7	P81 A851 S852 L853	P81-P849 HydrophobicContact CB-CB 3.47Å; P81-P849 VanDerWaalsContact CB-CB 3.47Å; P81-P849 HydrophobicContact CB-CG 3.65Å; P81-P849 HydrophobicContact CG-CB 4.45Å; P81-P849 HydrophobicContact CG-CG 4.25Å; P849-A851 VanDerWaalsContact C-N 3.34Å; P849-A851 PolarHBondContact O-N 3.13Å; P849-S852 PolarHBondContact O-N 2.93Å; P849-L853 WeakPolarHBondContact O-CG 3.22Å; P849-L853 PolarHBondContact O-N 3.2Å; P849-L853 VanDerWaalsContact O-N 3.09Å
850	R	83.4	Confident	85	Confident	113 Å²	113	22 Å²	22	43%	0.426	12%	0.117	S	C	.	.	H	α-helix	trans	-62.6	-40.4	176.9	-74	-173.5	175.8	-172.6	-1.2	112.3	V848 A854 E879	V848-R850 VanDerWaalsContact C-N 3.31Å; V848-R850 PolarHBondContact O-N 2.72Å; V848-R850 VanDerWaalsContact O-N 3.07Å; R850-A854 WeakPolarHBondContact O-CB 3.33Å; R850-A854 PolarHBondContact O-N 3.06Å; R850-E879 IonicContact NH1-OE1 3.47Å; R850-E879 IonicContact NH1-OE2 3.81Å; R850-E879 PolarHBondContact NH1-OE2 2.96Å; R850-E879 VanDerWaalsContact NH1-OE2 3.08Å
851	A	84.1	Confident	84.7	Confident	3 Å²	3	19.1 Å²	19.1	3%	0.025	10%	0.098	C	C	.	.	H	α-helix	trans	-68.6	-38.9	178.3	0	0	0	0	0	111.6	L847 V848 P849 A854 L855 I883 L887	L847-A851 HydrophobicContact CB-CB 4.23Å; V848-A851 HydrophobicContact CB-CB 4.49Å; V848-A851 WeakPolarHBondContact O-CA 3.46Å; V848-A851 WeakPolarHBondContact O-CB 3.21Å; V848-A851 PolarHBondContact O-N 2.95Å; P849-A851 VanDerWaalsContact C-N 3.34Å; P849-A851 PolarHBondContact O-N 3.13Å; A851-A854 WeakPolarHBondContact O-CB 3.42Å; A851-A854 PolarHBondContact O-N 2.87Å; A851-L855 WeakPolarHBondContact O-CB 3.48Å; A851-L855 PolarHBondContact O-N 2.96Å; A851-I883 HydrophobicContact CB-CG2 3.61Å; A851-L887 HydrophobicContact CB-CD2 4.19Å
852	S	87.9	Confident	83.6	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-62.3	-45.8	175.3	-169.4	0	0	0	0	112.4	Y82 P844 V848 P849 A854 L855 K856 Y920	Y82-S852 WeakPolarHBondContact CD2-OG 3.49Å; P844-S852 VanDerWaalsContact O-CB 3.22Å; P844-S852 WeakPolarHBondContact O-CB 3.37Å; P844-S852 PolarHBondContact O-OG 2.84Å; V848-S852 PolarHBondContact O-N 2.8Å; P849-S852 PolarHBondContact O-N 2.93Å; S852-A854 VanDerWaalsContact C-N 3.32Å; S852-A854 PolarHBondContact O-N 2.78Å; S852-L855 PolarHBondContact O-N 3.38Å; S852-K856 PolarHBondContact O-N 2.72Å; S852-Y920 PolarHBondContact O-OH 2.91Å
853	L	87.2	Confident	81.9	Confident	16 Å²	16	20.9 Å²	20.9	8%	0.084	11%	0.111	C	C	.	.	H	α-helix	trans	-65.7	-36.3	174.4	-67.3	171.8	0	0	0	111.9	H76 I78 Y82 P849 K856 A857 L1190	H76-L853 HydrophobicContact CB-CD2 4.36Å; I78-L853 HydrophobicContact CG1-CD1 4.07Å; Y82-L853 HydrophobicContact CD2-CD2 4.32Å; Y82-L853 HydrophobicContact CE2-CD2 3.89Å; P849-L853 WeakPolarHBondContact O-CG 3.22Å; P849-L853 PolarHBondContact O-N 3.2Å; P849-L853 VanDerWaalsContact O-N 3.09Å; L853-K856 PolarHBondContact O-N 2.72Å; L853-A857 WeakPolarHBondContact O-CB 3.15Å; L853-A857 PolarHBondContact O-N 3.33Å; L853-L1190 HydrophobicContact CB-CD2 3.91Å; L853-L1190 HydrophobicContact CD1-CD2 4.29Å
854	A	84.3	Confident	80.5	Confident	0 Å²	0	24 Å²	24	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-64.1	-44.4	175.3	0	0	0	0	0	112.3	R850 A851 S852 K856 A857 F858 Y877 F1192	R850-A854 WeakPolarHBondContact O-CB 3.33Å; R850-A854 PolarHBondContact O-N 3.06Å; A851-A854 WeakPolarHBondContact O-CB 3.42Å; A851-A854 PolarHBondContact O-N 2.87Å; S852-A854 VanDerWaalsContact C-N 3.32Å; S852-A854 PolarHBondContact O-N 2.78Å; A854-K856 VanDerWaalsContact C-N 3.31Å; A854-K856 PolarHBondContact O-N 3.43Å; A854-A857 PolarHBondContact O-N 2.92Å; A854-F858 WeakPolarHBondContact O-CB 3.33Å; A854-F858 PolarHBondContact O-N 3.27Å; A854-Y877 HydrophobicContact CB-CE2 4.26Å; A854-F1192 VanDerWaalsContact CA-CE2 3.45Å; A854-F1192 HydrophobicContact CB-CE2 3.42Å; A854-F1192 VanDerWaalsContact CB-CE2 3.42Å; A854-F1192 HydrophobicContact CB-CZ 3.76Å; A854-F1192 WeakPolarHBondContact O-CZ 3.41Å
855	L	87.1	Confident	78.6	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-61	-41.9	174.7	-177.7	60.6	0	0	0	111.4	W842 L847 A851 S852 F858 L859 L887 Q890 L891 Y920	W842-L855 HydrophobicContact CH2-CD2 4.01Å; W842-L855 HydrophobicContact CZ3-CD2 4.2Å; L847-L855 HydrophobicContact CD1-CD2 3.84Å; A851-L855 WeakPolarHBondContact O-CB 3.48Å; A851-L855 PolarHBondContact O-N 2.96Å; S852-L855 PolarHBondContact O-N 3.38Å; L855-F858 PolarHBondContact O-N 2.78Å; L855-L859 HydrophobicContact CD1-CD1 4.42Å; L855-L859 HydrophobicContact CD1-CG 4.44Å; L855-L859 HydrophobicContact CG-CD1 4.28Å; L855-L859 WeakPolarHBondContact O-CG 3.47Å; L855-L859 PolarHBondContact O-N 3.3Å; L855-L887 HydrophobicContact CB-CD2 3.83Å; L855-L887 HydrophobicContact CD1-CD2 4.41Å; L855-L887 HydrophobicContact CD2-CD2 4.38Å; L855-L887 HydrophobicContact CG-CD2 4.43Å; L855-Q890 HydrophobicContact CD2-CB 4.03Å; L855-Q890 HydrophobicContact CD2-CG 4.48Å; L855-L891 HydrophobicContact CD1-CD1 4.45Å; L855-L891 HydrophobicContact CD1-CD2 3.87Å; L855-L891 HydrophobicContact CD1-CG 4Å; L855-Y920 WeakPolarHBondContact CB-OH 3.41Å; L855-Y920 WeakPolarHBondContact CG-OH 3.31Å
856	K	88.4	Confident	77.2	Confident	5 Å²	5	35.1 Å²	35.1	2%	0.022	20%	0.196	C	C	.	.	H	α-helix	trans	-61.4	-48.4	176	-175.7	170.3	177.3	174.2	0	110.6	Y82 S852 L853 A854 F858 L859 L860 V916 Y920 D922 E925	Y82-K856 HydrophobicContact CE2-CD 4.48Å; Y82-K856 WeakPolarHBondContact OH-CD 3.21Å; Y82-K856 PolarHBondContact OH-NZ 3.23Å; S852-K856 PolarHBondContact O-N 2.72Å; L853-K856 PolarHBondContact O-N 2.72Å; A854-K856 VanDerWaalsContact C-N 3.31Å; A854-K856 PolarHBondContact O-N 3.43Å; K856-F858 PolarHBondContact O-N 2.91Å; K856-L859 PolarHBondContact O-N 3.08Å; K856-L860 HydrophobicContact CG-CD1 3.81Å; K856-L860 WeakPolarHBondContact O-CB 3.34Å; K856-L860 VanDerWaalsContact O-CG 3.27Å; K856-L860 WeakPolarHBondContact O-CG 3.47Å; K856-L860 PolarHBondContact O-N 2.75Å; K856-V916 HydrophobicContact CG-CG1 4.17Å; K856-Y920 HydrophobicContact CB-CE1 4.06Å; K856-Y920 HydrophobicContact CB-CE2 4.21Å; K856-Y920 HydrophobicContact CD-CE1 4.44Å; K856-Y920 PolarHBondContact N-OH 2.8Å; K856-D922 IonicContact NZ-OD2 3.18Å; K856-D922 PolarHBondContact NZ-OD2 3.07Å; K856-E925 WeakPolarHBondContact CE-OE2 3.38Å; K856-E925 IonicContact NZ-OE1 3.95Å; K856-E925 PolarHBondContact NZ-OE1 3.35Å; K856-E925 IonicContact NZ-OE2 3.77Å; K856-E925 PolarHBondContact NZ-OE2 3.25Å
857	A	84.7	Confident	76.1	Confident	7 Å²	7	42 Å²	42	6%	0.058	23%	0.228	C	C	.	.	H	α-helix	trans	-57.7	-47.6	175.4	0	0	0	0	0	110.9	L853 A854 L859 L860 H861 L1187 F1192	L853-A857 WeakPolarHBondContact O-CB 3.15Å; L853-A857 PolarHBondContact O-N 3.33Å; A854-A857 PolarHBondContact O-N 2.92Å; A857-L859 PolarHBondContact O-N 2.81Å; A857-L860 PolarHBondContact O-N 3.06Å; A857-H861 WeakPolarHBondContact O-CA 3.4Å; A857-H861 WeakPolarHBondContact O-CB 3.35Å; A857-H861 PolarHBondContact O-CD2 3.08Å; A857-H861 PolarHBondContact O-N 2.75Å; A857-L1187 HydrophobicContact CB-CD2 4.25Å; A857-F1192 HydrophobicContact CB-CD2 4.41Å; A857-F1192 HydrophobicContact CB-CE2 4.22Å
858	F	84.4	Confident	75.4	Confident	3 Å²	3	45.4 Å²	45.4	1%	0.013	24%	0.24	C	C	.	.	H	α-helix	trans	-60.1	-40.8	177.9	178	-99.6	0	0	0	113.5	A854 L855 K856 H861 I872 V875 L891 F1192	A854-F858 WeakPolarHBondContact O-CB 3.33Å; A854-F858 PolarHBondContact O-N 3.27Å; L855-F858 PolarHBondContact O-N 2.78Å; K856-F858 PolarHBondContact O-N 2.91Å; F858-H861 CarbonylContact O-C 3.54Å; F858-H861 VanDerWaalsContact O-C 3.3Å; F858-H861 PolarHBondContact O-N 3.35Å; F858-I872 HydrophobicContact CD1-CD1 4.47Å; F858-I872 HydrophobicContact CD2-CD1 4.46Å; F858-I872 HydrophobicContact CD2-CG1 4.21Å; F858-I872 HydrophobicContact CE2-CG1 4.17Å; F858-I872 HydrophobicContact CG-CD1 4.29Å; F858-I872 HydrophobicContact CG-CG1 4.5Å; F858-I872 HydrophobicContact CZ-CB 4.48Å; F858-I872 HydrophobicContact CZ-CG1 4.42Å; F858-V875 HydrophobicContact CD2-CG2 3.91Å; F858-V875 HydrophobicContact CE2-CG2 3.73Å; F858-L891 HydrophobicContact CD1-CD1 4.1Å; F858-L891 HydrophobicContact CE1-CD1 3.61Å; F858-L891 HydrophobicContact CE1-CD2 4.39Å; F858-L891 HydrophobicContact CZ-CD1 4.47Å; F858-F1192 HydrophobicContact CB-CE1 4.2Å; F858-F1192 HydrophobicContact CB-CZ 4.27Å
859	L	85.9	Confident	75	Confident	3 Å²	3	42.7 Å²	42.7	2%	0.016	23%	0.225	C	C	.	.	H	α-helix	trans	-71.7	-34.1	178.7	-75.4	174.5	0	0	0	112.9	W842 L855 K856 A857 H861 L870 L891 L902 R912 V916 Y920	W842-L859 HydrophobicContact CH2-CD1 3.81Å; W842-L859 HydrophobicContact CZ2-CD1 4.47Å; L855-L859 HydrophobicContact CD1-CD1 4.42Å; L855-L859 HydrophobicContact CD1-CG 4.44Å; L855-L859 HydrophobicContact CG-CD1 4.28Å; L855-L859 WeakPolarHBondContact O-CG 3.47Å; L855-L859 PolarHBondContact O-N 3.3Å; K856-L859 PolarHBondContact O-N 3.08Å; A857-L859 PolarHBondContact O-N 2.81Å; L859-H861 VanDerWaalsContact C-N 3.34Å; L859-L870 HydrophobicContact CD2-CD2 4.49Å; L859-L891 HydrophobicContact CD2-CD2 3.71Å; L859-L891 HydrophobicContact CG-CD2 4.36Å; L859-L902 HydrophobicContact CD2-CD1 4.05Å; L859-R912 VanDerWaalsContact O-CD 3.27Å; L859-R912 WeakPolarHBondContact O-CD 3.28Å; L859-V916 HydrophobicContact CB-CG1 4.49Å; L859-V916 HydrophobicContact CB-CG2 3.8Å; L859-Y920 HydrophobicContact CD1-CE2 4.3Å
860	L	82.8	Confident	74.8	Confident	8 Å²	8	41.5 Å²	41.5	4%	0.042	22%	0.216	C	C	.	.	H	α-helix	trans	-74.9	-30.2	173.8	-66.9	169.7	0	0	0	111.3	K856 A857 C913 V916 L1155	K856-L860 HydrophobicContact CG-CD1 3.81Å; K856-L860 WeakPolarHBondContact O-CB 3.34Å; K856-L860 VanDerWaalsContact O-CG 3.27Å; K856-L860 WeakPolarHBondContact O-CG 3.47Å; K856-L860 PolarHBondContact O-N 2.75Å; A857-L860 PolarHBondContact O-N 3.06Å; L860-C913 HydrophobicContact CD2-CB 4.38Å; L860-V916 HydrophobicContact CD2-CB 3.86Å; L860-V916 HydrophobicContact CD2-CG1 4.05Å; L860-V916 HydrophobicContact CD2-CG2 3.97Å; L860-V916 HydrophobicContact CG-CB 4.44Å; L860-V916 HydrophobicContact CG-CG1 4.13Å; L860-V916 HydrophobicContact CG-CG2 4.43Å; L860-L1155 HydrophobicContact CB-CD1 4.27Å; L860-L1155 HydrophobicContact CD1-CD1 3.87Å; L860-L1155 HydrophobicContact CD2-CD1 4.28Å; L860-L1155 HydrophobicContact CG-CD1 4.36Å
861	H	72.9	Confident	74.6	Confident	14 Å²	14	39.3 Å²	39.3	7%	0.065	21%	0.212	C	C	.	.			trans	-136.1	105.8	-166.2	-61.1	-66.7	0	0	0	113.2	A857 F858 L859 W864 L1155 Y1183	A857-H861 WeakPolarHBondContact O-CA 3.4Å; A857-H861 WeakPolarHBondContact O-CB 3.35Å; A857-H861 PolarHBondContact O-CD2 3.08Å; A857-H861 PolarHBondContact O-N 2.75Å; F858-H861 CarbonylContact O-C 3.54Å; F858-H861 VanDerWaalsContact O-C 3.3Å; F858-H861 PolarHBondContact O-N 3.35Å; L859-H861 VanDerWaalsContact C-N 3.34Å; H861-W864 HydrophobicContact CB-CH2 3.26Å; H861-W864 HydrophobicContact CB-CZ2 3.43Å; H861-W864 VanDerWaalsContact CB-CZ2 3.43Å; H861-W864 HydrophobicContact CB-CZ3 4.07Å; H861-W864 AromaticContact CG-CH2 3.32Å; H861-W864 AromaticContact CG-CZ2 3.96Å; H861-W864 AromaticContact ND1-CH2 3.11Å; H861-W864 WeakPolarHBondContact ND1-CH2 3.4Å; H861-W864 AromaticContact ND1-CZ3 3.46Å; H861-W864 WeakPolarHBondContact ND1-CZ3 3.2Å; H861-L1155 WeakPolarHBondContact CE1-CD2 3.49Å; H861-Y1183 PolarHBondContact CD2-OH 3.03Å; H861-Y1183 AromaticContact CE1-CE1 3.9Å; H861-Y1183 AromaticContact NE2-CE1 3.64Å; H861-Y1183 AromaticContact NE2-CZ 3.49Å; H861-Y1183 PolarHBondContact NE2-OH 2.78Å
862	Q	62.7	Low	74.2	Confident	16 Å²	16	39.5 Å²	39.5	8%	0.075	21%	0.213	C	C	.	.			trans	-106.4	158.3	178.8	-72.6	-120.3	-36.2	0	0	111.2	W864 Y868 S869	Q862-W864 PolarHBondContact O-N 3.12Å; Q862-Y868 HydrophobicContact CB-CD1 3.43Å; Q862-Y868 VanDerWaalsContact CB-CD1 3.43Å; Q862-Y868 HydrophobicContact CB-CE1 3.68Å; Q862-Y868 HydrophobicContact CG-CD1 3.72Å; Q862-Y868 HydrophobicContact CG-CE1 4.2Å; Q862-Y868 VanDerWaalsContact OE1-CA 3.31Å; Q862-S869 PolarHBondContact NE2-O 3.18Å; Q862-S869 PolarHBondContact OE1-O 3.12Å; Q862-S869 VanDerWaalsContact OE1-O 3.06Å
863	P	51.6	Low	73.4	Confident	48 Å²	48	42.7 Å²	42.7	31%	0.312	24%	0.236	S	C	.	.			trans	-55.5	132	-167.4	18.7	-31.5	0	0	0	113.4	N865	P863-N865 VanDerWaalsContact C-N 3.3Å; P863-N865 PolarHBondContact O-N 3.43Å
864	W	57.4	Low	72.3	Confident	66 Å²	66	48.1 Å²	48.1	25%	0.25	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96	36.2	-143.6	-42.1	78.8	0	0	0	113.3	H861 Q862 L1198 F1199	H861-W864 HydrophobicContact CB-CH2 3.26Å; H861-W864 HydrophobicContact CB-CZ2 3.43Å; H861-W864 VanDerWaalsContact CB-CZ2 3.43Å; H861-W864 HydrophobicContact CB-CZ3 4.07Å; H861-W864 AromaticContact CG-CH2 3.32Å; H861-W864 AromaticContact CG-CZ2 3.96Å; H861-W864 AromaticContact ND1-CH2 3.11Å; H861-W864 WeakPolarHBondContact ND1-CH2 3.4Å; H861-W864 AromaticContact ND1-CZ3 3.46Å; H861-W864 WeakPolarHBondContact ND1-CZ3 3.2Å; Q862-W864 PolarHBondContact O-N 3.12Å; W864-L1198 HydrophobicContact CB-CD1 3.53Å; W864-L1198 HydrophobicContact CB-CD2 4.38Å; W864-L1198 HydrophobicContact CB-CG 4.37Å; W864-L1198 HydrophobicContact CD2-CD2 3.73Å; W864-L1198 HydrophobicContact CD2-CG 4.45Å; W864-L1198 HydrophobicContact CE3-CD2 3.28Å; W864-L1198 HydrophobicContact CE3-CG 4.38Å; W864-L1198 HydrophobicContact CG-CB 4.43Å; W864-L1198 HydrophobicContact CG-CD1 4.12Å; W864-L1198 HydrophobicContact CG-CD2 4.22Å; W864-L1198 HydrophobicContact CG-CG 4.47Å; W864-L1198 HydrophobicContact CH2-CD2 4.28Å; W864-L1198 HydrophobicContact CZ3-CD2 3.59Å; W864-F1199 HydrophobicContact CH2-CD2 4.16Å; W864-F1199 AromaticContact CH2-CE2 3.4Å; W864-F1199 HydrophobicContact CH2-CE2 3.4Å; W864-F1199 VanDerWaalsContact CH2-CE2 3.4Å; W864-F1199 HydrophobicContact CH2-CZ 4.21Å; W864-F1199 HydrophobicContact CZ2-CE2 4.4Å; W864-F1199 AromaticContact CZ3-CE2 3.68Å; W864-F1199 HydrophobicContact CZ3-CE2 3.68Å; W864-F1199 HydrophobicContact CZ3-CZ 4.08Å
865	N	46	Very low	71.4	Confident	180 Å²	180	48.9 Å²	48.9	96%	0.963	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-163.3	21.6	172.7	-99.7	-16.6	0	0	0	112.8	P863	P863-N865 VanDerWaalsContact C-N 3.3Å; P863-N865 PolarHBondContact O-N 3.43Å
866	G	56.2	Low	70.2	Confident	58 Å²	58	54 Å²	54	60%	0.598	29%	0.292	S	S	*	.	S	Bend	trans	-152.8	-172.1	-173.7	0	0	0	0	0	116.7
867	Q	60.6	Low	69.2	Low	185 Å²	185	54.3 Å²	54.3	86%	0.864	29%	0.293	S	S	*	.			trans	-65.1	138.6	174.8	-72.3	179.4	-12.7	0	0	110.9	S869	Q867-S869 PolarHBondContact O-N 3.29Å
868	Y	69.6	Low	67.9	Low	83 Å²	83	57 Å²	57	33%	0.325	31%	0.311	S	S	.	.			trans	-62.1	131.4	175.7	-70.1	-82.2	0	0	0	110.8	Q862 L903 R912	Q862-Y868 HydrophobicContact CB-CD1 3.43Å; Q862-Y868 VanDerWaalsContact CB-CD1 3.43Å; Q862-Y868 HydrophobicContact CB-CE1 3.68Å; Q862-Y868 HydrophobicContact CG-CD1 3.72Å; Q862-Y868 HydrophobicContact CG-CE1 4.2Å; Q862-Y868 VanDerWaalsContact OE1-CA 3.31Å; Y868-L903 VanDerWaalsContact O-CD2 3.29Å; Y868-L903 WeakPolarHBondContact O-CD2 3.34Å; Y868-R912 VanDerWaalsContact CE1-CZ 3.45Å; Y868-R912 PolarHBondContact OH-NH1 2.94Å; Y868-R912 PolarHBondContact OH-NH2 3.43Å
869	S	74.9	Confident	66.6	Low	36 Å²	36	61.9 Å²	61.9	25%	0.252	33%	0.333	S	S	.	.			trans	-134.8	128.9	177.7	65.5	0	0	0	0	110.9	Q862 Q867 D871	Q862-S869 PolarHBondContact NE2-O 3.18Å; Q862-S869 PolarHBondContact OE1-O 3.12Å; Q862-S869 VanDerWaalsContact OE1-O 3.06Å; Q867-S869 PolarHBondContact O-N 3.29Å; S869-D871 PolarHBondContact O-N 3.46Å
870	L	79.1	Confident	65.6	Low	27 Å²	27	66 Å²	66	14%	0.141	36%	0.355	C	S	.	.			trans	-84.3	24.8	174.6	-63.9	172.6	0	0	0	112.9	L859 Q888 K899 L902 L903	L859-L870 HydrophobicContact CD2-CD2 4.49Å; L870-Q888 PolarHBondContact O-NE2 3.09Å; L870-Q888 VanDerWaalsContact O-NE2 3.08Å; L870-Q888 PolarHBondContact O-OE1 3.41Å; L870-K899 HydrophobicContact CD1-CB 3.93Å; L870-K899 HydrophobicContact CD1-CG 3.85Å; L870-L902 HydrophobicContact CD2-CB 4.25Å; L870-L902 HydrophobicContact CD2-CD1 4.22Å; L870-L903 HydrophobicContact CD1-CD1 4.2Å; L870-L903 HydrophobicContact CD1-CD2 4.28Å; L870-L903 HydrophobicContact CD1-CG 4.01Å; L870-L903 HydrophobicContact CG-CD2 3.9Å; L870-L903 HydrophobicContact CG-CG 4.18Å
871	D	78.3	Confident	65.1	Low	67 Å²	67	71.3 Å²	71.3	36%	0.358	38%	0.38	S	S	.	.			trans	-105.5	114.6	178.9	-164.7	-24	0	0	0	109.3	S869 S873	S869-D871 PolarHBondContact O-N 3.46Å; D871-S873 VanDerWaalsContact C-N 3.29Å; D871-S873 VanDerWaalsContact OD1-CB 3.25Å; D871-S873 WeakPolarHBondContact OD1-CB 3.18Å; D871-S873 PolarHBondContact OD1-N 3.29Å; D871-S873 PolarHBondContact OD1-OG 3.38Å; D871-S873 PolarHBondContact OD2-OG 2.61Å
872	I	76.9	Confident	65	Low	7 Å²	7	77.3 Å²	77.3	4%	0.036	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-81.6	-10.5	-176.3	-149.6	161.6	0	0	0	112.7	F858 H874 V875 K884 L887 Q888 L891	F858-I872 HydrophobicContact CD1-CD1 4.47Å; F858-I872 HydrophobicContact CD2-CD1 4.46Å; F858-I872 HydrophobicContact CD2-CG1 4.21Å; F858-I872 HydrophobicContact CE2-CG1 4.17Å; F858-I872 HydrophobicContact CG-CD1 4.29Å; F858-I872 HydrophobicContact CG-CG1 4.5Å; F858-I872 HydrophobicContact CZ-CB 4.48Å; F858-I872 HydrophobicContact CZ-CG1 4.42Å; I872-H874 PolarHBondContact O-N 2.79Å; I872-H874 VanDerWaalsContact O-N 3.17Å; I872-V875 HydrophobicContact CG1-CB 4.41Å; I872-V875 HydrophobicContact CG1-CG2 4.29Å; I872-V875 WeakPolarHBondContact O-CB 2.93Å; I872-V875 PolarHBondContact O-N 3.49Å; I872-K884 HydrophobicContact CG2-CB 4.29Å; I872-L887 HydrophobicContact CD1-CB 3.65Å; I872-L887 HydrophobicContact CD1-CD1 3.45Å; I872-L887 VanDerWaalsContact CD1-CD1 3.45Å; I872-L887 HydrophobicContact CD1-CG 4.18Å; I872-Q888 HydrophobicContact CG2-CB 4.19Å; I872-L891 HydrophobicContact CB-CD1 4.47Å
873	S	70.1	Confident	65.7	Low	68 Å²	68	78.2 Å²	78.2	48%	0.476	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-59.4	-28.5	-178.9	62	0	0	0	0	113.2	D871 V875	D871-S873 VanDerWaalsContact C-N 3.29Å; D871-S873 VanDerWaalsContact OD1-CB 3.25Å; D871-S873 WeakPolarHBondContact OD1-CB 3.18Å; D871-S873 PolarHBondContact OD1-N 3.29Å; D871-S873 PolarHBondContact OD1-OG 3.38Å; D871-S873 PolarHBondContact OD2-OG 2.61Å; S873-V875 VanDerWaalsContact C-N 3.27Å; S873-V875 PolarHBondContact O-N 3.14Å
874	H	64.3	Low	67	Low	129 Å²	129	77.1 Å²	77.1	60%	0.597	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-77.6	-6.6	178.2	-63.1	-62	0	0	0	114.3	I872	I872-H874 PolarHBondContact O-N 2.79Å; I872-H874 VanDerWaalsContact O-N 3.17Å
875	V	66	Low	68.1	Low	17 Å²	17	78.4 Å²	78.4	10%	0.103	42%	0.415	C	S	.	.	S	Bend	trans	-93.8	122.2	178.8	-175.8	0	0	0	0	109.8	F858 I872 S873 Y877 F1192	F858-V875 HydrophobicContact CD2-CG2 3.91Å; F858-V875 HydrophobicContact CE2-CG2 3.73Å; I872-V875 HydrophobicContact CG1-CB 4.41Å; I872-V875 HydrophobicContact CG1-CG2 4.29Å; I872-V875 WeakPolarHBondContact O-CB 2.93Å; I872-V875 PolarHBondContact O-N 3.49Å; S873-V875 VanDerWaalsContact C-N 3.27Å; S873-V875 PolarHBondContact O-N 3.14Å; V875-Y877 VanDerWaalsContact C-N 3.3Å; V875-Y877 PolarHBondContact O-N 3.29Å; V875-F1192 HydrophobicContact CG1-CD1 3.79Å; V875-F1192 HydrophobicContact CG1-CE1 3.73Å
876	D	62.1	Low	69.7	Low	106 Å²	106	73.8 Å²	73.8	57%	0.567	39%	0.39	S	S	*	.			trans	-67.4	85.1	172.8	-74.6	-34.8	0	0	0	110.7	P878	D876-P878 WeakPolarHBondContact O-CD 3.37Å
877	Y	66.8	Low	71	Confident	12 Å²	12	71.1 Å²	71.1	5%	0.047	36%	0.362	C	S	.	.			trans	-104.1	97	171.9	-163.5	-99.6	0	0	0	109.8	A854 V875 E879 I883 K884 L1190	A854-Y877 HydrophobicContact CB-CE2 4.26Å; V875-Y877 VanDerWaalsContact C-N 3.3Å; V875-Y877 PolarHBondContact O-N 3.29Å; Y877-E879 VanDerWaalsContact C-N 3.34Å; Y877-E879 HydrophobicContact CE1-CB 4.18Å; Y877-E879 PolarHBondContact O-N 3.08Å; Y877-I883 HydrophobicContact CE1-CB 4.39Å; Y877-I883 HydrophobicContact CE1-CD1 4.42Å; Y877-I883 HydrophobicContact CE1-CG2 4.06Å; Y877-K884 VanDerWaalsContact O-CE 3.26Å; Y877-K884 WeakPolarHBondContact O-CE 3.41Å; Y877-L1190 VanDerWaalsContact CE2-O 3.3Å; Y877-L1190 WeakPolarHBondContact CE2-O 3.36Å
878	P	56.5	Low	72.3	Confident	65 Å²	65	64.1 Å²	64.1	42%	0.422	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-12.3	-168.2	28.1	-34.4	0	0	0	115	D876	D876-P878 WeakPolarHBondContact O-CD 3.37Å
879	E	58.6	Low	73	Confident	104 Å²	104	65.3 Å²	65.3	49%	0.486	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-13.4	-165.3	-70.7	-166.6	165.6	0	0	116.2	R850 Y877	R850-E879 IonicContact NH1-OE1 3.47Å; R850-E879 IonicContact NH1-OE2 3.81Å; R850-E879 PolarHBondContact NH1-OE2 2.96Å; R850-E879 VanDerWaalsContact NH1-OE2 3.08Å; Y877-E879 VanDerWaalsContact C-N 3.34Å; Y877-E879 HydrophobicContact CE1-CB 4.18Å; Y877-E879 PolarHBondContact O-N 3.08Å
880	N	63.9	Low	73.5	Confident	89 Å²	89	64.5 Å²	64.5	48%	0.476	33%	0.33	S	S	.	.			trans	176.5	125.3	168.3	-95.7	-35.8	0	0	0	111.9	E882 I883	N880-E882 PolarHBondContact O-N 3.21Å; N880-I883 HydrophobicContact CB-CB 4.32Å; N880-I883 HydrophobicContact CB-CD1 3.93Å; N880-I883 HydrophobicContact CB-CG1 3.88Å; N880-I883 PolarHBondContact O-N 2.78Å
881	E	72	Confident	73.9	Confident	120 Å²	120	63.3 Å²	63.3	56%	0.561	32%	0.324	S	S	*	.	H	α-helix	trans	-61.3	-30.1	172.5	-77.5	-63.6	138.6	0	0	112.7	I883 K884 N885	E881-I883 VanDerWaalsContact C-N 3.32Å; E881-I883 PolarHBondContact O-N 2.66Å; E881-K884 WeakPolarHBondContact O-CB 3.32Å; E881-K884 PolarHBondContact O-N 2.8Å; E881-K884 IonicContact OE1-NZ 3.9Å; E881-K884 PolarHBondContact OE1-NZ 3.48Å; E881-N885 PolarHBondContact O-N 3.22Å; E881-N885 VanDerWaalsContact O-N 3.15Å; E881-N885 PolarHBondContact O-ND2 3.15Å
882	E	72.4	Confident	74.3	Confident	141 Å²	141	64.5 Å²	64.5	66%	0.659	33%	0.33	S	S	*	.	H	α-helix	trans	-60.3	-41.3	175.1	-65.3	-179.3	174	0	0	112	N880 K884 N885 L886	N880-E882 PolarHBondContact O-N 3.21Å; E882-K884 PolarHBondContact O-N 3.37Å; E882-N885 WeakPolarHBondContact O-CB 3.36Å; E882-N885 PolarHBondContact O-N 2.75Å; E882-L886 WeakPolarHBondContact O-CD1 3.42Å; E882-L886 PolarHBondContact O-N 3.18Å; E882-L886 VanDerWaalsContact O-N 3.07Å
883	I	76.1	Confident	74.8	Confident	35 Å²	35	65.6 Å²	65.6	18%	0.179	34%	0.338	C	S	.	.	H	α-helix	trans	-65.6	-40.9	178.8	-64.3	177.2	0	0	0	110.3	A851 Y877 N880 E881 N885 L886 L887	A851-I883 HydrophobicContact CB-CG2 3.61Å; Y877-I883 HydrophobicContact CE1-CB 4.39Å; Y877-I883 HydrophobicContact CE1-CD1 4.42Å; Y877-I883 HydrophobicContact CE1-CG2 4.06Å; N880-I883 HydrophobicContact CB-CB 4.32Å; N880-I883 HydrophobicContact CB-CD1 3.93Å; N880-I883 HydrophobicContact CB-CG1 3.88Å; N880-I883 PolarHBondContact O-N 2.78Å; E881-I883 VanDerWaalsContact C-N 3.32Å; E881-I883 PolarHBondContact O-N 2.66Å; I883-N885 VanDerWaalsContact C-N 3.28Å; I883-N885 PolarHBondContact O-N 3.03Å; I883-L886 PolarHBondContact O-N 3.33Å; I883-L887 HydrophobicContact CG2-CD1 4.27Å; I883-L887 HydrophobicContact CG2-CG 4.23Å; I883-L887 VanDerWaalsContact O-CG 3.29Å; I883-L887 WeakPolarHBondContact O-CG 3.22Å; I883-L887 PolarHBondContact O-N 3.19Å
884	K	78.6	Confident	75.5	Confident	24 Å²	24	62.7 Å²	62.7	10%	0.104	32%	0.318	C	S	.	.	H	α-helix	trans	-58.3	-42.3	175.6	-69	-176.6	-176.7	168.4	0	111.7	I872 Y877 E881 E882 L887 Q888	I872-K884 HydrophobicContact CG2-CB 4.29Å; Y877-K884 VanDerWaalsContact O-CE 3.26Å; Y877-K884 WeakPolarHBondContact O-CE 3.41Å; E881-K884 WeakPolarHBondContact O-CB 3.32Å; E881-K884 PolarHBondContact O-N 2.8Å; E881-K884 IonicContact OE1-NZ 3.9Å; E881-K884 PolarHBondContact OE1-NZ 3.48Å; E882-K884 PolarHBondContact O-N 3.37Å; K884-L887 PolarHBondContact O-N 2.96Å; K884-Q888 WeakPolarHBondContact O-CB 3.15Å; K884-Q888 PolarHBondContact O-N 3.01Å
885	N	81.3	Confident	76.4	Confident	94 Å²	94	59.2 Å²	59.2	50%	0.503	31%	0.308	S	S	.	.	H	α-helix	trans	-62	-46.7	176.5	-67.8	-28.5	0	0	0	111.5	E881 E882 I883 L887 Q888 E889	E881-N885 PolarHBondContact O-N 3.22Å; E881-N885 VanDerWaalsContact O-N 3.15Å; E881-N885 PolarHBondContact O-ND2 3.15Å; E882-N885 WeakPolarHBondContact O-CB 3.36Å; E882-N885 PolarHBondContact O-N 2.75Å; I883-N885 VanDerWaalsContact C-N 3.28Å; I883-N885 PolarHBondContact O-N 3.03Å; N885-L887 VanDerWaalsContact C-N 3.32Å; N885-L887 PolarHBondContact O-N 2.97Å; N885-Q888 PolarHBondContact O-N 3.17Å; N885-E889 WeakPolarHBondContact O-CG 3.49Å; N885-E889 PolarHBondContact O-N 2.57Å
886	L	79.1	Confident	77.2	Confident	83 Å²	83	64 Å²	64	44%	0.435	33%	0.333	S	S	.	.	H	α-helix	trans	-59.4	-41.6	175.1	-87.6	90	0	0	0	112.3	L847 E882 I883 E889 Q890	L847-L886 HydrophobicContact CD2-CB 4.05Å; L847-L886 HydrophobicContact CD2-CD2 4.02Å; E882-L886 WeakPolarHBondContact O-CD1 3.42Å; E882-L886 PolarHBondContact O-N 3.18Å; E882-L886 VanDerWaalsContact O-N 3.07Å; I883-L886 PolarHBondContact O-N 3.33Å; L886-E889 PolarHBondContact O-N 3.39Å; L886-Q890 WeakPolarHBondContact O-CG 3.34Å; L886-Q890 PolarHBondContact O-N 3.13Å
887	L	84.3	Confident	78.1	Confident	2 Å²	2	64 Å²	64	1%	0.01	33%	0.33	C	S	.	.	H	α-helix	trans	-63.7	-42	177	-67.4	-172.6	0	0	0	111.6	L847 A851 L855 I872 I883 K884 N885 E889 Q890 L891	L847-L887 HydrophobicContact CD1-CD2 3.53Å; L847-L887 HydrophobicContact CD2-CD2 4.49Å; A851-L887 HydrophobicContact CB-CD2 4.19Å; L855-L887 HydrophobicContact CB-CD2 3.83Å; L855-L887 HydrophobicContact CD1-CD2 4.41Å; L855-L887 HydrophobicContact CD2-CD2 4.38Å; L855-L887 HydrophobicContact CG-CD2 4.43Å; I872-L887 HydrophobicContact CD1-CB 3.65Å; I872-L887 HydrophobicContact CD1-CD1 3.45Å; I872-L887 VanDerWaalsContact CD1-CD1 3.45Å; I872-L887 HydrophobicContact CD1-CG 4.18Å; I883-L887 HydrophobicContact CG2-CD1 4.27Å; I883-L887 HydrophobicContact CG2-CG 4.23Å; I883-L887 VanDerWaalsContact O-CG 3.29Å; I883-L887 WeakPolarHBondContact O-CG 3.22Å; I883-L887 PolarHBondContact O-N 3.19Å; K884-L887 PolarHBondContact O-N 2.96Å; N885-L887 VanDerWaalsContact C-N 3.32Å; N885-L887 PolarHBondContact O-N 2.97Å; L887-E889 VanDerWaalsContact C-N 3.35Å; L887-Q890 PolarHBondContact O-N 3.32Å; L887-L891 WeakPolarHBondContact O-CG 3.42Å; L887-L891 PolarHBondContact O-N 3.21Å
888	Q	86.9	Confident	78.8	Confident	37 Å²	37	64.5 Å²	64.5	17%	0.173	33%	0.332	C	S	.	.	H	α-helix	trans	-66.5	-37	176.7	-167	60.3	50.1	0	0	111.9	L870 I872 K884 N885 L891 N892	L870-Q888 PolarHBondContact O-NE2 3.09Å; L870-Q888 VanDerWaalsContact O-NE2 3.08Å; L870-Q888 PolarHBondContact O-OE1 3.41Å; I872-Q888 HydrophobicContact CG2-CB 4.19Å; K884-Q888 WeakPolarHBondContact O-CB 3.15Å; K884-Q888 PolarHBondContact O-N 3.01Å; N885-Q888 PolarHBondContact O-N 3.17Å; Q888-L891 PolarHBondContact O-N 3.41Å; Q888-N892 PolarHBondContact NE2-OD1 3.04Å; Q888-N892 WeakPolarHBondContact O-CB 3.49Å; Q888-N892 PolarHBondContact O-N 2.92Å; Q888-N892 PolarHBondContact O-ND2 3.37Å; Q888-N892 PolarHBondContact O-OD1 2.95Å
889	E	84	Confident	80.2	Confident	109 Å²	109	63.4 Å²	63.4	51%	0.509	32%	0.321	S	S	.	.	H	α-helix	trans	-60.8	-42.3	173.2	-75.4	178	-179.2	0	0	112.1	N885 L886 L887 N892 S893	N885-E889 WeakPolarHBondContact O-CG 3.49Å; N885-E889 PolarHBondContact O-N 2.57Å; L886-E889 PolarHBondContact O-N 3.39Å; L887-E889 VanDerWaalsContact C-N 3.35Å; E889-N892 PolarHBondContact O-N 3.14Å; E889-S893 PolarHBondContact O-N 3.06Å
890	Q	86.9	Confident	81.3	Confident	19 Å²	19	66 Å²	66	9%	0.089	33%	0.331	C	S	.	.	H	α-helix	trans	-62.5	-44.4	172.8	-67.7	-64.9	-48.9	0	0	111.5	V841 W842 L847 L855 L886 L887 N892 S893	V841-Q890 VanDerWaalsContact O-CD 3.29Å; V841-Q890 PolarHBondContact O-NE2 3.43Å; V841-Q890 PolarHBondContact O-OE1 2.98Å; V841-Q890 VanDerWaalsContact O-OE1 3.05Å; W842-Q890 HydrophobicContact CE3-CB 4.25Å; W842-Q890 HydrophobicContact CZ3-CB 4.07Å; W842-Q890 WeakPolarHBondContact CZ3-O 3.48Å; L847-Q890 HydrophobicContact CD1-CG 4.12Å; L847-Q890 HydrophobicContact CD2-CG 4.1Å; L847-Q890 HydrophobicContact CG-CG 4.32Å; L855-Q890 HydrophobicContact CD2-CB 4.03Å; L855-Q890 HydrophobicContact CD2-CG 4.48Å; L886-Q890 WeakPolarHBondContact O-CG 3.34Å; L886-Q890 PolarHBondContact O-N 3.13Å; L887-Q890 PolarHBondContact O-N 3.32Å; Q890-N892 PolarHBondContact O-N 2.76Å; Q890-S893 PolarHBondContact O-N 3.14Å; Q890-S893 PolarHBondContact O-OG 2.88Å
891	L	87	Confident	82	Confident	1 Å²	1	63 Å²	63	1%	0.005	31%	0.314	C	S	.	.	H	α-helix	trans	-63.1	-33.9	176.2	-67.9	170.8	0	0	0	112	L855 F858 L859 I872 L887 Q888 L894 K899	L855-L891 HydrophobicContact CD1-CD1 4.45Å; L855-L891 HydrophobicContact CD1-CD2 3.87Å; L855-L891 HydrophobicContact CD1-CG 4Å; F858-L891 HydrophobicContact CD1-CD1 4.1Å; F858-L891 HydrophobicContact CE1-CD1 3.61Å; F858-L891 HydrophobicContact CE1-CD2 4.39Å; F858-L891 HydrophobicContact CZ-CD1 4.47Å; L859-L891 HydrophobicContact CD2-CD2 3.71Å; L859-L891 HydrophobicContact CG-CD2 4.36Å; I872-L891 HydrophobicContact CB-CD1 4.47Å; L887-L891 WeakPolarHBondContact O-CG 3.42Å; L887-L891 PolarHBondContact O-N 3.21Å; Q888-L891 PolarHBondContact O-N 3.41Å; L891-L894 HydrophobicContact CD2-CD1 4.35Å; L891-K899 WeakPolarHBondContact O-CE 3.39Å
892	N	87.4	Confident	82.4	Confident	92 Å²	92	57.5 Å²	57.5	49%	0.492	29%	0.289	S	S	.	.	H	α-helix	trans	-71.5	-28.2	177.7	-70.1	-18.5	0	0	0	112.9	Q888 E889 Q890 L894 K899	Q888-N892 PolarHBondContact NE2-OD1 3.04Å; Q888-N892 WeakPolarHBondContact O-CB 3.49Å; Q888-N892 PolarHBondContact O-N 2.92Å; Q888-N892 PolarHBondContact O-ND2 3.37Å; Q888-N892 PolarHBondContact O-OD1 2.95Å; E889-N892 PolarHBondContact O-N 3.14Å; Q890-N892 PolarHBondContact O-N 2.76Å; N892-L894 VanDerWaalsContact C-N 3.31Å; N892-L894 PolarHBondContact O-N 2.89Å; N892-K899 PolarHBondContact O-NZ 2.87Å
893	S	85.9	Confident	82.9	Confident	30 Å²	30	54.4 Å²	54.4	21%	0.21	28%	0.277	C	S	.	.	H	α-helix	trans	-75.4	-15.9	178	68.6	0	0	0	0	114	P840 W842 E889 Q890	P840-S893 WeakPolarHBondContact O-CB 3.1Å; W842-S893 WeakPolarHBondContact CA-OG 3.29Å; W842-S893 PolarHBondContact N-OG 3.15Å; E889-S893 PolarHBondContact O-N 3.06Å; Q890-S893 PolarHBondContact O-N 3.14Å; Q890-S893 PolarHBondContact O-OG 2.88Å
894	L	85.8	Confident	82.9	Confident	8 Å²	8	54.9 Å²	54.9	4%	0.042	28%	0.28	C	S	.	.	S	Bend	trans	-60.3	144.7	175.1	-69.8	173	0	0	0	112.4	W842 L891 N892 I898 K899 L902 L919	W842-L894 HydrophobicContact CD2-CD2 3.51Å; W842-L894 HydrophobicContact CD2-CG 4.24Å; W842-L894 HydrophobicContact CE3-CD1 4.39Å; W842-L894 HydrophobicContact CE3-CD2 3.44Å; W842-L894 VanDerWaalsContact CE3-CD2 3.44Å; W842-L894 HydrophobicContact CE3-CG 3.64Å; W842-L894 HydrophobicContact CG-CD2 4.13Å; W842-L894 HydrophobicContact CH2-CD1 4.39Å; W842-L894 HydrophobicContact CH2-CD2 4.1Å; W842-L894 HydrophobicContact CH2-CG 4.43Å; W842-L894 HydrophobicContact CZ2-CD2 4.15Å; W842-L894 HydrophobicContact CZ3-CD1 3.98Å; W842-L894 HydrophobicContact CZ3-CD2 3.74Å; W842-L894 HydrophobicContact CZ3-CG 3.75Å; L891-L894 HydrophobicContact CD2-CD1 4.35Å; N892-L894 VanDerWaalsContact C-N 3.31Å; N892-L894 PolarHBondContact O-N 2.89Å; L894-I898 HydrophobicContact CD2-CG2 4.34Å; L894-K899 HydrophobicContact CB-CG 4.1Å; L894-K899 WeakPolarHBondContact O-CE 3.23Å; L894-K899 PolarHBondContact O-NZ 3.28Å; L894-L902 HydrophobicContact CD1-CD1 4.2Å; L894-L919 HydrophobicContact CD2-CD1 4.23Å; L894-L919 HydrophobicContact CD2-CD2 3.86Å
895	S	83.1	Confident	82.6	Confident	56 Å²	56	58.9 Å²	58.9	39%	0.392	31%	0.308	S	S	.	.			trans	-63.8	151	177.5	81.3	0	0	0	0	111.9	E897 I898 K899	S895-E897 PolarHBondContact O-N 2.64Å; S895-I898 PolarHBondContact O-N 3.21Å; S895-I898 WeakPolarHBondContact OG-CD1 3.48Å; S895-I898 VanDerWaalsContact OG-CG1 3.29Å; S895-I898 WeakPolarHBondContact OG-CG1 3.46Å; S895-I898 PolarHBondContact OG-N 2.86Å; S895-K899 WeakPolarHBondContact O-CG 3.17Å; S895-K899 PolarHBondContact O-N 2.86Å
896	N	83.2	Confident	82.2	Confident	118 Å²	118	61 Å²	61	63%	0.631	32%	0.315	S	S	*	.	H	α-helix	trans	-62.4	-27.3	-179.9	-69.8	-30	0	0	0	113	K900	N896-K900 VanDerWaalsContact O-CG 3.23Å; N896-K900 WeakPolarHBondContact O-CG 3.41Å; N896-K900 PolarHBondContact O-N 3.42Å; N896-K900 VanDerWaalsContact O-N 3.15Å
897	E	79.6	Confident	82	Confident	106 Å²	106	57.6 Å²	57.6	50%	0.495	30%	0.297	S	S	.	.	H	α-helix	trans	-69.8	-44	176.3	-65.1	-177.6	176.3	0	0	111.1	P423 S895 K900 L901	P423-E897 HydrophobicContact CB-CB 4.05Å; P423-E897 WeakPolarHBondContact CB-OE2 3.03Å; P423-E897 HydrophobicContact CG-CB 4.44Å; S895-E897 PolarHBondContact O-N 2.64Å; E897-K900 PolarHBondContact O-N 2.86Å; E897-L901 PolarHBondContact O-N 2.9Å; E897-L901 VanDerWaalsContact O-N 3.13Å
898	I	82.6	Confident	81.8	Confident	21 Å²	21	58.5 Å²	58.5	11%	0.108	30%	0.302	C	S	.	.	H	α-helix	trans	-67.4	-42.1	178.5	-65.1	168.7	0	0	0	110.5	L425 L894 S895 K900 L901 L902 L915 L919	L425-I898 HydrophobicContact CD2-CD1 4.34Å; L425-I898 HydrophobicContact CD2-CG1 4.01Å; L894-I898 HydrophobicContact CD2-CG2 4.34Å; S895-I898 PolarHBondContact O-N 3.21Å; S895-I898 WeakPolarHBondContact OG-CD1 3.48Å; S895-I898 VanDerWaalsContact OG-CG1 3.29Å; S895-I898 WeakPolarHBondContact OG-CG1 3.46Å; S895-I898 PolarHBondContact OG-N 2.86Å; I898-K900 VanDerWaalsContact C-N 3.32Å; I898-K900 PolarHBondContact O-N 3.02Å; I898-L901 PolarHBondContact O-N 3.37Å; I898-L902 HydrophobicContact CG2-CD1 4.01Å; I898-L902 HydrophobicContact CG2-CG 4.4Å; I898-L902 WeakPolarHBondContact O-CG 3.27Å; I898-L902 PolarHBondContact O-N 3.26Å; I898-L915 HydrophobicContact CG2-CD2 4.38Å; I898-L919 HydrophobicContact CD1-CD2 3.99Å; I898-L919 HydrophobicContact CG2-CD1 4.11Å; I898-L919 HydrophobicContact CG2-CD2 4.45Å
899	K	84.7	Confident	81.6	Confident	43 Å²	43	58.2 Å²	58.2	19%	0.187	30%	0.301	C	S	.	.	H	α-helix	trans	-58.4	-42.6	174.9	-70.4	175.6	177.7	159.5	0	112.1	L870 L891 N892 L894 S895 L902 L903	L870-K899 HydrophobicContact CD1-CB 3.93Å; L870-K899 HydrophobicContact CD1-CG 3.85Å; L891-K899 WeakPolarHBondContact O-CE 3.39Å; N892-K899 PolarHBondContact O-NZ 2.87Å; L894-K899 HydrophobicContact CB-CG 4.1Å; L894-K899 WeakPolarHBondContact O-CE 3.23Å; L894-K899 PolarHBondContact O-NZ 3.28Å; S895-K899 WeakPolarHBondContact O-CG 3.17Å; S895-K899 PolarHBondContact O-N 2.86Å; K899-L902 PolarHBondContact O-N 2.87Å; K899-L903 WeakPolarHBondContact O-CB 3.3Å; K899-L903 VanDerWaalsContact O-CG 3.27Å; K899-L903 WeakPolarHBondContact O-CG 3.32Å; K899-L903 PolarHBondContact O-N 2.9Å; K899-L903 VanDerWaalsContact O-N 3.12Å
900	K	82.6	Confident	81.6	Confident	157 Å²	157	53.1 Å²	53.1	68%	0.683	28%	0.278	S	S	*	.	H	α-helix	trans	-62.4	-41.2	176.4	-76.4	171.9	-176.4	-179.4	0	112.3	N896 E897 I898 D904	N896-K900 VanDerWaalsContact O-CG 3.23Å; N896-K900 WeakPolarHBondContact O-CG 3.41Å; N896-K900 PolarHBondContact O-N 3.42Å; N896-K900 VanDerWaalsContact O-N 3.15Å; E897-K900 PolarHBondContact O-N 2.86Å; I898-K900 VanDerWaalsContact C-N 3.32Å; I898-K900 PolarHBondContact O-N 3.02Å; K900-D904 PolarHBondContact O-N 3.21Å
901	L	79.6	Confident	81.3	Confident	26 Å²	26	52.7 Å²	52.7	14%	0.136	28%	0.276	C	S	.	.	H	α-helix	trans	-65.5	-43.6	176.4	-71.9	176.9	0	0	0	112.3	P423 L425 E897 I898 L903 D904 F907 L915	P423-L901 HydrophobicContact CG-CD1 3.47Å; P423-L901 VanDerWaalsContact CG-CD1 3.47Å; P423-L901 HydrophobicContact CG-CG 4.21Å; L425-L901 HydrophobicContact CD1-CD1 4.08Å; E897-L901 PolarHBondContact O-N 2.9Å; E897-L901 VanDerWaalsContact O-N 3.13Å; I898-L901 PolarHBondContact O-N 3.37Å; L901-L903 VanDerWaalsContact C-N 3.28Å; L901-L903 PolarHBondContact O-N 3.46Å; L901-D904 WeakPolarHBondContact O-CB 3.29Å; L901-D904 PolarHBondContact O-N 3.31Å; L901-F907 HydrophobicContact CB-CE2 4.44Å; L901-F907 HydrophobicContact CD2-CE2 4.45Å; L901-F907 WeakPolarHBondContact O-CG 3.27Å; L901-L915 HydrophobicContact CB-CD2 4.44Å
902	L	79.8	Confident	81.3	Confident	6 Å²	6	53.1 Å²	53.1	3%	0.031	28%	0.277	C	S	.	.	H	α-helix	trans	-65.9	-31.8	-179.2	-71.6	172.7	0	0	0	112.9	L859 L870 L894 I898 K899 L915	L859-L902 HydrophobicContact CD2-CD1 4.05Å; L870-L902 HydrophobicContact CD2-CB 4.25Å; L870-L902 HydrophobicContact CD2-CD1 4.22Å; L894-L902 HydrophobicContact CD1-CD1 4.2Å; I898-L902 HydrophobicContact CG2-CD1 4.01Å; I898-L902 HydrophobicContact CG2-CG 4.4Å; I898-L902 WeakPolarHBondContact O-CG 3.27Å; I898-L902 PolarHBondContact O-N 3.26Å; K899-L902 PolarHBondContact O-N 2.87Å; L902-L915 HydrophobicContact CD2-CD2 3.8Å; L902-L915 HydrophobicContact CG-CD2 4.11Å
903	L	81.5	Confident	81.3	Confident	76 Å²	76	48.8 Å²	48.8	40%	0.398	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-9.6	178	-68	171.9	0	0	0	113.7	Y868 L870 K899 L901 P905	Y868-L903 VanDerWaalsContact O-CD2 3.29Å; Y868-L903 WeakPolarHBondContact O-CD2 3.34Å; L870-L903 HydrophobicContact CD1-CD1 4.2Å; L870-L903 HydrophobicContact CD1-CD2 4.28Å; L870-L903 HydrophobicContact CD1-CG 4.01Å; L870-L903 HydrophobicContact CG-CD2 3.9Å; L870-L903 HydrophobicContact CG-CG 4.18Å; K899-L903 WeakPolarHBondContact O-CB 3.3Å; K899-L903 VanDerWaalsContact O-CG 3.27Å; K899-L903 WeakPolarHBondContact O-CG 3.32Å; K899-L903 PolarHBondContact O-N 2.9Å; K899-L903 VanDerWaalsContact O-N 3.12Å; L901-L903 VanDerWaalsContact C-N 3.28Å; L901-L903 PolarHBondContact O-N 3.46Å; L903-P905 WeakPolarHBondContact O-CD 3.38Å
904	D	76.6	Confident	81.3	Confident	45 Å²	45	47.5 Å²	47.5	24%	0.241	25%	0.245	C	C	.	.			trans	-71	120.4	-179.5	-175.1	-9.1	0	0	0	110.5	K900 L901 E906 F907	K900-D904 PolarHBondContact O-N 3.21Å; L901-D904 WeakPolarHBondContact O-CB 3.29Å; L901-D904 PolarHBondContact O-N 3.31Å; D904-E906 PolarHBondContact O-N 3.07Å; D904-E906 PolarHBondContact OD1-N 3.14Å; D904-F907 HydrophobicContact CB-CB 4.22Å; D904-F907 WeakPolarHBondContact O-CB 3.3Å; D904-F907 PolarHBondContact O-N 3.39Å; D904-F907 VanDerWaalsContact O-N 3.14Å
905	P	71.9	Confident	81.4	Confident	107 Å²	107	47.3 Å²	47.3	70%	0.695	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-22.7	178.8	27.8	-35.8	0	0	0	113.6	L903 F907	L903-P905 WeakPolarHBondContact O-CD 3.38Å; P905-F907 VanDerWaalsContact C-N 3.26Å
906	E	72.8	Confident	81.7	Confident	140 Å²	140	44.7 Å²	44.7	65%	0.654	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-8.6	176.3	-62.5	-169.4	169.1	0	0	112.5	D904 T908	D904-E906 PolarHBondContact O-N 3.07Å; D904-E906 PolarHBondContact OD1-N 3.14Å; E906-T908 PolarHBondContact O-N 3.07Å
907	F	76.5	Confident	82	Confident	11 Å²	11	39 Å²	39	5%	0.048	20%	0.196	C	C	.	.			trans	-68.1	114.3	-180	-158	-119.3	0	0	0	111	F410 L901 D904 P905 Q911 R912 L915	F410-F907 HydrophobicContact CE1-CE2 4.44Å; L901-F907 HydrophobicContact CB-CE2 4.44Å; L901-F907 HydrophobicContact CD2-CE2 4.45Å; L901-F907 WeakPolarHBondContact O-CG 3.27Å; D904-F907 HydrophobicContact CB-CB 4.22Å; D904-F907 WeakPolarHBondContact O-CB 3.3Å; D904-F907 PolarHBondContact O-N 3.39Å; D904-F907 VanDerWaalsContact O-N 3.14Å; P905-F907 VanDerWaalsContact C-N 3.26Å; F907-Q911 HydrophobicContact CD1-CB 4.44Å; F907-Q911 HydrophobicContact CD2-CB 4.04Å; F907-Q911 HydrophobicContact CE1-CB 4.08Å; F907-Q911 HydrophobicContact CE2-CB 3.6Å; F907-Q911 HydrophobicContact CE2-CG 4.42Å; F907-Q911 HydrophobicContact CG-CB 4.44Å; F907-Q911 HydrophobicContact CZ-CB 3.62Å; F907-R912 HydrophobicContact CD1-CB 3.99Å; F907-R912 VanDerWaalsContact CE1-CA 3.49Å; F907-R912 HydrophobicContact CE1-CB 3.89Å; F907-L915 HydrophobicContact CE1-CB 4.39Å; F907-L915 HydrophobicContact CE1-CD2 3.95Å; F907-L915 HydrophobicContact CZ-CB 4.2Å; F907-L915 HydrophobicContact CZ-CD2 3.85Å
908	T	79	Confident	82.3	Confident	21 Å²	21	35 Å²	35	13%	0.129	18%	0.176	C	C	.	.			trans	-72.2	157.1	-173.1	64.2	0	0	0	0	112.2	I413 E906 L910 Q911 R912	I413-T908 HydrophobicContact CD1-CG2 4.21Å; E906-T908 PolarHBondContact O-N 3.07Å; T908-L910 VanDerWaalsContact C-N 3.27Å; T908-L910 PolarHBondContact O-N 3.21Å; T908-Q911 PolarHBondContact O-N 3.37Å; T908-Q911 WeakPolarHBondContact OG1-CB 3.42Å; T908-Q911 WeakPolarHBondContact OG1-CG 3.23Å; T908-Q911 PolarHBondContact OG1-N 3.16Å; T908-Q911 PolarHBondContact OG1-OE1 2.91Å; T908-R912 PolarHBondContact O-N 2.76Å
909	L	83.7	Confident	82.6	Confident	30 Å²	30	35.2 Å²	35.2	16%	0.157	18%	0.177	C	C	.	.	H	α-helix	trans	-54.6	-43.5	176.6	-173.8	66.1	0	0	0	112.1	R912 C913 L1155 E1158 A1159	L909-R912 WeakPolarHBondContact O-CB 3.44Å; L909-R912 PolarHBondContact O-N 3.48Å; L909-C913 PolarHBondContact O-N 2.96Å; L909-C913 PolarHBondContact O-SG 2.87Å; L909-L1155 HydrophobicContact CD1-CD2 3.74Å; L909-L1155 HydrophobicContact CD2-CD2 4.16Å; L909-L1155 HydrophobicContact CG-CD2 4.25Å; L909-E1158 HydrophobicContact CD2-CB 3.85Å; L909-A1159 HydrophobicContact CD2-CB 4.48Å
910	L	83.5	Confident	82.9	Confident	3 Å²	3	33.2 Å²	33.2	2%	0.016	17%	0.168	C	C	.	.	H	α-helix	trans	-64.7	-44	179.6	-70.4	169.8	0	0	0	112.3	T908 R912 C913 L914 W929 A933 L936 A1159 Y1163	T908-L910 VanDerWaalsContact C-N 3.27Å; T908-L910 PolarHBondContact O-N 3.21Å; L910-R912 VanDerWaalsContact C-N 3.26Å; L910-R912 PolarHBondContact O-N 2.77Å; L910-C913 PolarHBondContact O-N 2.97Å; L910-L914 PolarHBondContact O-N 3.45Å; L910-W929 HydrophobicContact CD2-CE3 3.79Å; L910-W929 HydrophobicContact CD2-CZ3 3.79Å; L910-A933 HydrophobicContact CB-CB 4.38Å; L910-A933 HydrophobicContact CD1-CB 4.35Å; L910-L936 HydrophobicContact CD1-CB 4.48Å; L910-L936 HydrophobicContact CD1-CD1 4.04Å; L910-L936 HydrophobicContact CD2-CD1 4.09Å; L910-A1159 HydrophobicContact CD2-CB 3.77Å; L910-A1159 HydrophobicContact CG-CB 4.08Å; L910-Y1163 HydrophobicContact CD1-CD2 4.15Å; L910-Y1163 HydrophobicContact CD1-CE2 3.44Å; L910-Y1163 VanDerWaalsContact CD1-CE2 3.44Å; L910-Y1163 HydrophobicContact CG-CE2 4.34Å
911	Q	81.6	Confident	83.1	Confident	10 Å²	10	25.8 Å²	25.8	5%	0.047	14%	0.136	C	C	.	.	H	α-helix	trans	-62.5	-36	175.8	-71.8	166.6	-32.7	0	0	111.4	F410 C411 I413 F907 T908 L915	F410-Q911 HydrophobicContact CD1-CG 3.97Å; F410-Q911 HydrophobicContact CE1-CB 4.19Å; F410-Q911 HydrophobicContact CE1-CG 3.99Å; C411-Q911 HydrophobicContact CB-CG 4.37Å; I413-Q911 HydrophobicContact CD1-CG 4.04Å; F907-Q911 HydrophobicContact CD1-CB 4.44Å; F907-Q911 HydrophobicContact CD2-CB 4.04Å; F907-Q911 HydrophobicContact CE1-CB 4.08Å; F907-Q911 HydrophobicContact CE2-CB 3.6Å; F907-Q911 HydrophobicContact CE2-CG 4.42Å; F907-Q911 HydrophobicContact CG-CB 4.44Å; F907-Q911 HydrophobicContact CZ-CB 3.62Å; T908-Q911 PolarHBondContact O-N 3.37Å; T908-Q911 WeakPolarHBondContact OG1-CB 3.42Å; T908-Q911 WeakPolarHBondContact OG1-CG 3.23Å; T908-Q911 PolarHBondContact OG1-N 3.16Å; T908-Q911 PolarHBondContact OG1-OE1 2.91Å; Q911-L915 VanDerWaalsContact O-CB 3.31Å; Q911-L915 WeakPolarHBondContact O-CB 3.22Å; Q911-L915 PolarHBondContact O-N 2.8Å
912	R	85.4	Confident	83.5	Confident	9 Å²	9	24.6 Å²	24.6	3%	0.034	13%	0.13	C	C	.	.	H	α-helix	trans	-66.5	-49.2	173.8	-175.5	178.3	-71.9	138.7	4.6	112.6	L859 Y868 F907 T908 L909 L910 L914 L915 V916	L859-R912 VanDerWaalsContact O-CD 3.27Å; L859-R912 WeakPolarHBondContact O-CD 3.28Å; Y868-R912 VanDerWaalsContact CE1-CZ 3.45Å; Y868-R912 PolarHBondContact OH-NH1 2.94Å; Y868-R912 PolarHBondContact OH-NH2 3.43Å; F907-R912 HydrophobicContact CD1-CB 3.99Å; F907-R912 VanDerWaalsContact CE1-CA 3.49Å; F907-R912 HydrophobicContact CE1-CB 3.89Å; T908-R912 PolarHBondContact O-N 2.76Å; L909-R912 WeakPolarHBondContact O-CB 3.44Å; L909-R912 PolarHBondContact O-N 3.48Å; L910-R912 VanDerWaalsContact C-N 3.26Å; L910-R912 PolarHBondContact O-N 2.77Å; R912-L914 VanDerWaalsContact C-N 3.26Å; R912-L914 PolarHBondContact O-N 2.84Å; R912-L915 PolarHBondContact O-N 3.03Å; R912-V916 HydrophobicContact CG-CG2 4.39Å; R912-V916 WeakPolarHBondContact O-CG2 3.47Å; R912-V916 PolarHBondContact O-N 2.85Å
913	C	88.3	Confident	83.8	Confident	1 Å²	1	25.4 Å²	25.4	1%	0.007	13%	0.134	C	C	.	.	H	α-helix	trans	-56.6	-42.9	175.7	-66.7	0	0	0	0	111.7	L860 L909 L910 S917 W929	L860-C913 HydrophobicContact CD2-CB 4.38Å; L909-C913 PolarHBondContact O-N 2.96Å; L909-C913 PolarHBondContact O-SG 2.87Å; L910-C913 PolarHBondContact O-N 2.97Å; C913-S917 WeakPolarHBondContact O-CB 3.46Å; C913-S917 PolarHBondContact O-N 2.94Å; C913-S917 PolarHBondContact O-OG 2.81Å; C913-W929 HydrophobicContact CB-CD2 3.52Å; C913-W929 VanDerWaalsContact CB-CE2 3.49Å; C913-W929 HydrophobicContact CB-CE3 3.96Å; C913-W929 HydrophobicContact CB-CG 3.86Å; C913-W929 HydrophobicContact CB-CH2 4.3Å; C913-W929 HydrophobicContact CB-CZ2 3.9Å; C913-W929 HydrophobicContact CB-CZ3 4.33Å
914	L	86	Confident	84.1	Confident	3 Å²	3	22.8 Å²	22.8	2%	0.016	12%	0.122	C	C	.	.	H	α-helix	trans	-65.6	-47.4	177	-169.6	73.8	0	0	0	111.9	C411 L910 R912 V916 S917 R918 L926 W929 T930	C411-L914 HydrophobicContact CB-CD2 4.41Å; C411-L914 WeakPolarHBondContact SG-CD2 3.33Å; L910-L914 PolarHBondContact O-N 3.45Å; R912-L914 VanDerWaalsContact C-N 3.26Å; R912-L914 PolarHBondContact O-N 2.84Å; L914-V916 VanDerWaalsContact C-N 3.34Å; L914-V916 PolarHBondContact O-N 3.47Å; L914-S917 WeakPolarHBondContact CA-OG 3.3Å; L914-S917 PolarHBondContact O-N 3.41Å; L914-S917 PolarHBondContact O-OG 3.01Å; L914-R918 WeakPolarHBondContact O-CG 3.43Å; L914-R918 PolarHBondContact O-N 3.45Å; L914-L926 HydrophobicContact CD1-CD1 3.79Å; L914-L926 HydrophobicContact CG-CD1 4.44Å; L914-W929 HydrophobicContact CB-CB 4.37Å; L914-W929 HydrophobicContact CD1-CB 3.91Å; L914-T930 VanDerWaalsContact CD1-OG1 3.32Å; L914-T930 WeakPolarHBondContact CD1-OG1 3.37Å
915	L	86.9	Confident	84.7	Confident	5 Å²	5	20.9 Å²	20.9	3%	0.026	11%	0.112	C	C	.	.	H	α-helix	trans	-60.6	-43.6	179.3	-179.9	62.1	0	0	0	111.6	L425 I898 L901 L902 F907 Q911 R912 R918 L919	L425-L915 HydrophobicContact CD1-CD1 4.09Å; I898-L915 HydrophobicContact CG2-CD2 4.38Å; L901-L915 HydrophobicContact CB-CD2 4.44Å; L902-L915 HydrophobicContact CD2-CD2 3.8Å; L902-L915 HydrophobicContact CG-CD2 4.11Å; F907-L915 HydrophobicContact CE1-CB 4.39Å; F907-L915 HydrophobicContact CE1-CD2 3.95Å; F907-L915 HydrophobicContact CZ-CB 4.2Å; F907-L915 HydrophobicContact CZ-CD2 3.85Å; Q911-L915 VanDerWaalsContact O-CB 3.31Å; Q911-L915 WeakPolarHBondContact O-CB 3.22Å; Q911-L915 PolarHBondContact O-N 2.8Å; R912-L915 PolarHBondContact O-N 3.03Å; L915-R918 PolarHBondContact O-N 3.16Å; L915-L919 HydrophobicContact CG-CD1 4.3Å; L915-L919 WeakPolarHBondContact O-CG 3.4Å; L915-L919 PolarHBondContact O-N 3.13Å
916	V	89.2	Confident	85.5	Confident	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-64.8	-42	177.1	175	0	0	0	0	110.9	K856 L859 L860 R912 L914 R918 L919 Y920	K856-V916 HydrophobicContact CG-CG1 4.17Å; L859-V916 HydrophobicContact CB-CG1 4.49Å; L859-V916 HydrophobicContact CB-CG2 3.8Å; L860-V916 HydrophobicContact CD2-CB 3.86Å; L860-V916 HydrophobicContact CD2-CG1 4.05Å; L860-V916 HydrophobicContact CD2-CG2 3.97Å; L860-V916 HydrophobicContact CG-CB 4.44Å; L860-V916 HydrophobicContact CG-CG1 4.13Å; L860-V916 HydrophobicContact CG-CG2 4.43Å; R912-V916 HydrophobicContact CG-CG2 4.39Å; R912-V916 WeakPolarHBondContact O-CG2 3.47Å; R912-V916 PolarHBondContact O-N 2.85Å; L914-V916 VanDerWaalsContact C-N 3.34Å; L914-V916 PolarHBondContact O-N 3.47Å; V916-R918 VanDerWaalsContact C-N 3.29Å; V916-R918 PolarHBondContact O-N 3.34Å; V916-L919 PolarHBondContact O-N 2.84Å; V916-Y920 HydrophobicContact CG1-CD2 4.05Å; V916-Y920 HydrophobicContact CG1-CE2 4.3Å; V916-Y920 PolarHBondContact O-N 2.73Å
917	S	89.5	Confident	86.2	Confident	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-60.7	-37	174.8	69.7	0	0	0	0	112.6	C913 L914 G921 D922	C913-S917 WeakPolarHBondContact O-CB 3.46Å; C913-S917 PolarHBondContact O-N 2.94Å; C913-S917 PolarHBondContact O-OG 2.81Å; L914-S917 WeakPolarHBondContact CA-OG 3.3Å; L914-S917 PolarHBondContact O-N 3.41Å; L914-S917 PolarHBondContact O-OG 3.01Å; S917-G921 PolarHBondContact O-N 2.94Å; S917-D922 PolarHBondContact O-N 2.79Å
918	R	87.7	Confident	86.9	Confident	21 Å²	21	10.8 Å²	10.8	8%	0.079	6%	0.055	C	C	.	.	H	α-helix	trans	-67	-43.8	172.8	-71.3	-179.6	-174.3	-168.3	-5	112.1	V366 S426 D428 L914 L915 V916 Y920 G921 L926	V366-R918 HydrophobicContact CG1-CB 4.2Å; V366-R918 HydrophobicContact CG1-CG 4.33Å; S426-R918 PolarHBondContact OG-NH1 2.81Å; D428-R918 IonicContact OD1-NH1 2.78Å; D428-R918 IonicContact OD1-NH2 2.96Å; D428-R918 IonicContact OD2-CZ 3.48Å; D428-R918 IonicContact OD2-NH2 3.89Å; D428-R918 PolarHBondContact OD2-NH2 2.99Å; L914-R918 WeakPolarHBondContact O-CG 3.43Å; L914-R918 PolarHBondContact O-N 3.45Å; L915-R918 PolarHBondContact O-N 3.16Å; V916-R918 VanDerWaalsContact C-N 3.29Å; V916-R918 PolarHBondContact O-N 3.34Å; R918-Y920 VanDerWaalsContact C-N 3.3Å; R918-Y920 PolarHBondContact O-N 3.4Å; R918-G921 PolarHBondContact O-N 2.78Å; R918-G921 VanDerWaalsContact O-N 3.15Å; R918-L926 HydrophobicContact CB-CD1 4.45Å; R918-L926 HydrophobicContact CG-CD1 3.25Å
919	L	88.9	Confident	87.5	Confident	26 Å²	26	10 Å²	10	14%	0.136	5%	0.05	C	C	.	.	H	α-helix	trans	-64.1	-34.5	180	-76.4	174.8	0	0	0	113.1	W842 L894 I898 L915 V916	W842-L919 HydrophobicContact CZ2-CB 3.92Å; W842-L919 HydrophobicContact CZ2-CD1 4.41Å; W842-L919 PolarHBondContact NE1-O 2.87Å; L894-L919 HydrophobicContact CD2-CD1 4.23Å; L894-L919 HydrophobicContact CD2-CD2 3.86Å; I898-L919 HydrophobicContact CD1-CD2 3.99Å; I898-L919 HydrophobicContact CG2-CD1 4.11Å; I898-L919 HydrophobicContact CG2-CD2 4.45Å; L915-L919 HydrophobicContact CG-CD1 4.3Å; L915-L919 WeakPolarHBondContact O-CG 3.4Å; L915-L919 PolarHBondContact O-N 3.13Å; V916-L919 PolarHBondContact O-N 2.84Å
920	Y	89.4	Confident	87.6	Confident	0 Å²	0	9.7 Å²	9.7	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-84.6	-17.6	174.4	-86.6	-110.3	0	0	0	112.8	Y82 W842 P844 Y845 S852 L855 K856 L859 V916 R918 D922	Y82-Y920 HydrophobicContact CD2-CE1 4.34Å; Y82-Y920 AromaticContact CE1-CD1 3.93Å; Y82-Y920 HydrophobicContact CE1-CD1 3.93Å; Y82-Y920 AromaticContact CE2-CD1 3.87Å; Y82-Y920 HydrophobicContact CE2-CD1 3.87Å; Y82-Y920 AromaticContact CE2-CE1 3.82Å; Y82-Y920 HydrophobicContact CE2-CE1 3.82Å; Y82-Y920 AromaticContact CZ-CD1 3.55Å; W842-Y920 HydrophobicContact CZ2-CE2 4.28Å; P844-Y920 HydrophobicContact CB-CD1 3.89Å; P844-Y920 HydrophobicContact CB-CE1 3.37Å; P844-Y920 HydrophobicContact CB-CE2 4.13Å; P844-Y920 HydrophobicContact CB-CG 4.48Å; P844-Y920 VanDerWaalsContact CB-CZ 3.5Å; P844-Y920 HydrophobicContact CG-CD1 4.2Å; P844-Y920 HydrophobicContact CG-CD2 4.12Å; P844-Y920 HydrophobicContact CG-CE1 3.94Å; P844-Y920 HydrophobicContact CG-CE2 3.83Å; P844-Y920 HydrophobicContact CG-CG 4.29Å; Y845-Y920 WeakPolarHBondContact CE2-O 3.06Å; Y845-Y920 PolarHBondContact OH-O 2.97Å; S852-Y920 PolarHBondContact O-OH 2.91Å; L855-Y920 WeakPolarHBondContact CB-OH 3.41Å; L855-Y920 WeakPolarHBondContact CG-OH 3.31Å; K856-Y920 HydrophobicContact CB-CE1 4.06Å; K856-Y920 HydrophobicContact CB-CE2 4.21Å; K856-Y920 HydrophobicContact CD-CE1 4.44Å; K856-Y920 PolarHBondContact N-OH 2.8Å; L859-Y920 HydrophobicContact CD1-CE2 4.3Å; V916-Y920 HydrophobicContact CG1-CD2 4.05Å; V916-Y920 HydrophobicContact CG1-CE2 4.3Å; V916-Y920 PolarHBondContact O-N 2.73Å; R918-Y920 VanDerWaalsContact C-N 3.3Å; R918-Y920 PolarHBondContact O-N 3.4Å; Y920-D922 VanDerWaalsContact C-N 3.33Å
921	G	86.8	Confident	87.8	Confident	1 Å²	1	9.6 Å²	9.6	1%	0.01	5%	0.049	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.9	26.8	-174.2	0	0	0	0	0	113.5	W31 S917 R918 E923	W31-G921 WeakPolarHBondContact CB-O 3.41Å; W31-G921 VanDerWaalsContact O-CA 3.31Å; W31-G921 WeakPolarHBondContact O-CA 3.26Å; S917-G921 PolarHBondContact O-N 2.94Å; R918-G921 PolarHBondContact O-N 2.78Å; R918-G921 VanDerWaalsContact O-N 3.15Å; G921-E923 PolarHBondContact O-N 3.39Å; G921-E923 VanDerWaalsContact O-N 3.09Å
922	D	88.3	Confident	88.2	Confident	1 Å²	1	9.1 Å²	9.1	1%	0.005	5%	0.047	C	C	.	.			trans	-77.3	96.8	-178.4	-71.7	-0.8	0	0	0	109.6	Y82 K856 S917 Y920 S924 E925 L926	Y82-D922 VanDerWaalsContact CE1-OD1 3.25Å; Y82-D922 WeakPolarHBondContact CE1-OD1 3.09Å; Y82-D922 PolarHBondContact OH-OD1 2.94Å; Y82-D922 PolarHBondContact OH-OD2 3.25Å; K856-D922 IonicContact NZ-OD2 3.18Å; K856-D922 PolarHBondContact NZ-OD2 3.07Å; S917-D922 PolarHBondContact O-N 2.79Å; Y920-D922 VanDerWaalsContact C-N 3.33Å; D922-S924 VanDerWaalsContact C-N 3.3Å; D922-S924 PolarHBondContact O-N 3.33Å; D922-E925 HydrophobicContact CB-CB 3.89Å; D922-E925 HydrophobicContact CB-CG 4.2Å; D922-E925 PolarHBondContact O-N 3.03Å; D922-L926 WeakPolarHBondContact O-CB 3.43Å; D922-L926 PolarHBondContact O-N 2.75Å
923	E	86.8	Confident	88.2	Confident	23 Å²	23	8.7 Å²	8.7	11%	0.107	5%	0.045	C	C	.	.	H	α-helix	trans	-56.2	-45.3	-176.9	-175.3	172.9	-171.4	0	0	110.9	W31 R71 E72 G921 E925 L926 H927	W31-E923 HydrophobicContact CD2-CB 4.11Å; W31-E923 HydrophobicContact CE3-CB 3.77Å; W31-E923 HydrophobicContact CE3-CG 4.34Å; W31-E923 HydrophobicContact CH2-CB 3.86Å; W31-E923 HydrophobicContact CH2-CG 3.48Å; W31-E923 VanDerWaalsContact CH2-CG 3.48Å; W31-E923 HydrophobicContact CZ2-CB 4.14Å; W31-E923 VanDerWaalsContact CZ2-CD 3.43Å; W31-E923 HydrophobicContact CZ2-CG 3.71Å; W31-E923 HydrophobicContact CZ3-CB 3.65Å; W31-E923 HydrophobicContact CZ3-CG 3.82Å; R71-E923 WeakPolarHBondContact CD-OE2 3.49Å; R71-E923 IonicContact NH1-OE1 3.66Å; R71-E923 PolarHBondContact NH1-OE1 3.13Å; R71-E923 IonicContact NH1-OE2 3.91Å; E72-E923 PolarHBondContact O-N 3.32Å; G921-E923 PolarHBondContact O-N 3.39Å; G921-E923 VanDerWaalsContact O-N 3.09Å; E923-E925 VanDerWaalsContact C-N 3.34Å; E923-E925 PolarHBondContact O-N 2.78Å; E923-L926 PolarHBondContact O-N 2.87Å; E923-H927 PolarHBondContact O-N 3.33Å; E923-H927 PolarHBondContact O-ND1 3.38Å; E923-H927 IonicContact OE1-CE1 3.53Å
924	S	87.2	Confident	88.1	Confident	21 Å²	21	9.4 Å²	9.4	15%	0.147	5%	0.049	C	C	.	.	H	α-helix	trans	-65.6	-34.7	-177.7	77	0	0	0	0	113.4	N73 Y74 D922 F928 R1152	N73-S924 WeakPolarHBondContact O-CB 3.37Å; Y74-S924 PolarHBondContact O-OG 3.11Å; D922-S924 VanDerWaalsContact C-N 3.3Å; D922-S924 PolarHBondContact O-N 3.33Å; S924-F928 WeakPolarHBondContact O-CB 3.44Å; S924-F928 PolarHBondContact O-N 2.58Å; S924-R1152 PolarHBondContact OG-NH2 3.45Å
925	E	88.6	Confident	88.1	Confident	6 Å²	6	10.4 Å²	10.4	3%	0.028	5%	0.052	C	C	.	.	H	α-helix	trans	-79.2	-38.8	-179.8	-72	-169.4	-175.3	0	0	111.8	H75 K856 D922 E923 H927 F928 W929 R1152	H75-E925 IonicContact ND1-OE1 3.64Å; K856-E925 WeakPolarHBondContact CE-OE2 3.38Å; K856-E925 IonicContact NZ-OE1 3.95Å; K856-E925 PolarHBondContact NZ-OE1 3.35Å; K856-E925 IonicContact NZ-OE2 3.77Å; K856-E925 PolarHBondContact NZ-OE2 3.25Å; D922-E925 HydrophobicContact CB-CB 3.89Å; D922-E925 HydrophobicContact CB-CG 4.2Å; D922-E925 PolarHBondContact O-N 3.03Å; E923-E925 VanDerWaalsContact C-N 3.34Å; E923-E925 PolarHBondContact O-N 2.78Å; E925-H927 VanDerWaalsContact C-N 3.34Å; E925-H927 PolarHBondContact O-N 3.13Å; E925-F928 PolarHBondContact O-N 2.72Å; E925-W929 WeakPolarHBondContact O-CB 3.47Å; E925-W929 PolarHBondContact O-N 2.82Å; E925-R1152 VanDerWaalsContact CG-CZ 3.45Å; E925-R1152 IonicContact OE1-CZ 3.66Å; E925-R1152 IonicContact OE1-NE 3.02Å; E925-R1152 IonicContact OE1-NH2 3.57Å; E925-R1152 PolarHBondContact OE1-NH2 2.91Å
926	L	88.6	Confident	88	Confident	13 Å²	13	10.1 Å²	10.1	7%	0.068	5%	0.051	C	C	.	.	H	α-helix	trans	-55.9	-51.1	177.3	-175	71.7	0	0	0	110.8	W31 L914 R918 D922 E923 T930	W31-L926 HydrophobicContact CZ3-CD2 4.1Å; L914-L926 HydrophobicContact CD1-CD1 3.79Å; L914-L926 HydrophobicContact CG-CD1 4.44Å; R918-L926 HydrophobicContact CB-CD1 4.45Å; R918-L926 HydrophobicContact CG-CD1 3.25Å; D922-L926 WeakPolarHBondContact O-CB 3.43Å; D922-L926 PolarHBondContact O-N 2.75Å; E923-L926 PolarHBondContact O-N 2.87Å; L926-T930 VanDerWaalsContact O-CB 3.3Å; L926-T930 WeakPolarHBondContact O-CB 3.19Å; L926-T930 PolarHBondContact O-N 2.85Å; L926-T930 PolarHBondContact O-OG1 3.15Å
927	H	88.2	Confident	87.6	Confident	30 Å²	30	11.4 Å²	11.4	14%	0.139	6%	0.057	C	C	.	.	H	α-helix	trans	-65.3	-42.9	178.4	-65.8	97.1	0	0	0	111.6	F298 E923 E925 V931 Y967 L1129	F298-H927 AromaticContact CE1-NE2 3.42Å; F298-H927 WeakPolarHBondContact CE1-NE2 3.41Å; F298-H927 AromaticContact CZ-CD2 3.86Å; F298-H927 AromaticContact CZ-NE2 3.33Å; F298-H927 VanDerWaalsContact CZ-NE2 3.33Å; F298-H927 WeakPolarHBondContact CZ-NE2 3.48Å; E923-H927 PolarHBondContact O-N 3.33Å; E923-H927 PolarHBondContact O-ND1 3.38Å; E923-H927 IonicContact OE1-CE1 3.53Å; E925-H927 VanDerWaalsContact C-N 3.34Å; E925-H927 PolarHBondContact O-N 3.13Å; H927-V931 WeakPolarHBondContact O-CG2 3.45Å; H927-V931 PolarHBondContact O-N 2.83Å; H927-V931 VanDerWaalsContact O-N 3.13Å; H927-Y967 HydrophobicContact CB-CE1 4.22Å; H927-Y967 AromaticContact CD2-CE1 3.54Å; H927-Y967 AromaticContact CD2-CZ 3.89Å; H927-L1129 HydrophobicContact CB-CD1 4.49Å
928	F	91.8	Very high	87.3	Confident	3 Å²	3	12.7 Å²	12.7	1%	0.013	7%	0.066	C	C	.	.	H	α-helix	trans	-59.8	-51.4	178.3	175.7	-92.5	0	0	0	112.2	S924 E925 V931 A932 L1129 L1132 V1140 L1144 R1152 F1156	S924-F928 WeakPolarHBondContact O-CB 3.44Å; S924-F928 PolarHBondContact O-N 2.58Å; E925-F928 PolarHBondContact O-N 2.72Å; F928-V931 PolarHBondContact O-N 2.8Å; F928-A932 WeakPolarHBondContact O-CB 3.19Å; F928-A932 PolarHBondContact O-N 3.09Å; F928-L1129 HydrophobicContact CB-CD2 4.49Å; F928-L1132 HydrophobicContact CD2-CD1 3.66Å; F928-L1132 HydrophobicContact CE2-CD1 3.64Å; F928-L1132 HydrophobicContact CE2-CG 4.35Å; F928-L1132 HydrophobicContact CG-CD1 4.4Å; F928-L1132 HydrophobicContact CZ-CD1 4.35Å; F928-V1140 HydrophobicContact CE2-CG1 4.01Å; F928-V1140 HydrophobicContact CZ-CG1 4.3Å; F928-L1144 HydrophobicContact CE2-CD1 4.08Å; F928-L1144 HydrophobicContact CE2-CD2 4.45Å; F928-L1144 HydrophobicContact CZ-CD1 3.76Å; F928-R1152 HydrophobicContact CD1-CG 4.06Å; F928-R1152 HydrophobicContact CE1-CG 3.76Å; F928-R1152 HydrophobicContact CZ-CG 4.27Å; F928-F1156 HydrophobicContact CE1-CD2 4.15Å; F928-F1156 HydrophobicContact CZ-CB 4.4Å; F928-F1156 AromaticContact CZ-CD2 3.78Å; F928-F1156 HydrophobicContact CZ-CD2 3.78Å; F928-F1156 HydrophobicContact CZ-CE2 4.16Å; F928-F1156 HydrophobicContact CZ-CG 4.08Å
929	W	90.4	Very high	87	Confident	4 Å²	4	13.5 Å²	13.5	2%	0.015	7%	0.072	C	C	.	.	H	α-helix	trans	-71.3	-32	-177.4	-69	119.9	0	0	0	112.6	L910 C913 L914 E925 A932 A933 R1152 L1155 F1156	L910-W929 HydrophobicContact CD2-CE3 3.79Å; L910-W929 HydrophobicContact CD2-CZ3 3.79Å; C913-W929 HydrophobicContact CB-CD2 3.52Å; C913-W929 VanDerWaalsContact CB-CE2 3.49Å; C913-W929 HydrophobicContact CB-CE3 3.96Å; C913-W929 HydrophobicContact CB-CG 3.86Å; C913-W929 HydrophobicContact CB-CH2 4.3Å; C913-W929 HydrophobicContact CB-CZ2 3.9Å; C913-W929 HydrophobicContact CB-CZ3 4.33Å; L914-W929 HydrophobicContact CB-CB 4.37Å; L914-W929 HydrophobicContact CD1-CB 3.91Å; E925-W929 WeakPolarHBondContact O-CB 3.47Å; E925-W929 PolarHBondContact O-N 2.82Å; W929-A932 HydrophobicContact CE3-CB 4.46Å; W929-A933 WeakPolarHBondContact O-CB 3.19Å; W929-A933 PolarHBondContact O-N 2.73Å; W929-R1152 HydrophobicContact CZ2-CG 3.94Å; W929-L1155 HydrophobicContact CH2-CB 3.81Å; W929-L1155 HydrophobicContact CZ2-CB 4.14Å; W929-F1156 HydrophobicContact CH2-CB 4.14Å; W929-F1156 HydrophobicContact CZ3-CB 4.45Å; W929-F1156 HydrophobicContact CZ3-CD2 4.44Å
930	T	87	Confident	86.6	Confident	24 Å²	24	13.9 Å²	13.9	15%	0.147	8%	0.076	C	C	.	.	H	α-helix	trans	-61.9	-49.6	174	-58.3	0	0	0	0	110.8	L914 L926 H934 Y967	L914-T930 VanDerWaalsContact CD1-OG1 3.32Å; L914-T930 WeakPolarHBondContact CD1-OG1 3.37Å; L926-T930 VanDerWaalsContact O-CB 3.3Å; L926-T930 WeakPolarHBondContact O-CB 3.19Å; L926-T930 PolarHBondContact O-N 2.85Å; L926-T930 PolarHBondContact O-OG1 3.15Å; T930-H934 PolarHBondContact O-N 3.03Å; T930-Y967 HydrophobicContact CG2-CE2 4.12Å
931	V	88.3	Confident	85.9	Confident	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-69	-42.9	179.1	178.1	0	0	0	0	111.2	H927 F928 A933 H934 Y935 L963 Y967 L970 L1129 L1132	H927-V931 WeakPolarHBondContact O-CG2 3.45Å; H927-V931 PolarHBondContact O-N 2.83Å; H927-V931 VanDerWaalsContact O-N 3.13Å; F928-V931 PolarHBondContact O-N 2.8Å; V931-A933 PolarHBondContact O-N 2.99Å; V931-H934 PolarHBondContact O-N 3.25Å; V931-Y935 HydrophobicContact CG1-CD2 3.78Å; V931-Y935 HydrophobicContact CG1-CE2 4.01Å; V931-Y935 WeakPolarHBondContact O-CD2 3.35Å; V931-Y935 PolarHBondContact O-N 2.9Å; V931-L963 HydrophobicContact CG2-CD2 4.32Å; V931-Y967 HydrophobicContact CG2-CD1 3.79Å; V931-Y967 HydrophobicContact CG2-CE1 3.76Å; V931-Y967 HydrophobicContact CG2-CG 4.48Å; V931-L970 HydrophobicContact CG2-CD1 4.39Å; V931-L1129 HydrophobicContact CB-CD2 4.3Å; V931-L1129 HydrophobicContact CG2-CD2 4.17Å; V931-L1132 HydrophobicContact CB-CD1 4.4Å; V931-L1132 HydrophobicContact CG1-CB 3.88Å; V931-L1132 HydrophobicContact CG1-CD1 4.26Å
932	A	89.3	Confident	85.3	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-61.9	-42.5	179	0	0	0	0	0	112.2	F928 W929 Y935 L936 L1132 F1156	F928-A932 WeakPolarHBondContact O-CB 3.19Å; F928-A932 PolarHBondContact O-N 3.09Å; W929-A932 HydrophobicContact CE3-CB 4.46Å; A932-Y935 PolarHBondContact O-N 2.9Å; A932-L936 VanDerWaalsContact O-CB 3.3Å; A932-L936 WeakPolarHBondContact O-CB 3.37Å; A932-L936 VanDerWaalsContact O-CG 3.26Å; A932-L936 WeakPolarHBondContact O-CG 3.4Å; A932-L936 PolarHBondContact O-N 3.13Å; A932-L1132 HydrophobicContact CB-CD1 4.02Å; A932-L1132 HydrophobicContact CB-CD2 4.01Å; A932-F1156 HydrophobicContact CB-CD2 4.48Å; A932-F1156 HydrophobicContact CB-CE2 4.17Å
933	A	85.2	Confident	84.5	Confident	1 Å²	1	26 Å²	26	1%	0.008	13%	0.131	C	C	.	.	H	α-helix	trans	-63.8	-42.1	179.7	0	0	0	0	0	112.3	C411 L910 W929 V931 H937	C411-A933 HydrophobicContact CB-CB 3.96Å; L910-A933 HydrophobicContact CB-CB 4.38Å; L910-A933 HydrophobicContact CD1-CB 4.35Å; W929-A933 WeakPolarHBondContact O-CB 3.19Å; W929-A933 PolarHBondContact O-N 2.73Å; V931-A933 PolarHBondContact O-N 2.99Å; A933-H937 VanDerWaalsContact O-CB 3.27Å; A933-H937 WeakPolarHBondContact O-CB 3.2Å; A933-H937 PolarHBondContact O-N 2.93Å; A933-H937 VanDerWaalsContact O-N 3.17Å
934	H	85.2	Confident	83.4	Confident	16 Å²	16	28.5 Å²	28.5	7%	0.074	15%	0.151	C	C	.	.	H	α-helix	trans	-58.4	-54.1	176	-176.3	66.7	0	0	0	112.1	T930 V931 H937 S938 N961 L963 E972	T930-H934 PolarHBondContact O-N 3.03Å; V931-H934 PolarHBondContact O-N 3.25Å; H934-H937 PolarHBondContact O-N 2.76Å; H934-S938 WeakPolarHBondContact O-CB 3.47Å; H934-S938 PolarHBondContact O-N 3.26Å; H934-N961 PolarHBondContact CE1-O 3.02Å; H934-L963 HydrophobicContact CB-CD1 4.18Å; H934-E972 IonicContact CD2-OE1 3.69Å; H934-E972 IonicContact CE1-OE1 3.55Å; H934-E972 IonicContact NE2-OE1 3.29Å; H934-E972 PolarHBondContact NE2-OE1 3.18Å
935	Y	86.5	Confident	82	Confident	23 Å²	23	30.4 Å²	30.4	9%	0.09	17%	0.168	C	C	.	.	H	α-helix	trans	-74.1	-34.3	-173.8	-80.6	-72.2	0	0	0	114.2	V931 A932 H937 L939 L963 L970 S1133	V931-Y935 HydrophobicContact CG1-CD2 3.78Å; V931-Y935 HydrophobicContact CG1-CE2 4.01Å; V931-Y935 WeakPolarHBondContact O-CD2 3.35Å; V931-Y935 PolarHBondContact O-N 2.9Å; A932-Y935 PolarHBondContact O-N 2.9Å; Y935-H937 VanDerWaalsContact C-N 3.34Å; Y935-L939 WeakPolarHBondContact O-CB 3.46Å; Y935-L939 PolarHBondContact O-N 2.74Å; Y935-L963 HydrophobicContact CE2-CD2 4.49Å; Y935-L970 PolarHBondContact OH-O 2.69Å; Y935-S1133 WeakPolarHBondContact CE1-O 3Å; Y935-S1133 VanDerWaalsContact CE2-CA 3.46Å
936	L	85.8	Confident	80.6	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-65.4	-39.8	173.5	-73.6	171.7	0	0	0	111.6	L910 A932 S940 F1137 F1156 A1159 Y1163 A1165	L910-L936 HydrophobicContact CD1-CB 4.48Å; L910-L936 HydrophobicContact CD1-CD1 4.04Å; L910-L936 HydrophobicContact CD2-CD1 4.09Å; A932-L936 VanDerWaalsContact O-CB 3.3Å; A932-L936 WeakPolarHBondContact O-CB 3.37Å; A932-L936 VanDerWaalsContact O-CG 3.26Å; A932-L936 WeakPolarHBondContact O-CG 3.4Å; A932-L936 PolarHBondContact O-N 3.13Å; L936-S940 PolarHBondContact O-N 2.92Å; L936-S940 VanDerWaalsContact O-N 3.14Å; L936-F1137 HydrophobicContact CD2-CD1 3.74Å; L936-F1137 HydrophobicContact CD2-CE1 3.44Å; L936-F1137 VanDerWaalsContact CD2-CE1 3.44Å; L936-F1137 HydrophobicContact CD2-CG 4.41Å; L936-F1137 HydrophobicContact CD2-CZ 3.88Å; L936-F1137 HydrophobicContact CG-CD1 4.46Å; L936-F1137 HydrophobicContact CG-CE1 3.9Å; L936-F1137 HydrophobicContact CG-CZ 4.48Å; L936-F1156 HydrophobicContact CD1-CE2 4.41Å; L936-A1159 HydrophobicContact CD1-CB 4.09Å; L936-Y1163 HydrophobicContact CB-CG 4.33Å; L936-A1165 HydrophobicContact CD2-CB 3.84Å
937	H	81.3	Confident	79.1	Confident	27 Å²	27	45 Å²	45	13%	0.125	24%	0.235	C	C	.	.	H	α-helix	trans	-68.7	-44.8	177.3	-174.4	-98.7	0	0	0	111.6	G412 A933 H934 Y935 L939 S940 Q941	G412-H937 PolarHBondContact O-CE1 2.96Å; G412-H937 PolarHBondContact O-ND1 3.12Å; G412-H937 VanDerWaalsContact O-ND1 3.08Å; A933-H937 VanDerWaalsContact O-CB 3.27Å; A933-H937 WeakPolarHBondContact O-CB 3.2Å; A933-H937 PolarHBondContact O-N 2.93Å; A933-H937 VanDerWaalsContact O-N 3.17Å; H934-H937 PolarHBondContact O-N 2.76Å; Y935-H937 VanDerWaalsContact C-N 3.34Å; H937-L939 VanDerWaalsContact C-N 3.31Å; H937-L939 PolarHBondContact O-N 2.91Å; H937-S940 PolarHBondContact O-N 3.06Å; H937-S940 VanDerWaalsContact O-N 3.09Å; H937-S940 PolarHBondContact O-OG 2.84Å; H937-Q941 PolarHBondContact CE1-NE2 2.83Å; H937-Q941 PolarHBondContact O-N 3.19Å
938	S	81.6	Confident	77.1	Confident	27 Å²	27	48.3 Å²	48.3	19%	0.189	26%	0.258	C	S	.	.	H	α-helix	trans	-53.5	-47.1	174.1	-176.2	0	0	0	0	111.7	H934 S940 Q941 E942	H934-S938 WeakPolarHBondContact O-CB 3.47Å; H934-S938 PolarHBondContact O-N 3.26Å; S938-S940 VanDerWaalsContact C-N 3.35Å; S938-S940 PolarHBondContact O-N 3.34Å; S938-Q941 PolarHBondContact O-N 2.71Å; S938-E942 WeakPolarHBondContact O-CG 3.45Å; S938-E942 PolarHBondContact O-N 2.91Å
939	L	82.3	Confident	74.6	Confident	38 Å²	38	52.3 Å²	52.3	20%	0.199	29%	0.291	C	S	.	.	H	α-helix	trans	-60.4	-41.2	176.3	-179.4	136.7	0	0	0	112.9	Y935 H937 Q941 E942 K943 F1137 A1165	Y935-L939 WeakPolarHBondContact O-CB 3.46Å; Y935-L939 PolarHBondContact O-N 2.74Å; H937-L939 VanDerWaalsContact C-N 3.31Å; H937-L939 PolarHBondContact O-N 2.91Å; L939-Q941 PolarHBondContact O-N 3.38Å; L939-E942 PolarHBondContact O-N 3.29Å; L939-K943 HydrophobicContact CD2-CD 4.04Å; L939-K943 PolarHBondContact O-N 2.88Å; L939-K943 VanDerWaalsContact O-N 3.08Å; L939-F1137 HydrophobicContact CD1-CD2 4.47Å; L939-F1137 HydrophobicContact CD1-CE2 3.65Å; L939-F1137 HydrophobicContact CD1-CZ 4.42Å; L939-A1165 HydrophobicContact CD2-CB 4.23Å
940	S	79.3	Confident	72.3	Confident	33 Å²	33	58.5 Å²	58.5	23%	0.231	33%	0.332	C	S	.	.	H	α-helix	trans	-65.8	-38	179.4	73.4	0	0	0	0	112.9	L936 H937 S938 K943 S944	L936-S940 PolarHBondContact O-N 2.92Å; L936-S940 VanDerWaalsContact O-N 3.14Å; H937-S940 PolarHBondContact O-N 3.06Å; H937-S940 VanDerWaalsContact O-N 3.09Å; H937-S940 PolarHBondContact O-OG 2.84Å; S938-S940 VanDerWaalsContact C-N 3.35Å; S938-S940 PolarHBondContact O-N 3.34Å; S940-K943 PolarHBondContact O-N 3.12Å; S940-S944 PolarHBondContact O-N 2.86Å
941	Q	75.1	Confident	69.9	Low	72 Å²	72	67 Å²	67	34%	0.336	37%	0.367	S	S	.	.	H	α-helix	trans	-66.2	-42.3	175.5	-70.4	-169.5	-15.1	0	0	111.6	H937 S938 L939 K943 S944 A945	H937-Q941 PolarHBondContact CE1-NE2 2.83Å; H937-Q941 PolarHBondContact O-N 3.19Å; S938-Q941 PolarHBondContact O-N 2.71Å; L939-Q941 PolarHBondContact O-N 3.38Å; Q941-K943 VanDerWaalsContact C-N 3.32Å; Q941-K943 PolarHBondContact O-N 3.29Å; Q941-S944 PolarHBondContact O-N 3.11Å; Q941-A945 WeakPolarHBondContact O-CB 3.17Å; Q941-A945 PolarHBondContact O-N 2.93Å
942	E	74.9	Confident	67.3	Low	92 Å²	92	76.1 Å²	76.1	43%	0.43	41%	0.41	S	S	.	.	H	α-helix	trans	-61	-40.8	176.4	-71.8	-166	157.9	0	0	112.4	S938 L939 A945 R946	S938-E942 WeakPolarHBondContact O-CG 3.45Å; S938-E942 PolarHBondContact O-N 2.91Å; L939-E942 PolarHBondContact O-N 3.29Å; E942-A945 PolarHBondContact O-N 2.85Å; E942-R946 WeakPolarHBondContact O-CG 3.45Å; E942-R946 PolarHBondContact O-N 2.81Å
943	K	70.7	Confident	64.8	Low	93 Å²	93	81.5 Å²	81.5	40%	0.404	45%	0.454	S	S	.	.	H	α-helix	trans	-66.3	-44.7	176.1	-73.3	-172.5	177.6	-169.4	0	111.9	L939 S940 Q941 A945 R946 T947 G1164	L939-K943 HydrophobicContact CD2-CD 4.04Å; L939-K943 PolarHBondContact O-N 2.88Å; L939-K943 VanDerWaalsContact O-N 3.08Å; S940-K943 PolarHBondContact O-N 3.12Å; Q941-K943 VanDerWaalsContact C-N 3.32Å; Q941-K943 PolarHBondContact O-N 3.29Å; K943-A945 VanDerWaalsContact C-N 3.27Å; K943-A945 PolarHBondContact O-N 3.47Å; K943-R946 PolarHBondContact O-N 3.3Å; K943-R946 VanDerWaalsContact O-N 3.13Å; K943-T947 PolarHBondContact O-N 3.2Å; K943-T947 PolarHBondContact O-OG1 3.39Å; K943-T947 VanDerWaalsContact O-OG1 3.11Å; K943-G1164 PolarHBondContact NZ-O 2.82Å
944	S	64	Low	62	Low	76 Å²	76	85.3 Å²	85.3	53%	0.531	49%	0.485	S	S	.	.	H	α-helix	trans	-57.5	-40.3	176.1	-175.8	0	0	0	0	112.1	S940 Q941 T947	S940-S944 PolarHBondContact O-N 2.86Å; Q941-S944 PolarHBondContact O-N 3.11Å; S944-T947 WeakPolarHBondContact CA-OG1 3.42Å; S944-T947 PolarHBondContact O-N 3.41Å; S944-T947 PolarHBondContact O-OG1 3.39Å
945	A	58.3	Low	59.5	Low	60 Å²	60	90.3 Å²	90.3	50%	0.496	52%	0.519	S	S	.	.	H	α-helix	trans	-68.1	-31.6	178.8	0	0	0	0	0	113.2	Q941 E942 K943 T947 T948	Q941-A945 WeakPolarHBondContact O-CB 3.17Å; Q941-A945 PolarHBondContact O-N 2.93Å; E942-A945 PolarHBondContact O-N 2.85Å; K943-A945 VanDerWaalsContact C-N 3.27Å; K943-A945 PolarHBondContact O-N 3.47Å; A945-T947 VanDerWaalsContact C-N 3.34Å; A945-T948 PolarHBondContact O-OG1 3.01Å
946	R	58.8	Low	57.1	Low	208 Å²	208	97.6 Å²	97.6	79%	0.785	55%	0.554	S	S	*	*	H	α-helix	trans	-72.5	-25.3	176.6	-71.6	178.3	-173.7	-172.6	4.4	113.2	E942 K943	E942-R946 WeakPolarHBondContact O-CG 3.45Å; E942-R946 PolarHBondContact O-N 2.81Å; K943-R946 PolarHBondContact O-N 3.3Å; K943-R946 VanDerWaalsContact O-N 3.13Å
947	T	56.5	Low	54.7	Low	119 Å²	119	105 Å²	105	73%	0.73	59%	0.593	S	S	*	*	H	α-helix	trans	-82.1	-19.6	179.3	25.6	0	0	0	0	114.8	K943 S944 A945	K943-T947 PolarHBondContact O-N 3.2Å; K943-T947 PolarHBondContact O-OG1 3.39Å; K943-T947 VanDerWaalsContact O-OG1 3.11Å; S944-T947 WeakPolarHBondContact CA-OG1 3.42Å; S944-T947 PolarHBondContact O-N 3.41Å; S944-T947 PolarHBondContact O-OG1 3.39Å; A945-T947 VanDerWaalsContact C-N 3.34Å
948	T	47.5	Very low	52.9	Low	99 Å²	99	110.6 Å²	110.6	61%	0.607	62%	0.618	S	S	*	*	S	Bend	trans	-90.5	117.7	174.7	48.6	0	0	0	0	110.5	A945	A945-T948 PolarHBondContact O-OG1 3.01Å
949	A	38.3	Very low	51.1	Low	86 Å²	86	116.5 Å²	116.5	71%	0.711	65%	0.646	S	S	*	*			trans	-52.1	148.8	-178	0	0	0	0	0	113.5	K951	A949-K951 PolarHBondContact O-N 2.9Å
950	P	43.3	Very low	49.8	Very low	135 Å²	135	117.2 Å²	117.2	88%	0.877	65%	0.654	S	S	*	*			trans	-73.4	104	-173.8	30.4	-32.5	0	0	0	109.9
951	K	35.3	Very low	49	Very low	201 Å²	201	119 Å²	119	87%	0.874	66%	0.662	S	S	*	*			trans	-104.4	113.9	161	-80.9	-170.9	175.1	-177.4	0	108.8	A949	A949-K951 PolarHBondContact O-N 2.9Å
952	E	35.3	Very low	48.9	Very low	193 Å²	193	116.7 Å²	116.7	90%	0.902	65%	0.652	S	S	*	*			trans	38.7	119.5	162.8	-69.1	177.9	168.1	0	0	118.8	A954	E952-A954 PolarHBondContact O-N 3.07Å; E952-A954 VanDerWaalsContact O-N 3.15Å
953	A	35.3	Very low	49.1	Very low	113 Å²	113	112.7 Å²	112.7	93%	0.934	63%	0.634	S	S	*	*			trans	-55.2	107.8	-178.8	0	0	0	0	0	113.6
954	A	26.9	Very low	49.3	Very low	81 Å²	81	109.5 Å²	109.5	67%	0.669	62%	0.621	S	S	*	*			trans	-99.4	147	146.4	0	0	0	0	0	108.2	E952	E952-A954 PolarHBondContact O-N 3.07Å; E952-A954 VanDerWaalsContact O-N 3.15Å
955	P	33.3	Very low	50	Low	121 Å²	121	107.7 Å²	107.7	79%	0.786	61%	0.605	S	S	*	*			trans	-61	142.6	-172.9	25	-31.9	0	0	0	111.6	D957	P955-D957 VanDerWaalsContact C-N 3.28Å; P955-D957 PolarHBondContact O-N 2.8Å
956	Q	35.3	Very low	50.9	Low	176 Å²	176	105.3 Å²	105.3	82%	0.822	59%	0.585	S	S	*	*			trans	-70.1	59.5	-169.6	-64.7	177.5	-37.2	0	0	114.6	K958	Q956-K958 PolarHBondContact O-N 3.08Å
957	D	34.9	Very low	52	Low	154 Å²	154	96.7 Å²	96.7	82%	0.824	55%	0.553	S	S	*	*			trans	-90.2	82.9	166.2	-76.3	-24.6	0	0	0	109.5	P955	P955-D957 VanDerWaalsContact C-N 3.28Å; P955-D957 PolarHBondContact O-N 2.8Å
958	K	43.7	Very low	53.3	Low	146 Å²	146	91.4 Å²	91.4	64%	0.635	52%	0.52	S	S	*	.			trans	-67.1	132.5	-179.9	-77.9	-179.5	176.2	179.5	0	111.3	Q956 S960	Q956-K958 PolarHBondContact O-N 3.08Å; K958-S960 VanDerWaalsContact C-N 3.31Å; K958-S960 PolarHBondContact O-N 3Å
959	L	45.3	Very low	55	Low	151 Å²	151	87.2 Å²	87.2	79%	0.791	49%	0.494	S	S	*	.			trans	-79.8	57.6	-175	-133.9	104.7	0	0	0	112.9
960	S	53.2	Low	57.2	Low	52 Å²	52	84 Å²	84	36%	0.364	47%	0.465	S	S	.	.			trans	-121.1	117.2	174.4	57.7	0	0	0	0	110.6	K958	K958-S960 VanDerWaalsContact C-N 3.31Å; K958-S960 PolarHBondContact O-N 3Å
961	N	64.2	Low	59.2	Low	72 Å²	72	77.8 Å²	77.8	39%	0.385	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-62.5	126.3	171.8	-70.9	-20.8	0	0	0	108.6	S409 H934	S409-N961 PolarHBondContact OG-ND2 2.98Å; H934-N961 PolarHBondContact CE1-O 3.02Å
962	P	71.8	Confident	61.4	Low	22 Å²	22	70.2 Å²	70.2	14%	0.143	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-67.5	164.7	-179.3	27.2	-33.2	0	0	0	111.7	Q433 E972 Y975	Q433-P962 PolarHBondContact NE2-O 2.88Å; Q433-P962 PolarHBondContact OE1-O 3.13Å; P962-E972 WeakPolarHBondContact CA-OE2 3.5Å; P962-E972 WeakPolarHBondContact CB-OE2 3.25Å; P962-Y975 HydrophobicContact CB-CD1 3.78Å; P962-Y975 HydrophobicContact CB-CD2 3.69Å; P962-Y975 HydrophobicContact CB-CE1 4.04Å; P962-Y975 HydrophobicContact CB-CE2 3.96Å; P962-Y975 HydrophobicContact CB-CG 3.58Å; P962-Y975 HydrophobicContact CG-CD1 4.26Å; P962-Y975 HydrophobicContact CG-CD2 3.52Å; P962-Y975 HydrophobicContact CG-CE1 4.14Å; P962-Y975 HydrophobicContact CG-CE2 3.37Å; P962-Y975 HydrophobicContact CG-CG 3.97Å
963	L	78.7	Confident	63.8	Low	8 Å²	8	62.5 Å²	62.5	4%	0.042	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-64.6	146	171.2	-172	66.5	0	0	0	110.5	V931 H934 Y935 Y967 L970	V931-L963 HydrophobicContact CG2-CD2 4.32Å; H934-L963 HydrophobicContact CB-CD1 4.18Å; Y935-L963 HydrophobicContact CE2-CD2 4.49Å; L963-Y967 HydrophobicContact CD1-CD2 4.15Å; L963-Y967 HydrophobicContact CD1-CE2 4.5Å; L963-Y967 HydrophobicContact CD2-CD2 4.24Å; L963-Y967 HydrophobicContact CD2-CG 3.99Å; L963-Y967 HydrophobicContact CG-CD2 4.02Å; L963-Y967 HydrophobicContact CG-CG 4.28Å; L963-L970 HydrophobicContact CD2-CB 4.19Å
964	D	76.4	Confident	66.1	Low	27 Å²	27	60.7 Å²	60.7	14%	0.144	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-60.2	141.6	178.8	-72.8	-45.3	0	0	0	112.3	R300 Q433 C966 Y967	R300-D964 IonicContact CZ-OD1 2.62Å; R300-D964 IonicContact NH1-OD1 3.21Å; R300-D964 PolarHBondContact NH1-OD1 3.35Å; R300-D964 IonicContact NH1-OD2 3.28Å; Q433-D964 WeakPolarHBondContact CG-OD1 3.32Å; Q433-D964 PolarHBondContact NE2-OD1 3.46Å; D964-C966 PolarHBondContact O-N 3.44Å; D964-C966 VanDerWaalsContact O-N 3.07Å; D964-Y967 HydrophobicContact CB-CD2 4.34Å; D964-Y967 PolarHBondContact O-N 3.41Å; D964-Y967 VanDerWaalsContact O-N 3.09Å
965	I	77.6	Confident	68.7	Low	37 Å²	37	57.9 Å²	57.9	19%	0.19	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-60.7	-22.7	-174.9	-62.9	161.8	0	0	0	113	Y967 D968 Y975 F979	I965-Y967 PolarHBondContact O-N 3.07Å; I965-D968 PolarHBondContact O-N 3.26Å; I965-Y975 HydrophobicContact CD1-CE1 4.44Å; I965-Y975 WeakPolarHBondContact CD1-OH 3.49Å; I965-Y975 HydrophobicContact CG1-CE1 3.67Å; I965-Y975 WeakPolarHBondContact CG1-OH 3.33Å; I965-F979 HydrophobicContact CD1-CD2 3.68Å; I965-F979 HydrophobicContact CD1-CE2 3.78Å; I965-F979 HydrophobicContact CD1-CG 4.4Å; I965-F979 HydrophobicContact CG1-CD2 4.32Å; I965-F979 HydrophobicContact CG2-CD1 4.13Å; I965-F979 HydrophobicContact CG2-CD2 4.32Å; I965-F979 HydrophobicContact CG2-CE1 3.74Å; I965-F979 HydrophobicContact CG2-CE2 3.94Å; I965-F979 HydrophobicContact CG2-CG 4.41Å; I965-F979 HydrophobicContact CG2-CZ 3.63Å
966	C	78.4	Confident	71.2	Confident	11 Å²	11	52.3 Å²	52.3	7%	0.074	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-60.3	-15.7	176.3	58.2	0	0	0	0	113.5	F169 F298 D964	F169-C966 WeakPolarHBondContact CE1-O 3.44Å; F298-C966 HydrophobicContact CD2-CB 4.04Å; F298-C966 HydrophobicContact CE2-CB 3.73Å; F298-C966 HydrophobicContact CZ-CB 3.99Å; F298-C966 VanDerWaalsContact O-CB 3.31Å; F298-C966 WeakPolarHBondContact O-CB 3.37Å; D964-C966 PolarHBondContact O-N 3.44Å; D964-C966 VanDerWaalsContact O-N 3.07Å
967	Y	81.4	Confident	73.6	Confident	26 Å²	26	47 Å²	47	10%	0.102	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-92.2	0.1	174.7	-67	-85.8	0	0	0	114.1	H927 T930 V931 L963 D964 I965 V969 L970	H927-Y967 HydrophobicContact CB-CE1 4.22Å; H927-Y967 AromaticContact CD2-CE1 3.54Å; H927-Y967 AromaticContact CD2-CZ 3.89Å; T930-Y967 HydrophobicContact CG2-CE2 4.12Å; V931-Y967 HydrophobicContact CG2-CD1 3.79Å; V931-Y967 HydrophobicContact CG2-CE1 3.76Å; V931-Y967 HydrophobicContact CG2-CG 4.48Å; L963-Y967 HydrophobicContact CD1-CD2 4.15Å; L963-Y967 HydrophobicContact CD1-CE2 4.5Å; L963-Y967 HydrophobicContact CD2-CD2 4.24Å; L963-Y967 HydrophobicContact CD2-CG 3.99Å; L963-Y967 HydrophobicContact CG-CD2 4.02Å; L963-Y967 HydrophobicContact CG-CG 4.28Å; D964-Y967 HydrophobicContact CB-CD2 4.34Å; D964-Y967 PolarHBondContact O-N 3.41Å; D964-Y967 VanDerWaalsContact O-N 3.09Å; I965-Y967 PolarHBondContact O-N 3.07Å; Y967-V969 PolarHBondContact O-N 3.31Å; Y967-L970 HydrophobicContact CD1-CD1 3.98Å; Y967-L970 VanDerWaalsContact O-CB 3.31Å; Y967-L970 WeakPolarHBondContact O-CB 3.47Å; Y967-L970 WeakPolarHBondContact O-CG 3.42Å; Y967-L970 PolarHBondContact O-N 3.43Å
968	D	84.4	Confident	75.8	Confident	9 Å²	9	42.8 Å²	42.8	5%	0.048	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	46.5	-112.6	171.1	-167.7	45.8	0	0	0	113.7	F169 R257 I965 L970 C971 F976	F169-D968 HydrophobicContact CD1-CB 3.81Å; F169-D968 HydrophobicContact CE1-CB 3.81Å; R257-D968 WeakPolarHBondContact CD-OD2 3.48Å; R257-D968 IonicContact CZ-OD2 2.71Å; R257-D968 IonicContact NE-OD2 3.07Å; R257-D968 IonicContact NH1-OD2 3.83Å; R257-D968 PolarHBondContact NH1-OD2 3.22Å; I965-D968 PolarHBondContact O-N 3.26Å; D968-L970 PolarHBondContact O-N 2.98Å; D968-C971 WeakPolarHBondContact O-CB 3.48Å; D968-C971 PolarHBondContact O-N 2.95Å; D968-C971 PolarHBondContact O-SG 3.26Å; D968-F976 WeakPolarHBondContact O-CD2 3.36Å; D968-F976 VanDerWaalsContact OD1-CE2 3.3Å; D968-F976 WeakPolarHBondContact OD1-CE2 3.45Å
969	V	82.7	Confident	77.6	Confident	11 Å²	11	36.6 Å²	36.6	7%	0.067	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-58.3	-21.6	-177.7	176.6	0	0	0	0	113.2	Y967 C971 A1093 K1097 L1109 W1112	Y967-V969 PolarHBondContact O-N 3.31Å; V969-C971 PolarHBondContact O-N 3.34Å; V969-A1093 HydrophobicContact CG1-CB 4.17Å; V969-K1097 HydrophobicContact CG1-CG 4.09Å; V969-K1097 WeakPolarHBondContact O-CE 3.27Å; V969-L1109 HydrophobicContact CG1-CD2 4.36Å; V969-W1112 HydrophobicContact CG1-CZ3 4.05Å
970	L	84.1	Confident	79.5	Confident	19 Å²	19	29.4 Å²	29.4	10%	0.099	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-75.7	-9.1	179.2	-57.1	172.7	0	0	0	113	V931 Y935 L963 Y967 D968 L1129 V1130	V931-L970 HydrophobicContact CG2-CD1 4.39Å; Y935-L970 PolarHBondContact OH-O 2.69Å; L963-L970 HydrophobicContact CD2-CB 4.19Å; Y967-L970 HydrophobicContact CD1-CD1 3.98Å; Y967-L970 VanDerWaalsContact O-CB 3.31Å; Y967-L970 WeakPolarHBondContact O-CB 3.47Å; Y967-L970 WeakPolarHBondContact O-CG 3.42Å; Y967-L970 PolarHBondContact O-N 3.43Å; D968-L970 PolarHBondContact O-N 2.98Å; L970-L1129 HydrophobicContact CD1-CB 3.8Å; L970-L1129 HydrophobicContact CD1-CD1 4.13Å; L970-L1129 HydrophobicContact CD2-CB 3.98Å; L970-V1130 HydrophobicContact CD2-CB 4.44Å; L970-V1130 HydrophobicContact CD2-CG2 3.93Å
971	C	84.3	Confident	80.9	Confident	3 Å²	3	28.4 Å²	28.4	2%	0.02	15%	0.154	C	C	.	.	S	Bend	trans	-71.4	166.3	176.9	-58.9	0	0	0	0	112.2	D968 V969 Y975 F976 K1097	D968-C971 WeakPolarHBondContact O-CB 3.48Å; D968-C971 PolarHBondContact O-N 2.95Å; D968-C971 PolarHBondContact O-SG 3.26Å; V969-C971 PolarHBondContact O-N 3.34Å; C971-Y975 HydrophobicContact CB-CD1 4.25Å; C971-F976 HydrophobicContact CB-CB 4.44Å; C971-K1097 PolarHBondContact O-NZ 2.87Å
972	E	83.1	Confident	81.6	Confident	43 Å²	43	26 Å²	26	20%	0.201	14%	0.14	C	C	.	.			trans	-63.6	145.9	172.4	-62.7	123.6	176.1	0	0	111.5	H934 P962 A974 Y975 F976	H934-E972 IonicContact CD2-OE1 3.69Å; H934-E972 IonicContact CE1-OE1 3.55Å; H934-E972 IonicContact NE2-OE1 3.29Å; H934-E972 PolarHBondContact NE2-OE1 3.18Å; P962-E972 WeakPolarHBondContact CA-OE2 3.5Å; P962-E972 WeakPolarHBondContact CB-OE2 3.25Å; E972-A974 VanDerWaalsContact C-N 3.35Å; E972-A974 PolarHBondContact O-N 2.63Å; E972-Y975 PolarHBondContact O-N 2.83Å; E972-F976 VanDerWaalsContact O-CB 3.3Å; E972-F976 WeakPolarHBondContact O-CB 3.34Å; E972-F976 PolarHBondContact O-N 3.32Å
973	N	85.4	Confident	82.1	Confident	31 Å²	31	25.7 Å²	25.7	17%	0.166	14%	0.136	C	C	.	.	H	α-helix	trans	-58	-44.2	-172.6	-62.8	20.2	0	0	0	112.5	F976 Q977 K1097	N973-F976 PolarHBondContact O-N 3.16Å; N973-Q977 WeakPolarHBondContact O-CB 3.46Å; N973-Q977 PolarHBondContact O-N 2.84Å; N973-K1097 WeakPolarHBondContact OD1-CD 3.42Å; N973-K1097 WeakPolarHBondContact OD1-CE 3.48Å; N973-K1097 PolarHBondContact OD1-NZ 3.43Å
974	A	82.6	Confident	82.3	Confident	75 Å²	75	25.3 Å²	25.3	62%	0.62	13%	0.134	S	C	*	.	H	α-helix	trans	-66.5	-45.2	-178.5	0	0	0	0	0	112.4	E972 Q977 K978	E972-A974 VanDerWaalsContact C-N 3.35Å; E972-A974 PolarHBondContact O-N 2.63Å; A974-Q977 PolarHBondContact O-N 3.06Å; A974-K978 WeakPolarHBondContact O-CB 3.29Å; A974-K978 PolarHBondContact O-N 2.86Å
975	Y	82.5	Confident	82.7	Confident	22 Å²	22	27.2 Å²	27.2	9%	0.086	14%	0.144	C	C	.	.	H	α-helix	trans	-64.6	-44	177.3	-177.3	-108.4	0	0	0	111.3	I436 P962 I965 C971 E972 K978 F979	I436-Y975 HydrophobicContact CD1-CD2 3.77Å; I436-Y975 HydrophobicContact CD1-CE2 3.24Å; I436-Y975 HydrophobicContact CG1-CE2 3.98Å; P962-Y975 HydrophobicContact CB-CD1 3.78Å; P962-Y975 HydrophobicContact CB-CD2 3.69Å; P962-Y975 HydrophobicContact CB-CE1 4.04Å; P962-Y975 HydrophobicContact CB-CE2 3.96Å; P962-Y975 HydrophobicContact CB-CG 3.58Å; P962-Y975 HydrophobicContact CG-CD1 4.26Å; P962-Y975 HydrophobicContact CG-CD2 3.52Å; P962-Y975 HydrophobicContact CG-CE1 4.14Å; P962-Y975 HydrophobicContact CG-CE2 3.37Å; P962-Y975 HydrophobicContact CG-CG 3.97Å; I965-Y975 HydrophobicContact CD1-CE1 4.44Å; I965-Y975 WeakPolarHBondContact CD1-OH 3.49Å; I965-Y975 HydrophobicContact CG1-CE1 3.67Å; I965-Y975 WeakPolarHBondContact CG1-OH 3.33Å; C971-Y975 HydrophobicContact CB-CD1 4.25Å; E972-Y975 PolarHBondContact O-N 2.83Å; Y975-K978 PolarHBondContact O-N 3.42Å; Y975-F979 PolarHBondContact O-N 3.07Å
976	F	85.5	Confident	82.7	Confident	4 Å²	4	25.9 Å²	25.9	2%	0.018	14%	0.137	C	C	.	.	H	α-helix	trans	-60.1	-48.2	176.4	-171.6	-106.4	0	0	0	111.8	D968 C971 E972 N973 K978 F979 Q980 W1094 K1097 V1098	D968-F976 WeakPolarHBondContact O-CD2 3.36Å; D968-F976 VanDerWaalsContact OD1-CE2 3.3Å; D968-F976 WeakPolarHBondContact OD1-CE2 3.45Å; C971-F976 HydrophobicContact CB-CB 4.44Å; E972-F976 VanDerWaalsContact O-CB 3.3Å; E972-F976 WeakPolarHBondContact O-CB 3.34Å; E972-F976 PolarHBondContact O-N 3.32Å; N973-F976 PolarHBondContact O-N 3.16Å; F976-K978 VanDerWaalsContact C-N 3.34Å; F976-K978 PolarHBondContact O-N 3.35Å; F976-F979 PolarHBondContact O-N 3.37Å; F976-Q980 HydrophobicContact CD1-CG 4.06Å; F976-Q980 HydrophobicContact CE1-CG 3.79Å; F976-Q980 HydrophobicContact CE2-CG 4.44Å; F976-Q980 HydrophobicContact CZ-CG 4Å; F976-Q980 VanDerWaalsContact CZ-NE2 3.25Å; F976-Q980 VanDerWaalsContact O-CG 3.29Å; F976-Q980 WeakPolarHBondContact O-CG 3.41Å; F976-Q980 PolarHBondContact O-N 3.2Å; F976-W1094 AromaticContact CE1-CD1 3.74Å; F976-W1094 HydrophobicContact CE1-CG 4.4Å; F976-W1094 AromaticContact CE1-NE1 3.96Å; F976-W1094 AromaticContact CZ-CD1 3.61Å; F976-W1094 AromaticContact CZ-NE1 3.95Å; F976-K1097 HydrophobicContact CD1-CB 3.73Å; F976-K1097 HydrophobicContact CE1-CB 4.01Å; F976-V1098 HydrophobicContact CD1-CG2 3.97Å; F976-V1098 HydrophobicContact CE1-CG2 3.84Å
977	Q	85.1	Confident	82.8	Confident	64 Å²	64	25.5 Å²	25.5	30%	0.299	13%	0.134	S	C	.	.	H	α-helix	trans	-59.6	-43.7	177.9	-172.5	-175.9	14	0	0	111.7	N973 A974 F979 Q980 L981 L1007 V1098	N973-Q977 WeakPolarHBondContact O-CB 3.46Å; N973-Q977 PolarHBondContact O-N 2.84Å; A974-Q977 PolarHBondContact O-N 3.06Å; Q977-F979 PolarHBondContact O-N 3.14Å; Q977-Q980 PolarHBondContact O-N 3.02Å; Q977-L981 HydrophobicContact CG-CD1 4.41Å; Q977-L981 WeakPolarHBondContact O-CG 3.09Å; Q977-L981 PolarHBondContact O-N 3.11Å; Q977-L1007 HydrophobicContact CG-CD2 4.32Å; Q977-L1007 PolarHBondContact NE2-O 3.47Å; Q977-V1098 PolarHBondContact NE2-O 3.07Å
978	K	82.2	Confident	82.7	Confident	66 Å²	66	25.2 Å²	25.2	29%	0.287	13%	0.134	S	C	.	.	H	α-helix	trans	-61.5	-42.8	177	-171.2	-178.6	176.1	178.5	0	111.9	I436 E439 A974 Y975 F976 L981 E982	I436-K978 HydrophobicContact CB-CD 4.47Å; I436-K978 HydrophobicContact CD1-CD 4.27Å; I436-K978 HydrophobicContact CD1-CG 4.36Å; I436-K978 HydrophobicContact CG2-CD 4.14Å; I436-K978 HydrophobicContact CG2-CG 4.11Å; E439-K978 IonicContact OE1-NZ 3.53Å; E439-K978 PolarHBondContact OE1-NZ 3.46Å; A974-K978 WeakPolarHBondContact O-CB 3.29Å; A974-K978 PolarHBondContact O-N 2.86Å; Y975-K978 PolarHBondContact O-N 3.42Å; F976-K978 VanDerWaalsContact C-N 3.34Å; F976-K978 PolarHBondContact O-N 3.35Å; K978-L981 WeakPolarHBondContact O-CB 3.47Å; K978-L981 PolarHBondContact O-N 2.83Å; K978-E982 PolarHBondContact O-N 2.95Å
979	F	81.1	Confident	82.3	Confident	15 Å²	15	28.2 Å²	28.2	7%	0.066	15%	0.153	C	C	.	.	H	α-helix	trans	-65.3	-42.4	175.9	176.6	-103.4	0	0	0	112.4	K256 I436 I965 Y975 F976 Q977 L981 E982 R983	K256-F979 HydrophobicContact CG-CZ 4.26Å; I436-F979 HydrophobicContact CD1-CB 4.27Å; I965-F979 HydrophobicContact CD1-CD2 3.68Å; I965-F979 HydrophobicContact CD1-CE2 3.78Å; I965-F979 HydrophobicContact CD1-CG 4.4Å; I965-F979 HydrophobicContact CG1-CD2 4.32Å; I965-F979 HydrophobicContact CG2-CD1 4.13Å; I965-F979 HydrophobicContact CG2-CD2 4.32Å; I965-F979 HydrophobicContact CG2-CE1 3.74Å; I965-F979 HydrophobicContact CG2-CE2 3.94Å; I965-F979 HydrophobicContact CG2-CG 4.41Å; I965-F979 HydrophobicContact CG2-CZ 3.63Å; Y975-F979 PolarHBondContact O-N 3.07Å; F976-F979 PolarHBondContact O-N 3.37Å; Q977-F979 PolarHBondContact O-N 3.14Å; F979-L981 VanDerWaalsContact C-N 3.28Å; F979-L981 PolarHBondContact O-N 2.84Å; F979-E982 WeakPolarHBondContact O-CB 3.31Å; F979-E982 PolarHBondContact O-N 2.85Å; F979-R983 PolarHBondContact O-N 2.94Å
980	Q	84.1	Confident	81.8	Confident	1 Å²	1	29.7 Å²	29.7	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-62.3	-37.1	175.2	-65.3	-56.9	-41.8	0	0	111.5	F976 Q977 R983 V984 L1007 W1094 V1098	F976-Q980 HydrophobicContact CD1-CG 4.06Å; F976-Q980 HydrophobicContact CE1-CG 3.79Å; F976-Q980 HydrophobicContact CE2-CG 4.44Å; F976-Q980 HydrophobicContact CZ-CG 4Å; F976-Q980 VanDerWaalsContact CZ-NE2 3.25Å; F976-Q980 VanDerWaalsContact O-CG 3.29Å; F976-Q980 WeakPolarHBondContact O-CG 3.41Å; F976-Q980 PolarHBondContact O-N 3.2Å; Q977-Q980 PolarHBondContact O-N 3.02Å; Q980-R983 WeakPolarHBondContact O-CB 3.49Å; Q980-R983 PolarHBondContact O-N 2.79Å; Q980-V984 WeakPolarHBondContact O-CG2 3.47Å; Q980-V984 PolarHBondContact O-N 3.01Å; Q980-L1007 HydrophobicContact CB-CD2 3.63Å; Q980-W1094 HydrophobicContact CG-CZ2 4.4Å; Q980-V1098 HydrophobicContact CG-CG2 4.18Å
981	L	83.7	Confident	81.5	Confident	31 Å²	31	33.1 Å²	33.1	16%	0.162	17%	0.17	C	C	.	.	H	α-helix	trans	-64	-44.7	172.5	-74.7	166.8	0	0	0	112.3	Q977 K978 F979 R983 V984 N985 L1007 Q1009	Q977-L981 HydrophobicContact CG-CD1 4.41Å; Q977-L981 WeakPolarHBondContact O-CG 3.09Å; Q977-L981 PolarHBondContact O-N 3.11Å; K978-L981 WeakPolarHBondContact O-CB 3.47Å; K978-L981 PolarHBondContact O-N 2.83Å; F979-L981 VanDerWaalsContact C-N 3.28Å; F979-L981 PolarHBondContact O-N 2.84Å; L981-R983 VanDerWaalsContact C-N 3.26Å; L981-R983 PolarHBondContact O-N 2.77Å; L981-V984 PolarHBondContact O-N 2.87Å; L981-N985 PolarHBondContact O-N 3.19Å; L981-N985 PolarHBondContact O-ND2 2.56Å; L981-N985 PolarHBondContact O-OD1 3.05Å; L981-L1007 HydrophobicContact CD2-CB 3.96Å; L981-L1007 HydrophobicContact CD2-CD1 3.98Å; L981-L1007 HydrophobicContact CD2-CD2 4.45Å; L981-L1007 HydrophobicContact CD2-CG 4.36Å; L981-L1007 HydrophobicContact CG-CD1 4.42Å; L981-L1007 HydrophobicContact CG-CD2 4.26Å; L981-Q1009 HydrophobicContact CD2-CG 3.51Å
982	E	79.6	Confident	80.8	Confident	22 Å²	22	35.1 Å²	35.1	10%	0.103	18%	0.183	C	C	.	.	H	α-helix	trans	-57.7	-41.9	175.5	-169.3	-165.7	158.9	0	0	111.3	R317 I436 K978 F979 N985 L986	R317-E982 IonicContact CZ-OE1 2.78Å; R317-E982 IonicContact NH1-OE1 3.76Å; R317-E982 IonicContact NH2-OE1 3.36Å; R317-E982 PolarHBondContact NH2-OE1 3.32Å; I436-E982 WeakPolarHBondContact CG2-OE2 3.05Å; K978-E982 PolarHBondContact O-N 2.95Å; F979-E982 WeakPolarHBondContact O-CB 3.31Å; F979-E982 PolarHBondContact O-N 2.85Å; E982-N985 PolarHBondContact O-N 2.76Å; E982-L986 WeakPolarHBondContact O-CB 3.42Å; E982-L986 PolarHBondContact O-N 2.85Å; E982-L986 VanDerWaalsContact O-N 3.08Å
983	R	81.8	Confident	80.5	Confident	15 Å²	15	35.4 Å²	35.4	6%	0.057	19%	0.188	C	C	.	.	H	α-helix	trans	-62.2	-45.7	176.6	-171	-179.8	69.5	157.5	15.3	111.8	E274 F979 Q980 L981 L986 Q987	E274-R983 IonicContact OE1-CZ 2.78Å; E274-R983 IonicContact OE1-NH1 3.2Å; E274-R983 PolarHBondContact OE1-NH1 3.49Å; E274-R983 IonicContact OE1-NH2 3.6Å; E274-R983 PolarHBondContact OE1-NH2 3.38Å; E274-R983 IonicContact OE2-CZ 3.9Å; E274-R983 IonicContact OE2-NE 3.49Å; E274-R983 IonicContact OE2-NH1 3.24Å; E274-R983 IonicContact OE2-NH2 3.52Å; E274-R983 PolarHBondContact OE2-NH2 3.22Å; F979-R983 PolarHBondContact O-N 2.94Å; Q980-R983 WeakPolarHBondContact O-CB 3.49Å; Q980-R983 PolarHBondContact O-N 2.79Å; L981-R983 VanDerWaalsContact C-N 3.26Å; L981-R983 PolarHBondContact O-N 2.77Å; R983-L986 WeakPolarHBondContact O-CB 3.43Å; R983-L986 PolarHBondContact O-N 2.81Å; R983-Q987 WeakPolarHBondContact O-CG 3.44Å; R983-Q987 PolarHBondContact O-N 3.04Å
984	V	83.4	Confident	80.3	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-66.3	-39.7	178.2	174.8	0	0	0	0	111.9	Q980 L981 L986 Q987 E988 Q1003 L1004 L1007	Q980-V984 WeakPolarHBondContact O-CG2 3.47Å; Q980-V984 PolarHBondContact O-N 3.01Å; L981-V984 PolarHBondContact O-N 2.87Å; V984-L986 VanDerWaalsContact C-N 3.26Å; V984-L986 PolarHBondContact O-N 2.78Å; V984-Q987 CarbonylContact O-C 3.57Å; V984-Q987 WeakPolarHBondContact O-CB 3.41Å; V984-Q987 PolarHBondContact O-N 3.21Å; V984-Q987 VanDerWaalsContact O-N 3.08Å; V984-E988 WeakPolarHBondContact O-CB 3.17Å; V984-E988 PolarHBondContact O-N 2.84Å; V984-Q1003 HydrophobicContact CG2-CB 3.85Å; V984-L1004 HydrophobicContact CB-CD2 4.48Å; V984-L1004 HydrophobicContact CG1-CD1 4.46Å; V984-L1004 HydrophobicContact CG1-CD2 3.53Å; V984-L1004 HydrophobicContact CG1-CG 3.65Å; V984-L1007 HydrophobicContact CB-CD1 4.21Å; V984-L1007 HydrophobicContact CG2-CD1 3.54Å
985	N	82.8	Confident	80.2	Confident	66 Å²	66	37 Å²	37	35%	0.353	18%	0.184	S	C	.	.	H	α-helix	trans	-58.9	-41.8	175.2	-68.4	-12.9	0	0	0	111.1	L981 E982 E988 V989	L981-N985 PolarHBondContact O-N 3.19Å; L981-N985 PolarHBondContact O-ND2 2.56Å; L981-N985 PolarHBondContact O-OD1 3.05Å; E982-N985 PolarHBondContact O-N 2.76Å; N985-E988 WeakPolarHBondContact O-CB 3.41Å; N985-E988 PolarHBondContact O-N 3Å; N985-V989 WeakPolarHBondContact O-CG2 3.36Å; N985-V989 PolarHBondContact O-N 3.05Å; N985-V989 VanDerWaalsContact O-N 3.12Å
986	L	78.4	Confident	79.9	Confident	10 Å²	10	36.6 Å²	36.6	5%	0.052	18%	0.182	C	C	.	.	H	α-helix	trans	-65	-38.8	175.5	170.9	151.2	0	0	0	112.3	V279 L339 E982 R983 V984 E988 K990	V279-L986 HydrophobicContact CB-CD2 4.1Å; V279-L986 HydrophobicContact CG1-CD1 3.41Å; V279-L986 VanDerWaalsContact CG1-CD1 3.41Å; V279-L986 HydrophobicContact CG1-CD2 3.16Å; V279-L986 HydrophobicContact CG1-CG 3.62Å; V279-L986 HydrophobicContact CG2-CD2 3.75Å; L339-L986 HydrophobicContact CD1-CD1 4.3Å; L339-L986 HydrophobicContact CG-CD1 3.83Å; E982-L986 WeakPolarHBondContact O-CB 3.42Å; E982-L986 PolarHBondContact O-N 2.85Å; E982-L986 VanDerWaalsContact O-N 3.08Å; R983-L986 WeakPolarHBondContact O-CB 3.43Å; R983-L986 PolarHBondContact O-N 2.81Å; V984-L986 VanDerWaalsContact C-N 3.26Å; V984-L986 PolarHBondContact O-N 2.78Å; L986-E988 VanDerWaalsContact C-N 3.34Å; L986-K990 PolarHBondContact O-N 2.83Å
987	Q	79.8	Confident	79.8	Confident	3 Å²	3	37.3 Å²	37.3	1%	0.014	19%	0.187	C	C	.	.	H	α-helix	trans	-66.2	-38.7	174.4	-69.9	173.8	-1.6	0	0	111.4	D272 E274 V275 R983 V984 K990 R991	D272-Q987 WeakPolarHBondContact OD2-CG 3.41Å; D272-Q987 PolarHBondContact OD2-NE2 2.8Å; E274-Q987 PolarHBondContact OE2-NE2 2.96Å; E274-Q987 VanDerWaalsContact OE2-NE2 3.14Å; V275-Q987 HydrophobicContact CG2-CB 3.97Å; V275-Q987 VanDerWaalsContact CG2-CD 3.43Å; V275-Q987 HydrophobicContact CG2-CG 3.6Å; R983-Q987 WeakPolarHBondContact O-CG 3.44Å; R983-Q987 PolarHBondContact O-N 3.04Å; V984-Q987 CarbonylContact O-C 3.57Å; V984-Q987 WeakPolarHBondContact O-CB 3.41Å; V984-Q987 PolarHBondContact O-N 3.21Å; V984-Q987 VanDerWaalsContact O-N 3.08Å; Q987-K990 PolarHBondContact O-N 2.71Å; Q987-R991 PolarHBondContact O-N 2.95Å; Q987-R991 VanDerWaalsContact O-N 3.12Å
988	E	80.3	Confident	79.7	Confident	19 Å²	19	38.3 Å²	38.3	9%	0.089	19%	0.188	C	C	.	.	H	α-helix	trans	-61.4	-44.9	179.2	-166.2	-171	144.8	0	0	111.9	V984 N985 L986 K990 R991 R1012 L1016	V984-E988 WeakPolarHBondContact O-CB 3.17Å; V984-E988 PolarHBondContact O-N 2.84Å; N985-E988 WeakPolarHBondContact O-CB 3.41Å; N985-E988 PolarHBondContact O-N 3Å; L986-E988 VanDerWaalsContact C-N 3.34Å; E988-K990 PolarHBondContact O-N 2.79Å; E988-R991 WeakPolarHBondContact O-CD 3.21Å; E988-R991 WeakPolarHBondContact O-CG 3.22Å; E988-R991 PolarHBondContact O-N 2.84Å; E988-R1012 IonicContact OE1-CZ 3.25Å; E988-R1012 IonicContact OE1-NE 2.93Å; E988-R1012 PolarHBondContact OE1-NE 2.88Å; E988-R1012 IonicContact OE1-NH2 2.79Å; E988-R1012 PolarHBondContact OE1-NH2 2.86Å; E988-R1012 IonicContact OE2-NE 3.5Å; E988-L1016 HydrophobicContact CG-CD1 4.05Å; E988-L1016 HydrophobicContact CG-CD2 4.09Å
989	V	76.4	Confident	79.8	Confident	73 Å²	73	38.9 Å²	38.9	44%	0.442	19%	0.191	S	C	.	.	H	α-helix	trans	-61.7	-32.2	176.5	172.8	0	0	0	0	111.8	V336 N985	V336-V989 HydrophobicContact CG1-CG1 3.69Å; N985-V989 WeakPolarHBondContact O-CG2 3.36Å; N985-V989 PolarHBondContact O-N 3.05Å; N985-V989 VanDerWaalsContact O-N 3.12Å
990	K	72.7	Confident	79.9	Confident	41 Å²	41	38.2 Å²	38.2	18%	0.178	19%	0.187	C	C	.	.	H	α-helix	trans	-94.5	-1.1	-174.8	-66.6	-67.5	-178	-178.4	0	114.2	Q277 E338 L986 Q987 E988	Q277-K990 VanDerWaalsContact CD-O 3.24Å; Q277-K990 PolarHBondContact NE2-O 2.51Å; Q277-K990 PolarHBondContact OE1-O 2.91Å; E338-K990 IonicContact OE1-NZ 2.91Å; E338-K990 PolarHBondContact OE1-NZ 2.75Å; L986-K990 PolarHBondContact O-N 2.83Å; Q987-K990 PolarHBondContact O-N 2.71Å; E988-K990 PolarHBondContact O-N 2.79Å
991	R	75.8	Confident	79.9	Confident	92 Å²	92	38.3 Å²	38.3	35%	0.347	19%	0.188	S	C	.	.			trans	-52.8	142	-179.3	71.3	-168	172.3	115.2	-2.3	112.7	Q987 E988 H996 E1019	Q987-R991 PolarHBondContact O-N 2.95Å; Q987-R991 VanDerWaalsContact O-N 3.12Å; E988-R991 WeakPolarHBondContact O-CD 3.21Å; E988-R991 WeakPolarHBondContact O-CG 3.22Å; E988-R991 PolarHBondContact O-N 2.84Å; R991-H996 HydrophobicContact CB-CB 4.25Å; R991-E1019 IonicContact CZ-OE2 2.77Å; R991-E1019 IonicContact NH1-OE2 2.78Å; R991-E1019 PolarHBondContact NH1-OE2 2.93Å; R991-E1019 IonicContact NH2-OE1 3.92Å; R991-E1019 IonicContact NH2-OE2 3.6Å; R991-E1019 PolarHBondContact NH2-OE2 2.99Å
992	S	70.4	Confident	80	Confident	44 Å²	44	38.6 Å²	38.6	31%	0.308	19%	0.19	S	C	.	.			trans	-141.8	-33.6	-177.8	59.7	0	0	0	0	114.3
993	T	77.6	Confident	80.3	Confident	49 Å²	49	38.8 Å²	38.8	30%	0.301	19%	0.191	S	C	.	.	S	Bend	trans	-109.5	159.8	175.8	61.6	0	0	0	0	110.3	L231 D995 H996 T997	L231-T993 HydrophobicContact CD2-CG2 4.4Å; T993-D995 PolarHBondContact O-N 3.19Å; T993-H996 WeakPolarHBondContact O-CB 3.27Å; T993-H996 PolarHBondContact O-N 2.89Å; T993-H996 VanDerWaalsContact O-N 3.08Å; T993-H996 PolarHBondContact OG1-CD2 3.23Å; T993-H996 VanDerWaalsContact OG1-CG 3.24Å; T993-H996 PolarHBondContact OG1-N 3.03Å; T993-H996 PolarHBondContact OG1-NE2 3.38Å; T993-T997 PolarHBondContact O-N 2.86Å
994	Y	80.9	Confident	80.5	Confident	44 Å²	44	38.1 Å²	38.1	17%	0.173	19%	0.188	C	C	.	.	H	α-helix	trans	-58.3	-36.8	173.2	173.9	-99.2	0	0	0	112.2	H996 T997 R998 T1020 N1024 H1026 D1030	Y994-H996 PolarHBondContact O-N 3.25Å; Y994-T997 CarbonylContact O-C 3.54Å; Y994-T997 WeakPolarHBondContact O-CB 3.38Å; Y994-T997 PolarHBondContact O-N 2.73Å; Y994-T997 VanDerWaalsContact O-N 3.12Å; Y994-R998 HydrophobicContact CE1-CB 4.48Å; Y994-R998 PolarHBondContact O-N 2.83Å; Y994-T1020 HydrophobicContact CD2-CG2 4.17Å; Y994-T1020 HydrophobicContact CE2-CG2 3.96Å; Y994-N1024 VanDerWaalsContact CD2-ND2 3.27Å; Y994-N1024 WeakPolarHBondContact CD2-ND2 3.36Å; Y994-H1026 AromaticContact CD1-CD2 3.56Å; Y994-H1026 HydrophobicContact CE1-CB 3.73Å; Y994-H1026 AromaticContact CE1-CD2 3.28Å; Y994-H1026 WeakPolarHBondContact CE1-CD2 3.47Å; Y994-H1026 AromaticContact CE1-CG 3.6Å; Y994-H1026 HydrophobicContact CE2-CB 4.01Å; Y994-H1026 VanDerWaalsContact CZ-CB 3.42Å; Y994-H1026 AromaticContact CZ-CD2 3.95Å; Y994-H1026 AromaticContact CZ-CG 3.86Å; Y994-H1026 VanDerWaalsContact OH-CB 3.31Å; Y994-H1026 WeakPolarHBondContact OH-CB 3.45Å; Y994-D1030 WeakPolarHBondContact CE2-OD2 3.15Å; Y994-D1030 PolarHBondContact OH-OD1 3.35Å; Y994-D1030 PolarHBondContact OH-OD2 2.8Å
995	D	79.2	Confident	80.6	Confident	97 Å²	97	38.7 Å²	38.7	52%	0.519	19%	0.191	S	C	.	.	H	α-helix	trans	-61	-33.1	175.5	-73.7	-26.2	0	0	0	112.8	T993 R998 K999	T993-D995 PolarHBondContact O-N 3.19Å; D995-R998 PolarHBondContact O-N 2.78Å; D995-K999 WeakPolarHBondContact O-CG 3.48Å; D995-K999 PolarHBondContact O-N 3.35Å
996	H	78.3	Confident	80.7	Confident	13 Å²	13	36.4 Å²	36.4	6%	0.06	18%	0.179	C	C	.	.	H	α-helix	trans	-69.8	-44.7	174.8	-63.6	-172.2	0	0	0	110	V275 Q277 R991 T993 Y994 R998 K999 C1000	V275-H996 HydrophobicContact CG1-CB 4.08Å; V275-H996 WeakPolarHBondContact CG1-ND1 3.36Å; V275-H996 PolarHBondContact O-NE2 2.98Å; Q277-H996 PolarHBondContact OE1-CE1 2.79Å; Q277-H996 VanDerWaalsContact OE1-CE1 3.29Å; Q277-H996 PolarHBondContact OE1-ND1 3.4Å; Q277-H996 VanDerWaalsContact OE1-ND1 3.08Å; R991-H996 HydrophobicContact CB-CB 4.25Å; T993-H996 WeakPolarHBondContact O-CB 3.27Å; T993-H996 PolarHBondContact O-N 2.89Å; T993-H996 VanDerWaalsContact O-N 3.08Å; T993-H996 PolarHBondContact OG1-CD2 3.23Å; T993-H996 VanDerWaalsContact OG1-CG 3.24Å; T993-H996 PolarHBondContact OG1-N 3.03Å; T993-H996 PolarHBondContact OG1-NE2 3.38Å; Y994-H996 PolarHBondContact O-N 3.25Å; H996-R998 VanDerWaalsContact C-N 3.28Å; H996-R998 PolarHBondContact O-N 3.32Å; H996-K999 PolarHBondContact O-N 3.24Å; H996-C1000 PolarHBondContact O-N 3.01Å; H996-C1000 PolarHBondContact O-SG 3.05Å
997	T	82.3	Confident	81	Confident	18 Å²	18	36 Å²	36	11%	0.11	18%	0.177	C	C	.	.	H	α-helix	trans	-56.6	-44.9	173.5	-53.4	0	0	0	0	110.7	T993 Y994 C1000 T1001 L1016	T993-T997 PolarHBondContact O-N 2.86Å; Y994-T997 CarbonylContact O-C 3.54Å; Y994-T997 WeakPolarHBondContact O-CB 3.38Å; Y994-T997 PolarHBondContact O-N 2.73Å; Y994-T997 VanDerWaalsContact O-N 3.12Å; T997-C1000 PolarHBondContact O-N 3.31Å; T997-T1001 HydrophobicContact CG2-CG2 4.42Å; T997-T1001 WeakPolarHBondContact O-CB 3.34Å; T997-T1001 VanDerWaalsContact O-CG2 3.28Å; T997-T1001 WeakPolarHBondContact O-CG2 3.46Å; T997-T1001 PolarHBondContact O-N 3.45Å; T997-T1001 PolarHBondContact O-OG1 3.45Å; T997-L1016 HydrophobicContact CG2-CB 4.43Å
998	R	83.4	Confident	81	Confident	86 Å²	86	36.9 Å²	36.9	33%	0.325	19%	0.187	S	C	.	.	H	α-helix	trans	-60.4	-45.6	175.9	-177.2	-176.4	170.2	174.9	4.9	112.6	Y994 D995 H996 T1001 D1002 E1065	Y994-R998 HydrophobicContact CE1-CB 4.48Å; Y994-R998 PolarHBondContact O-N 2.83Å; D995-R998 PolarHBondContact O-N 2.78Å; H996-R998 VanDerWaalsContact C-N 3.28Å; H996-R998 PolarHBondContact O-N 3.32Å; R998-T1001 WeakPolarHBondContact CA-OG1 3.12Å; R998-T1001 PolarHBondContact O-N 3.2Å; R998-T1001 PolarHBondContact O-OG1 3.31Å; R998-D1002 IonicContact NE-OD2 3.52Å; R998-D1002 WeakPolarHBondContact O-CB 3.31Å; R998-D1002 PolarHBondContact O-N 2.99Å; R998-E1065 IonicContact NH2-OE1 2.71Å; R998-E1065 PolarHBondContact NH2-OE1 2.75Å
999	K	83.5	Confident	81.2	Confident	78 Å²	78	40 Å²	40	34%	0.339	20%	0.201	S	C	.	.	H	α-helix	trans	-65.7	-43.4	178.5	-75.6	176.8	178.3	-178.1	0	112.1	E274 D995 H996 D1002 Q1003	E274-K999 PolarHBondContact O-NZ 2.99Å; D995-K999 WeakPolarHBondContact O-CG 3.48Å; D995-K999 PolarHBondContact O-N 3.35Å; H996-K999 PolarHBondContact O-N 3.24Å; K999-D1002 PolarHBondContact O-N 3.29Å; K999-Q1003 WeakPolarHBondContact O-CG 3.22Å; K999-Q1003 PolarHBondContact O-N 2.79Å
1000	C	84.6	Confident	81.6	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-63.3	-43.8	176.6	-66.2	0	0	0	0	111	H996 T997 Q1003 L1004	H996-C1000 PolarHBondContact O-N 3.01Å; H996-C1000 PolarHBondContact O-SG 3.05Å; T997-C1000 PolarHBondContact O-N 3.31Å; C1000-Q1003 PolarHBondContact O-N 2.86Å; C1000-L1004 WeakPolarHBondContact O-CB 3.21Å; C1000-L1004 WeakPolarHBondContact O-CG 3.42Å; C1000-L1004 PolarHBondContact O-N 2.87Å
1001	T	84.3	Confident	82.1	Confident	3 Å²	3	42.7 Å²	42.7	2%	0.018	22%	0.217	C	C	.	.	H	α-helix	trans	-63.1	-43.8	175.9	53.2	0	0	0	0	111.5	T997 R998 Q1003 L1004 L1005 L1016 L1017	T997-T1001 HydrophobicContact CG2-CG2 4.42Å; T997-T1001 WeakPolarHBondContact O-CB 3.34Å; T997-T1001 VanDerWaalsContact O-CG2 3.28Å; T997-T1001 WeakPolarHBondContact O-CG2 3.46Å; T997-T1001 PolarHBondContact O-N 3.45Å; T997-T1001 PolarHBondContact O-OG1 3.45Å; R998-T1001 WeakPolarHBondContact CA-OG1 3.12Å; R998-T1001 PolarHBondContact O-N 3.2Å; R998-T1001 PolarHBondContact O-OG1 3.31Å; T1001-Q1003 VanDerWaalsContact C-N 3.32Å; T1001-Q1003 PolarHBondContact O-N 2.78Å; T1001-L1004 PolarHBondContact O-N 3.44Å; T1001-L1005 WeakPolarHBondContact O-CB 3.28Å; T1001-L1005 VanDerWaalsContact O-CG 3.23Å; T1001-L1005 WeakPolarHBondContact O-CG 3.47Å; T1001-L1005 PolarHBondContact O-N 3.23Å; T1001-L1016 HydrophobicContact CG2-CB 3.47Å; T1001-L1016 VanDerWaalsContact CG2-CB 3.47Å; T1001-L1016 HydrophobicContact CG2-CD1 4.04Å; T1001-L1016 HydrophobicContact CG2-CG 4.44Å; T1001-L1017 HydrophobicContact CG2-CD2 4.16Å; T1001-L1017 HydrophobicContact CG2-CG 4.08Å
1002	D	84.8	Confident	82.6	Confident	37 Å²	37	42.6 Å²	42.6	20%	0.198	22%	0.217	C	C	.	.	H	α-helix	trans	-58.2	-43.5	175.6	-70.5	-16.4	0	0	0	111.3	R998 K999 L1005 L1006 Q1068	R998-D1002 IonicContact NE-OD2 3.52Å; R998-D1002 WeakPolarHBondContact O-CB 3.31Å; R998-D1002 PolarHBondContact O-N 2.99Å; K999-D1002 PolarHBondContact O-N 3.29Å; D1002-L1005 PolarHBondContact O-N 2.82Å; D1002-L1006 VanDerWaalsContact O-CG 3.32Å; D1002-L1006 WeakPolarHBondContact O-CG 3.29Å; D1002-L1006 PolarHBondContact O-N 2.88Å; D1002-L1006 VanDerWaalsContact O-N 3.15Å; D1002-Q1068 PolarHBondContact OD1-NE2 3.36Å; D1002-Q1068 PolarHBondContact OD1-OE1 3.09Å
1003	Q	85.1	Confident	83.2	Confident	26 Å²	26	40.5 Å²	40.5	12%	0.121	20%	0.202	C	C	.	.	H	α-helix	trans	-69	-42.3	177.3	-69.5	-170.4	17.6	0	0	113.2	E274 V984 K999 C1000 T1001 L1005 L1006 L1007	E274-Q1003 PolarHBondContact OE2-NE2 3.31Å; E274-Q1003 PolarHBondContact OE2-OE1 3.49Å; V984-Q1003 HydrophobicContact CG2-CB 3.85Å; K999-Q1003 WeakPolarHBondContact O-CG 3.22Å; K999-Q1003 PolarHBondContact O-N 2.79Å; C1000-Q1003 PolarHBondContact O-N 2.86Å; T1001-Q1003 VanDerWaalsContact C-N 3.32Å; T1001-Q1003 PolarHBondContact O-N 2.78Å; Q1003-L1005 VanDerWaalsContact C-N 3.28Å; Q1003-L1005 PolarHBondContact O-N 2.89Å; Q1003-L1006 PolarHBondContact O-N 3.27Å; Q1003-L1006 VanDerWaalsContact O-N 3.17Å; Q1003-L1007 WeakPolarHBondContact O-CB 3.16Å; Q1003-L1007 WeakPolarHBondContact O-CD1 3.06Å; Q1003-L1007 WeakPolarHBondContact O-CG 3.08Å; Q1003-L1007 PolarHBondContact O-N 3.15Å
1004	L	85.9	Confident	83.6	Confident	2 Å²	2	39 Å²	39	1%	0.01	19%	0.193	C	C	.	.	H	α-helix	trans	-60.6	-39.1	175.6	-73.8	171.4	0	0	0	111.8	V984 C1000 T1001 L1007 G1008 Q1009 R1012 A1013 L1016	V984-L1004 HydrophobicContact CB-CD2 4.48Å; V984-L1004 HydrophobicContact CG1-CD1 4.46Å; V984-L1004 HydrophobicContact CG1-CD2 3.53Å; V984-L1004 HydrophobicContact CG1-CG 3.65Å; C1000-L1004 WeakPolarHBondContact O-CB 3.21Å; C1000-L1004 WeakPolarHBondContact O-CG 3.42Å; C1000-L1004 PolarHBondContact O-N 2.87Å; T1001-L1004 PolarHBondContact O-N 3.44Å; L1004-L1007 CarbonylContact O-C 3.56Å; L1004-L1007 PolarHBondContact O-N 3Å; L1004-G1008 PolarHBondContact O-N 2.93Å; L1004-Q1009 HydrophobicContact CB-CB 4.36Å; L1004-Q1009 HydrophobicContact CD2-CB 3.96Å; L1004-Q1009 HydrophobicContact CD2-CG 4.42Å; L1004-Q1009 PolarHBondContact O-N 2.87Å; L1004-R1012 HydrophobicContact CD1-CB 4.3Å; L1004-R1012 HydrophobicContact CD1-CG 3.97Å; L1004-A1013 HydrophobicContact CB-CB 3.96Å; L1004-L1016 HydrophobicContact CD1-CD1 3.49Å; L1004-L1016 VanDerWaalsContact CD1-CD1 3.49Å
1005	L	85.9	Confident	83.8	Confident	12 Å²	12	41.4 Å²	41.4	6%	0.063	21%	0.206	C	C	.	.	H	α-helix	trans	-64.9	-39.6	175.4	-70.4	175.3	0	0	0	111.9	T1001 D1002 Q1003 G1008 T1010 A1013 V1037 Q1068 L1072	T1001-L1005 WeakPolarHBondContact O-CB 3.28Å; T1001-L1005 VanDerWaalsContact O-CG 3.23Å; T1001-L1005 WeakPolarHBondContact O-CG 3.47Å; T1001-L1005 PolarHBondContact O-N 3.23Å; D1002-L1005 PolarHBondContact O-N 2.82Å; Q1003-L1005 VanDerWaalsContact C-N 3.28Å; Q1003-L1005 PolarHBondContact O-N 2.89Å; L1005-G1008 PolarHBondContact O-N 2.82Å; L1005-T1010 HydrophobicContact CD2-CG2 4.31Å; L1005-A1013 HydrophobicContact CD2-CB 3.48Å; L1005-A1013 VanDerWaalsContact CD2-CB 3.48Å; L1005-A1013 HydrophobicContact CG-CB 3.7Å; L1005-V1037 HydrophobicContact CD1-CG2 4.37Å; L1005-V1037 HydrophobicContact CD2-CG1 3.95Å; L1005-V1037 HydrophobicContact CD2-CG2 4.1Å; L1005-Q1068 HydrophobicContact CD1-CG 4.49Å; L1005-L1072 HydrophobicContact CD2-CD2 3.99Å
1006	L	85.1	Confident	84	Confident	18 Å²	18	36.8 Å²	36.8	9%	0.094	18%	0.181	C	C	.	.	H	α-helix	trans	-68.5	-34.5	174.1	-65.1	172.2	0	0	0	112.4	D1002 Q1003 G1008 V1067 C1071 W1094 L1095	D1002-L1006 VanDerWaalsContact O-CG 3.32Å; D1002-L1006 WeakPolarHBondContact O-CG 3.29Å; D1002-L1006 PolarHBondContact O-N 2.88Å; D1002-L1006 VanDerWaalsContact O-N 3.15Å; Q1003-L1006 PolarHBondContact O-N 3.27Å; Q1003-L1006 VanDerWaalsContact O-N 3.17Å; L1006-G1008 VanDerWaalsContact C-N 3.27Å; L1006-G1008 PolarHBondContact O-N 3.49Å; L1006-V1067 HydrophobicContact CD2-CG1 4.46Å; L1006-C1071 HydrophobicContact CD2-CB 4.25Å; L1006-W1094 HydrophobicContact CB-CH2 4.2Å; L1006-W1094 HydrophobicContact CB-CZ3 4.07Å; L1006-W1094 HydrophobicContact CD1-CH2 4.47Å; L1006-W1094 HydrophobicContact CD1-CZ3 4.04Å; L1006-L1095 HydrophobicContact CB-CD1 4.41Å; L1006-L1095 HydrophobicContact CD2-CD1 3.98Å
1007	L	84.5	Confident	84.3	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-75.6	-12.7	176.4	-74.1	159.2	0	0	0	113.6	Q977 Q980 L981 V984 Q1003 L1004 V1098	Q977-L1007 HydrophobicContact CG-CD2 4.32Å; Q977-L1007 PolarHBondContact NE2-O 3.47Å; Q980-L1007 HydrophobicContact CB-CD2 3.63Å; L981-L1007 HydrophobicContact CD2-CB 3.96Å; L981-L1007 HydrophobicContact CD2-CD1 3.98Å; L981-L1007 HydrophobicContact CD2-CD2 4.45Å; L981-L1007 HydrophobicContact CD2-CG 4.36Å; L981-L1007 HydrophobicContact CG-CD1 4.42Å; L981-L1007 HydrophobicContact CG-CD2 4.26Å; V984-L1007 HydrophobicContact CB-CD1 4.21Å; V984-L1007 HydrophobicContact CG2-CD1 3.54Å; Q1003-L1007 WeakPolarHBondContact O-CB 3.16Å; Q1003-L1007 WeakPolarHBondContact O-CD1 3.06Å; Q1003-L1007 WeakPolarHBondContact O-CG 3.08Å; Q1003-L1007 PolarHBondContact O-N 3.15Å; L1004-L1007 CarbonylContact O-C 3.56Å; L1004-L1007 PolarHBondContact O-N 3Å; L1007-V1098 HydrophobicContact CB-CG1 4.36Å; L1007-V1098 HydrophobicContact CD2-CB 4.4Å; L1007-V1098 HydrophobicContact CD2-CG1 3.35Å; L1007-V1098 HydrophobicContact CD2-CG2 4.15Å; L1007-V1098 HydrophobicContact CG-CG1 4Å
1008	G	80.7	Confident	84.4	Confident	21 Å²	21	40.5 Å²	40.5	22%	0.216	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.5	7.1	178.7	0	0	0	0	0	116.2	L1004 L1005 L1006 T1010	L1004-G1008 PolarHBondContact O-N 2.93Å; L1005-G1008 PolarHBondContact O-N 2.82Å; L1006-G1008 VanDerWaalsContact C-N 3.27Å; L1006-G1008 PolarHBondContact O-N 3.49Å; G1008-T1010 VanDerWaalsContact C-N 3.29Å; G1008-T1010 PolarHBondContact O-N 3.08Å; G1008-T1010 VanDerWaalsContact O-N 3.12Å
1009	Q	84.6	Confident	84.3	Confident	86 Å²	86	40.6 Å²	40.6	40%	0.402	20%	0.204	S	C	.	.			trans	-86.6	68.2	177.9	-68.1	-68.6	-18.9	0	0	110.1	L981 L1004 D1011 A1013	L981-Q1009 HydrophobicContact CD2-CG 3.51Å; L1004-Q1009 HydrophobicContact CB-CB 4.36Å; L1004-Q1009 HydrophobicContact CD2-CB 3.96Å; L1004-Q1009 HydrophobicContact CD2-CG 4.42Å; L1004-Q1009 PolarHBondContact O-N 2.87Å; Q1009-D1011 VanDerWaalsContact C-N 3.33Å; Q1009-D1011 PolarHBondContact O-N 3.14Å; Q1009-A1013 WeakPolarHBondContact O-CB 3.32Å; Q1009-A1013 PolarHBondContact O-N 2.86Å; Q1009-A1013 VanDerWaalsContact O-N 3.13Å
1010	T	83.8	Confident	84.2	Confident	47 Å²	47	37.6 Å²	37.6	29%	0.288	19%	0.192	S	C	.	.	H	α-helix	trans	-63.3	-38.1	-175.6	49.8	0	0	0	0	112.6	L1005 G1008 A1013 V1014 V1037	L1005-T1010 HydrophobicContact CD2-CG2 4.31Å; G1008-T1010 VanDerWaalsContact C-N 3.29Å; G1008-T1010 PolarHBondContact O-N 3.08Å; G1008-T1010 VanDerWaalsContact O-N 3.12Å; T1010-A1013 PolarHBondContact O-N 3Å; T1010-V1014 WeakPolarHBondContact O-CB 3.43Å; T1010-V1014 VanDerWaalsContact O-CG2 3.25Å; T1010-V1014 WeakPolarHBondContact O-CG2 3.3Å; T1010-V1014 PolarHBondContact O-N 3.02Å; T1010-V1037 HydrophobicContact CG2-CG1 4.06Å
1011	D	83.9	Confident	83.8	Confident	123 Å²	123	40.8 Å²	40.8	66%	0.658	22%	0.215	S	C	*	.	H	α-helix	trans	-66.3	-45.6	-175.9	-62.5	-15	0	0	0	111.6	Q1009 V1014 Q1015	Q1009-D1011 VanDerWaalsContact C-N 3.33Å; Q1009-D1011 PolarHBondContact O-N 3.14Å; D1011-V1014 PolarHBondContact O-N 2.88Å; D1011-Q1015 WeakPolarHBondContact O-CG 3.27Å; D1011-Q1015 PolarHBondContact O-N 2.99Å; D1011-Q1015 VanDerWaalsContact O-N 3.07Å
1012	R	85.2	Confident	83.4	Confident	90 Å²	90	44.1 Å²	44.1	34%	0.34	24%	0.242	S	C	.	.	H	α-helix	trans	-68	-38.6	176.2	-170.2	58.5	177.2	172.5	0.6	111.8	E988 L1004 V1014 Q1015 L1016	E988-R1012 IonicContact OE1-CZ 3.25Å; E988-R1012 IonicContact OE1-NE 2.93Å; E988-R1012 PolarHBondContact OE1-NE 2.88Å; E988-R1012 IonicContact OE1-NH2 2.79Å; E988-R1012 PolarHBondContact OE1-NH2 2.86Å; E988-R1012 IonicContact OE2-NE 3.5Å; L1004-R1012 HydrophobicContact CD1-CB 4.3Å; L1004-R1012 HydrophobicContact CD1-CG 3.97Å; R1012-V1014 VanDerWaalsContact C-N 3.33Å; R1012-V1014 PolarHBondContact O-N 2.65Å; R1012-Q1015 VanDerWaalsContact CD-OE1 3.3Å; R1012-Q1015 WeakPolarHBondContact O-CB 3.26Å; R1012-Q1015 PolarHBondContact O-N 3.41Å; R1012-L1016 PolarHBondContact O-N 3.03Å
1013	A	84.7	Confident	82.8	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-61.3	-40.9	175.2	0	0	0	0	0	112.3	L1004 L1005 Q1009 T1010 L1016 L1017	L1004-A1013 HydrophobicContact CB-CB 3.96Å; L1005-A1013 HydrophobicContact CD2-CB 3.48Å; L1005-A1013 VanDerWaalsContact CD2-CB 3.48Å; L1005-A1013 HydrophobicContact CG-CB 3.7Å; Q1009-A1013 WeakPolarHBondContact O-CB 3.32Å; Q1009-A1013 PolarHBondContact O-N 2.86Å; Q1009-A1013 VanDerWaalsContact O-N 3.13Å; T1010-A1013 PolarHBondContact O-N 3Å; A1013-L1016 PolarHBondContact O-N 2.98Å; A1013-L1017 WeakPolarHBondContact O-CG 3.27Å; A1013-L1017 PolarHBondContact O-N 2.92Å
1014	V	84.9	Confident	82.5	Confident	18 Å²	18	50.9 Å²	50.9	11%	0.109	28%	0.279	C	S	.	.	H	α-helix	trans	-64.4	-43.1	175.7	168.2	0	0	0	0	111.1	T1010 D1011 R1012 L1016 L1017 L1018 A1034 V1037 T1038	T1010-V1014 WeakPolarHBondContact O-CB 3.43Å; T1010-V1014 VanDerWaalsContact O-CG2 3.25Å; T1010-V1014 WeakPolarHBondContact O-CG2 3.3Å; T1010-V1014 PolarHBondContact O-N 3.02Å; D1011-V1014 PolarHBondContact O-N 2.88Å; R1012-V1014 VanDerWaalsContact C-N 3.33Å; R1012-V1014 PolarHBondContact O-N 2.65Å; V1014-L1016 VanDerWaalsContact C-N 3.35Å; V1014-L1016 PolarHBondContact O-N 3.32Å; V1014-L1017 PolarHBondContact O-N 2.7Å; V1014-L1018 HydrophobicContact CG1-CD1 3.95Å; V1014-L1018 HydrophobicContact CG1-CG 4.41Å; V1014-L1018 WeakPolarHBondContact O-CG 3.19Å; V1014-L1018 PolarHBondContact O-N 3.24Å; V1014-A1034 HydrophobicContact CG1-CB 4.24Å; V1014-V1037 HydrophobicContact CG2-CB 4.07Å; V1014-V1037 HydrophobicContact CG2-CG1 3.74Å; V1014-T1038 HydrophobicContact CG1-CG2 4.06Å; V1014-T1038 HydrophobicContact CG2-CG2 3.88Å
1015	Q	85.9	Confident	82.2	Confident	94 Å²	94	59.2 Å²	59.2	44%	0.439	32%	0.318	S	S	.	.	H	α-helix	trans	-56.7	-48.8	175.1	-71.4	171.1	2.4	0	0	111.3	D1011 R1012 L1017 L1018 E1019	D1011-Q1015 WeakPolarHBondContact O-CG 3.27Å; D1011-Q1015 PolarHBondContact O-N 2.99Å; D1011-Q1015 VanDerWaalsContact O-N 3.07Å; R1012-Q1015 VanDerWaalsContact CD-OE1 3.3Å; R1012-Q1015 WeakPolarHBondContact O-CB 3.26Å; R1012-Q1015 PolarHBondContact O-N 3.41Å; Q1015-L1017 VanDerWaalsContact C-N 3.33Å; Q1015-L1017 PolarHBondContact O-N 3.46Å; Q1015-L1018 PolarHBondContact O-N 3.28Å; Q1015-E1019 WeakPolarHBondContact O-CG 3.35Å; Q1015-E1019 PolarHBondContact O-N 3.08Å
1016	L	83.3	Confident	81.9	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-64.2	-34.1	178.5	-71.6	178.3	0	0	0	113.5	E988 T997 T1001 L1004 R1012 A1013 V1014	E988-L1016 HydrophobicContact CG-CD1 4.05Å; E988-L1016 HydrophobicContact CG-CD2 4.09Å; T997-L1016 HydrophobicContact CG2-CB 4.43Å; T1001-L1016 HydrophobicContact CG2-CB 3.47Å; T1001-L1016 VanDerWaalsContact CG2-CB 3.47Å; T1001-L1016 HydrophobicContact CG2-CD1 4.04Å; T1001-L1016 HydrophobicContact CG2-CG 4.44Å; L1004-L1016 HydrophobicContact CD1-CD1 3.49Å; L1004-L1016 VanDerWaalsContact CD1-CD1 3.49Å; R1012-L1016 PolarHBondContact O-N 3.03Å; A1013-L1016 PolarHBondContact O-N 2.98Å; V1014-L1016 VanDerWaalsContact C-N 3.35Å; V1014-L1016 PolarHBondContact O-N 3.32Å
1017	L	83.4	Confident	81.8	Confident	6 Å²	6	66 Å²	66	3%	0.031	35%	0.346	C	S	.	.	H	α-helix	trans	-66.4	-40	174.2	-71.9	170.7	0	0	0	111.5	T1001 A1013 V1014 Q1015 E1019 T1020 D1030 K1033 A1034	T1001-L1017 HydrophobicContact CG2-CD2 4.16Å; T1001-L1017 HydrophobicContact CG2-CG 4.08Å; A1013-L1017 WeakPolarHBondContact O-CG 3.27Å; A1013-L1017 PolarHBondContact O-N 2.92Å; V1014-L1017 PolarHBondContact O-N 2.7Å; Q1015-L1017 VanDerWaalsContact C-N 3.33Å; Q1015-L1017 PolarHBondContact O-N 3.46Å; L1017-E1019 VanDerWaalsContact C-N 3.34Å; L1017-T1020 WeakPolarHBondContact O-CB 3.24Å; L1017-T1020 PolarHBondContact O-N 2.79Å; L1017-T1020 PolarHBondContact O-OG1 3.26Å; L1017-D1030 HydrophobicContact CB-CB 4.35Å; L1017-D1030 HydrophobicContact CD2-CB 3.91Å; L1017-K1033 HydrophobicContact CD1-CB 4.15Å; L1017-A1034 HydrophobicContact CB-CB 4.14Å; L1017-A1034 HydrophobicContact CD1-CB 4.26Å
1018	L	84.4	Confident	81.7	Confident	102 Å²	102	73.9 Å²	73.9	53%	0.534	38%	0.376	S	S	.	.	H	α-helix	trans	-75	-19.4	179	-66.6	175.3	0	0	0	113.8	V1014 Q1015 T1020 A1034	V1014-L1018 HydrophobicContact CG1-CD1 3.95Å; V1014-L1018 HydrophobicContact CG1-CG 4.41Å; V1014-L1018 WeakPolarHBondContact O-CG 3.19Å; V1014-L1018 PolarHBondContact O-N 3.24Å; Q1015-L1018 PolarHBondContact O-N 3.28Å; L1018-T1020 PolarHBondContact O-N 3.44Å; L1018-A1034 HydrophobicContact CD2-CB 4.11Å; L1018-A1034 HydrophobicContact CG-CB 4.3Å
1019	E	82.8	Confident	81.7	Confident	88 Å²	88	76 Å²	76	41%	0.411	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-10.1	172.1	-76.2	178	-168.9	0	0	113.5	R991 Q1015 L1017 S1021	R991-E1019 IonicContact CZ-OE2 2.77Å; R991-E1019 IonicContact NH1-OE2 2.78Å; R991-E1019 PolarHBondContact NH1-OE2 2.93Å; R991-E1019 IonicContact NH2-OE1 3.92Å; R991-E1019 IonicContact NH2-OE2 3.6Å; R991-E1019 PolarHBondContact NH2-OE2 2.99Å; Q1015-E1019 WeakPolarHBondContact O-CG 3.35Å; Q1015-E1019 PolarHBondContact O-N 3.08Å; L1017-E1019 VanDerWaalsContact C-N 3.34Å; E1019-S1021 PolarHBondContact O-N 2.84Å
1020	T	81.3	Confident	81.7	Confident	15 Å²	15	72.1 Å²	72.1	9%	0.092	37%	0.369	C	S	.	.	S	Bend	trans	-62.6	128.6	175.9	-51.5	0	0	0	0	109.6	Y994 L1017 L1018 N1024 Y1027	Y994-T1020 HydrophobicContact CD2-CG2 4.17Å; Y994-T1020 HydrophobicContact CE2-CG2 3.96Å; L1017-T1020 WeakPolarHBondContact O-CB 3.24Å; L1017-T1020 PolarHBondContact O-N 2.79Å; L1017-T1020 PolarHBondContact O-OG1 3.26Å; L1018-T1020 PolarHBondContact O-N 3.44Å; T1020-N1024 HydrophobicContact CG2-CB 3.96Å; T1020-Y1027 WeakPolarHBondContact O-CD2 3.45Å; T1020-Y1027 WeakPolarHBondContact O-CE2 3.47Å
1021	S	76.3	Confident	81.6	Confident	68 Å²	68	71.1 Å²	71.1	48%	0.476	36%	0.364	S	S	.	.			trans	-67.6	145.8	179.9	59.8	0	0	0	0	112	E1019 D1023 N1024 Y1027	E1019-S1021 PolarHBondContact O-N 2.84Å; S1021-D1023 PolarHBondContact O-N 2.95Å; S1021-D1023 VanDerWaalsContact O-N 3.15Å; S1021-N1024 WeakPolarHBondContact O-CB 3.33Å; S1021-N1024 PolarHBondContact O-N 2.82Å; S1021-Y1027 WeakPolarHBondContact O-CB 3.39Å
1022	A	74.2	Confident	81.6	Confident	72 Å²	72	69.6 Å²	69.6	60%	0.595	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-23.9	178.5	0	0	0	0	0	113.7	N1024 Y1027	A1022-N1024 VanDerWaalsContact C-N 3.27Å; A1022-N1024 PolarHBondContact O-N 3.15Å; A1022-Y1027 HydrophobicContact CB-CD1 4.46Å; A1022-Y1027 HydrophobicContact CB-CE1 4.39Å
1023	D	73.3	Confident	81.3	Confident	159 Å²	159	68.6 Å²	68.6	85%	0.85	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-13.4	177.9	-57.3	-39.3	0	0	0	113.3	S1021	S1021-D1023 PolarHBondContact O-N 2.95Å; S1021-D1023 VanDerWaalsContact O-N 3.15Å
1024	N	79.1	Confident	81.3	Confident	46 Å²	46	68.8 Å²	68.8	25%	0.246	36%	0.355	C	S	.	.	S	Bend	trans	-80.5	134.9	179.9	-170.5	-9.4	0	0	0	110.8	Y994 T1020 S1021 A1022 H1026 Y1027	Y994-N1024 VanDerWaalsContact CD2-ND2 3.27Å; Y994-N1024 WeakPolarHBondContact CD2-ND2 3.36Å; T1020-N1024 HydrophobicContact CG2-CB 3.96Å; S1021-N1024 WeakPolarHBondContact O-CB 3.33Å; S1021-N1024 PolarHBondContact O-N 2.82Å; A1022-N1024 VanDerWaalsContact C-N 3.27Å; A1022-N1024 PolarHBondContact O-N 3.15Å; N1024-H1026 PolarHBondContact O-N 3.04Å; N1024-H1026 PolarHBondContact OD1-N 3.26Å; N1024-Y1027 VanDerWaalsContact O-CB 3.23Å; N1024-Y1027 WeakPolarHBondContact O-CB 3.42Å; N1024-Y1027 PolarHBondContact O-N 2.96Å
1025	Q	79.4	Confident	81.1	Confident	177 Å²	177	71.5 Å²	71.5	83%	0.827	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-26.1	179	-67.5	-177.4	2.1	0	0	113.3
1026	H	80.2	Confident	80.8	Confident	81 Å²	81	70 Å²	70	38%	0.375	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-5.9	-179.4	-59.2	-55.2	0	0	0	114.7	Y994 N1024 Y1028 C1029 D1030	Y994-H1026 AromaticContact CD1-CD2 3.56Å; Y994-H1026 HydrophobicContact CE1-CB 3.73Å; Y994-H1026 AromaticContact CE1-CD2 3.28Å; Y994-H1026 WeakPolarHBondContact CE1-CD2 3.47Å; Y994-H1026 AromaticContact CE1-CG 3.6Å; Y994-H1026 HydrophobicContact CE2-CB 4.01Å; Y994-H1026 VanDerWaalsContact CZ-CB 3.42Å; Y994-H1026 AromaticContact CZ-CD2 3.95Å; Y994-H1026 AromaticContact CZ-CG 3.86Å; Y994-H1026 VanDerWaalsContact OH-CB 3.31Å; Y994-H1026 WeakPolarHBondContact OH-CB 3.45Å; N1024-H1026 PolarHBondContact O-N 3.04Å; N1024-H1026 PolarHBondContact OD1-N 3.26Å; H1026-Y1028 VanDerWaalsContact C-N 3.3Å; H1026-Y1028 PolarHBondContact O-N 2.91Å; H1026-C1029 PolarHBondContact O-N 3.08Å; H1026-D1030 PolarHBondContact O-N 3.32Å
1027	Y	81.4	Confident	80.7	Confident	93 Å²	93	70.5 Å²	70.5	37%	0.365	37%	0.372	S	S	.	.	H	α-helix	trans	-52.7	-45.2	-178.1	175.9	-104.2	0	0	0	113.2	T1020 S1021 A1022 N1024 D1030 S1031	T1020-Y1027 WeakPolarHBondContact O-CD2 3.45Å; T1020-Y1027 WeakPolarHBondContact O-CE2 3.47Å; S1021-Y1027 WeakPolarHBondContact O-CB 3.39Å; A1022-Y1027 HydrophobicContact CB-CD1 4.46Å; A1022-Y1027 HydrophobicContact CB-CE1 4.39Å; N1024-Y1027 VanDerWaalsContact O-CB 3.23Å; N1024-Y1027 WeakPolarHBondContact O-CB 3.42Å; N1024-Y1027 PolarHBondContact O-N 2.96Å; Y1027-D1030 PolarHBondContact O-N 2.77Å; Y1027-S1031 VanDerWaalsContact O-CB 3.31Å; Y1027-S1031 WeakPolarHBondContact O-CB 3.13Å; Y1027-S1031 PolarHBondContact O-N 2.85Å; Y1027-S1031 PolarHBondContact O-OG 2.66Å
1028	Y	82.9	Confident	80.4	Confident	165 Å²	165	73.9 Å²	73.9	65%	0.647	39%	0.393	S	S	*	.	H	α-helix	trans	-64.1	-43.2	179.5	-176.1	-105.1	0	0	0	111.8	H1026 L1032	H1026-Y1028 VanDerWaalsContact C-N 3.3Å; H1026-Y1028 PolarHBondContact O-N 2.91Å; Y1028-L1032 HydrophobicContact CD1-CD1 3.91Å; Y1028-L1032 HydrophobicContact CE1-CD1 3.39Å; Y1028-L1032 HydrophobicContact CE1-CG 4.27Å; Y1028-L1032 WeakPolarHBondContact O-CG 3.46Å; Y1028-L1032 PolarHBondContact O-N 3.29Å
1029	C	81.9	Confident	79.9	Confident	67 Å²	67	72.7 Å²	72.7	45%	0.453	39%	0.39	S	S	.	.	H	α-helix	trans	-65.6	-40.2	177.6	-66.7	0	0	0	0	112.1	H1026 L1032 K1033	H1026-C1029 PolarHBondContact O-N 3.08Å; C1029-L1032 PolarHBondContact O-N 3.12Å; C1029-K1033 WeakPolarHBondContact O-CB 3.41Å; C1029-K1033 WeakPolarHBondContact O-CG 3.15Å; C1029-K1033 PolarHBondContact O-N 2.86Å
1030	D	82.8	Confident	79.2	Confident	3 Å²	3	68.7 Å²	68.7	2%	0.016	37%	0.372	C	S	.	.	H	α-helix	trans	-73.1	-36.1	179.6	-66.6	-30.9	0	0	0	112.7	Y994 L1017 H1026 Y1027 L1032 K1033 A1034	Y994-D1030 WeakPolarHBondContact CE2-OD2 3.15Å; Y994-D1030 PolarHBondContact OH-OD1 3.35Å; Y994-D1030 PolarHBondContact OH-OD2 2.8Å; L1017-D1030 HydrophobicContact CB-CB 4.35Å; L1017-D1030 HydrophobicContact CD2-CB 3.91Å; H1026-D1030 PolarHBondContact O-N 3.32Å; Y1027-D1030 PolarHBondContact O-N 2.77Å; D1030-L1032 VanDerWaalsContact C-N 3.32Å; D1030-L1032 PolarHBondContact O-N 2.92Å; D1030-K1033 PolarHBondContact O-N 2.79Å; D1030-A1034 WeakPolarHBondContact O-CB 3.41Å; D1030-A1034 PolarHBondContact O-N 2.86Å
1031	S	82.8	Confident	78.3	Confident	26 Å²	26	73.7 Å²	73.7	18%	0.182	40%	0.402	C	S	.	.	H	α-helix	trans	-60.7	-44.4	171.3	-60.7	0	0	0	0	110.7	Y1027 A1034 C1035	Y1027-S1031 VanDerWaalsContact O-CB 3.31Å; Y1027-S1031 WeakPolarHBondContact O-CB 3.13Å; Y1027-S1031 PolarHBondContact O-N 2.85Å; Y1027-S1031 PolarHBondContact O-OG 2.66Å; S1031-A1034 PolarHBondContact O-N 3.04Å; S1031-C1035 WeakPolarHBondContact O-CB 3.43Å; S1031-C1035 PolarHBondContact O-N 3.33Å; S1031-C1035 PolarHBondContact O-SG 3.45Å
1032	L	82.8	Confident	77.5	Confident	91 Å²	91	75 Å²	75	48%	0.476	41%	0.411	S	S	.	.	H	α-helix	trans	-65.7	-39.4	174.7	-73.4	178	0	0	0	112.4	Y1028 C1029 D1030 C1035 L1036	Y1028-L1032 HydrophobicContact CD1-CD1 3.91Å; Y1028-L1032 HydrophobicContact CE1-CD1 3.39Å; Y1028-L1032 HydrophobicContact CE1-CG 4.27Å; Y1028-L1032 WeakPolarHBondContact O-CG 3.46Å; Y1028-L1032 PolarHBondContact O-N 3.29Å; C1029-L1032 PolarHBondContact O-N 3.12Å; D1030-L1032 VanDerWaalsContact C-N 3.32Å; D1030-L1032 PolarHBondContact O-N 2.92Å; L1032-C1035 PolarHBondContact O-N 3.25Å; L1032-L1036 WeakPolarHBondContact O-CB 3.08Å; L1032-L1036 PolarHBondContact O-N 2.98Å
1033	K	80.7	Confident	77.2	Confident	70 Å²	70	74.1 Å²	74.1	30%	0.304	40%	0.401	S	S	.	.	H	α-helix	trans	-64.1	-42.1	174.1	-78.3	179.2	178.3	-178	0	111.8	L1017 C1029 D1030 L1036 V1037	L1017-K1033 HydrophobicContact CD1-CB 4.15Å; C1029-K1033 WeakPolarHBondContact O-CB 3.41Å; C1029-K1033 WeakPolarHBondContact O-CG 3.15Å; C1029-K1033 PolarHBondContact O-N 2.86Å; D1030-K1033 PolarHBondContact O-N 2.79Å; K1033-L1036 WeakPolarHBondContact O-CB 3.23Å; K1033-L1036 PolarHBondContact O-N 2.86Å; K1033-V1037 VanDerWaalsContact O-CG2 3.27Å; K1033-V1037 WeakPolarHBondContact O-CG2 3.48Å; K1033-V1037 PolarHBondContact O-N 3.06Å
1034	A	82.6	Confident	77.2	Confident	4 Å²	4	68.7 Å²	68.7	3%	0.033	38%	0.382	C	S	.	.	H	α-helix	trans	-62	-43.9	175.7	0	0	0	0	0	111.3	V1014 L1017 L1018 D1030 S1031 L1036 V1037 T1038	V1014-A1034 HydrophobicContact CG1-CB 4.24Å; L1017-A1034 HydrophobicContact CB-CB 4.14Å; L1017-A1034 HydrophobicContact CD1-CB 4.26Å; L1018-A1034 HydrophobicContact CD2-CB 4.11Å; L1018-A1034 HydrophobicContact CG-CB 4.3Å; D1030-A1034 WeakPolarHBondContact O-CB 3.41Å; D1030-A1034 PolarHBondContact O-N 2.86Å; S1031-A1034 PolarHBondContact O-N 3.04Å; A1034-L1036 VanDerWaalsContact C-N 3.35Å; A1034-L1036 PolarHBondContact O-N 2.86Å; A1034-V1037 PolarHBondContact O-N 3.38Å; A1034-T1038 WeakPolarHBondContact O-CB 3.49Å; A1034-T1038 WeakPolarHBondContact O-CG2 3.37Å; A1034-T1038 PolarHBondContact O-N 2.95Å; A1034-T1038 PolarHBondContact O-OG1 3.37Å
1035	C	81.9	Confident	77	Confident	74 Å²	74	71.2 Å²	71.2	50%	0.5	40%	0.401	S	S	.	.	H	α-helix	trans	-62	-40.3	172.1	-70.8	0	0	0	0	112.1	S1031 L1032 T1038 T1039	S1031-C1035 WeakPolarHBondContact O-CB 3.43Å; S1031-C1035 PolarHBondContact O-N 3.33Å; S1031-C1035 PolarHBondContact O-SG 3.45Å; L1032-C1035 PolarHBondContact O-N 3.25Å; C1035-T1038 WeakPolarHBondContact CA-OG1 3.24Å; C1035-T1038 PolarHBondContact O-OG1 3.3Å; C1035-T1039 WeakPolarHBondContact O-CB 3.35Å; C1035-T1039 WeakPolarHBondContact O-CG2 3.45Å; C1035-T1039 PolarHBondContact O-N 2.89Å; C1035-T1039 PolarHBondContact O-OG1 2.97Å
1036	L	80.1	Confident	76.7	Confident	63 Å²	63	64.3 Å²	64.3	33%	0.33	37%	0.373	S	S	.	.	H	α-helix	trans	-64.3	-52.1	176.6	-175.7	68.4	0	0	0	110.6	L1032 K1033 A1034 T1038 T1039 V1040 I1050 L1069	L1032-L1036 WeakPolarHBondContact O-CB 3.08Å; L1032-L1036 PolarHBondContact O-N 2.98Å; K1033-L1036 WeakPolarHBondContact O-CB 3.23Å; K1033-L1036 PolarHBondContact O-N 2.86Å; A1034-L1036 VanDerWaalsContact C-N 3.35Å; A1034-L1036 PolarHBondContact O-N 2.86Å; L1036-T1038 VanDerWaalsContact C-N 3.26Å; L1036-T1038 PolarHBondContact O-N 2.82Å; L1036-T1039 PolarHBondContact O-N 2.8Å; L1036-T1039 VanDerWaalsContact O-N 3.11Å; L1036-T1039 PolarHBondContact O-OG1 3.06Å; L1036-T1039 VanDerWaalsContact O-OG1 3.1Å; L1036-V1040 HydrophobicContact CD1-CG2 3.77Å; L1036-V1040 HydrophobicContact CG-CG2 3.95Å; L1036-V1040 WeakPolarHBondContact O-CB 3.4Å; L1036-V1040 WeakPolarHBondContact O-CG2 3.48Å; L1036-V1040 PolarHBondContact O-N 2.86Å; L1036-I1050 HydrophobicContact CD1-CD1 4.1Å; L1036-L1069 HydrophobicContact CD2-CD2 4.07Å
1037	V	79.9	Confident	76.7	Confident	10 Å²	10	63.7 Å²	63.7	6%	0.061	37%	0.37	C	S	.	.	H	α-helix	trans	-57.3	-40	-179.3	172.9	0	0	0	0	111.6	L1005 T1010 V1014 K1033 A1034 L1072	L1005-V1037 HydrophobicContact CD1-CG2 4.37Å; L1005-V1037 HydrophobicContact CD2-CG1 3.95Å; L1005-V1037 HydrophobicContact CD2-CG2 4.1Å; T1010-V1037 HydrophobicContact CG2-CG1 4.06Å; V1014-V1037 HydrophobicContact CG2-CB 4.07Å; V1014-V1037 HydrophobicContact CG2-CG1 3.74Å; K1033-V1037 VanDerWaalsContact O-CG2 3.27Å; K1033-V1037 WeakPolarHBondContact O-CG2 3.48Å; K1033-V1037 PolarHBondContact O-N 3.06Å; A1034-V1037 PolarHBondContact O-N 3.38Å; V1037-L1072 HydrophobicContact CG1-CD2 4.26Å; V1037-L1072 HydrophobicContact CG2-CD1 3.99Å; V1037-L1072 HydrophobicContact CG2-CD2 4.01Å
1038	T	76.7	Confident	76.8	Confident	78 Å²	78	63.3 Å²	63.3	48%	0.479	38%	0.381	S	S	.	.	H	α-helix	trans	-73.8	-29.6	178.5	49.9	0	0	0	0	113.9	V1014 A1034 C1035 L1036 T1041	V1014-T1038 HydrophobicContact CG1-CG2 4.06Å; V1014-T1038 HydrophobicContact CG2-CG2 3.88Å; A1034-T1038 WeakPolarHBondContact O-CB 3.49Å; A1034-T1038 WeakPolarHBondContact O-CG2 3.37Å; A1034-T1038 PolarHBondContact O-N 2.95Å; A1034-T1038 PolarHBondContact O-OG1 3.37Å; C1035-T1038 WeakPolarHBondContact CA-OG1 3.24Å; C1035-T1038 PolarHBondContact O-OG1 3.3Å; L1036-T1038 VanDerWaalsContact C-N 3.26Å; L1036-T1038 PolarHBondContact O-N 2.82Å; T1038-T1041 PolarHBondContact O-OG1 2.92Å
1039	T	75	Confident	76.8	Confident	77 Å²	77	59.7 Å²	59.7	47%	0.472	38%	0.376	S	S	.	.	H	α-helix	trans	-89.1	-26.1	-175.8	52.2	0	0	0	0	114.2	C1035 L1036 T1041 S1042	C1035-T1039 WeakPolarHBondContact O-CB 3.35Å; C1035-T1039 WeakPolarHBondContact O-CG2 3.45Å; C1035-T1039 PolarHBondContact O-N 2.89Å; C1035-T1039 PolarHBondContact O-OG1 2.97Å; L1036-T1039 PolarHBondContact O-N 2.8Å; L1036-T1039 VanDerWaalsContact O-N 3.11Å; L1036-T1039 PolarHBondContact O-OG1 3.06Å; L1036-T1039 VanDerWaalsContact O-OG1 3.1Å; T1039-T1041 PolarHBondContact O-N 2.99Å; T1039-T1041 VanDerWaalsContact O-N 3.13Å; T1039-S1042 PolarHBondContact O-N 2.85Å; T1039-S1042 PolarHBondContact O-OG 2.79Å
1040	V	68.4	Low	76.9	Confident	4 Å²	4	57.4 Å²	57.4	2%	0.024	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-20.3	-172.8	165.2	0	0	0	0	114.3	L1036 S1042 I1050 I1073	L1036-V1040 HydrophobicContact CD1-CG2 3.77Å; L1036-V1040 HydrophobicContact CG-CG2 3.95Å; L1036-V1040 WeakPolarHBondContact O-CB 3.4Å; L1036-V1040 WeakPolarHBondContact O-CG2 3.48Å; L1036-V1040 PolarHBondContact O-N 2.86Å; V1040-S1042 PolarHBondContact O-N 2.81Å; V1040-I1050 HydrophobicContact CB-CD1 4.46Å; V1040-I1050 HydrophobicContact CG1-CD1 4.28Å; V1040-I1050 HydrophobicContact CG2-CD1 3.34Å; V1040-I1073 HydrophobicContact CG1-CG2 3.8Å
1041	T	62.8	Low	77	Confident	119 Å²	119	60.8 Å²	60.8	73%	0.73	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-4.5	179	55.2	0	0	0	0	114	T1038 T1039	T1038-T1041 PolarHBondContact O-OG1 2.92Å; T1039-T1041 PolarHBondContact O-N 2.99Å; T1039-T1041 VanDerWaalsContact O-N 3.13Å
1042	S	58.1	Low	77.2	Confident	95 Å²	95	65.2 Å²	65.2	66%	0.664	39%	0.394	S	S	*	.	S	Bend	trans	-115	-18.9	-163.1	69	0	0	0	0	118.1	T1039 V1040	T1039-S1042 PolarHBondContact O-N 2.85Å; T1039-S1042 PolarHBondContact O-OG 2.79Å; V1040-S1042 PolarHBondContact O-N 2.81Å
1043	S	67.5	Low	77.4	Confident	54 Å²	54	64.1 Å²	64.1	38%	0.378	39%	0.392	S	S	.	.			trans	-145.3	130.8	-175.6	75.6	0	0	0	0	116.8	S1046 Q1047	S1043-S1046 PolarHBondContact O-N 3.01Å; S1043-S1046 PolarHBondContact O-OG 3.01Å; S1043-S1046 WeakPolarHBondContact OG-CB 3.1Å; S1043-S1046 PolarHBondContact OG-OG 2.77Å; S1043-Q1047 PolarHBondContact O-N 3.47Å
1044	G	73.1	Confident	77.7	Confident	45 Å²	45	60.8 Å²	60.8	46%	0.464	38%	0.377	S	S	.	.	H	α-helix	trans	-61.3	-39.3	-178.5	0	0	0	0	0	116.9	S1046 Q1047 S1048	G1044-S1046 VanDerWaalsContact C-N 3.31Å; G1044-S1046 PolarHBondContact O-N 2.88Å; G1044-Q1047 PolarHBondContact O-N 2.8Å; G1044-S1048 PolarHBondContact O-N 3.46Å; G1044-S1048 PolarHBondContact O-OG 3.11Å
1045	P	75.8	Confident	78	Confident	99 Å²	99	62.5 Å²	62.5	64%	0.643	39%	0.387	S	S	*	.	H	α-helix	trans	-63.1	-35.2	175.9	-25	35.2	0	0	0	113.2	S1048 T1049	P1045-S1048 PolarHBondContact O-N 2.78Å; P1045-T1049 PolarHBondContact O-N 3.48Å; P1045-T1049 PolarHBondContact O-OG1 2.88Å
1046	S	74	Confident	78.5	Confident	33 Å²	33	63.2 Å²	63.2	23%	0.231	39%	0.386	C	S	.	.	H	α-helix	trans	-66.4	-38.8	178.6	73.3	0	0	0	0	112.3	S1043 G1044 S1048 T1049 I1050	S1043-S1046 PolarHBondContact O-N 3.01Å; S1043-S1046 PolarHBondContact O-OG 3.01Å; S1043-S1046 WeakPolarHBondContact OG-CB 3.1Å; S1043-S1046 PolarHBondContact OG-OG 2.77Å; G1044-S1046 VanDerWaalsContact C-N 3.31Å; G1044-S1046 PolarHBondContact O-N 2.88Å; S1046-S1048 VanDerWaalsContact C-N 3.29Å; S1046-S1048 PolarHBondContact O-N 2.82Å; S1046-T1049 PolarHBondContact O-N 3.21Å; S1046-I1050 WeakPolarHBondContact O-CD1 3.37Å; S1046-I1050 VanDerWaalsContact O-CG1 3.27Å; S1046-I1050 WeakPolarHBondContact O-CG1 3.49Å; S1046-I1050 PolarHBondContact O-N 3.22Å
1047	Q	80.3	Confident	78.9	Confident	68 Å²	68	62.3 Å²	62.3	32%	0.318	38%	0.381	S	S	.	.	H	α-helix	trans	-61.9	-37.1	175.8	-66.4	-175.3	-13.2	0	0	112.3	S1043 G1044 I1050 K1051 I1073	S1043-Q1047 PolarHBondContact O-N 3.47Å; G1044-Q1047 PolarHBondContact O-N 2.8Å; Q1047-I1050 PolarHBondContact O-N 2.89Å; Q1047-K1051 WeakPolarHBondContact O-CB 3.48Å; Q1047-K1051 PolarHBondContact O-N 2.9Å; Q1047-I1073 HydrophobicContact CB-CB 4.44Å; Q1047-I1073 HydrophobicContact CB-CG2 4.26Å; Q1047-I1073 HydrophobicContact CG-CB 4.32Å; Q1047-I1073 HydrophobicContact CG-CG2 4.14Å
1048	S	82.3	Confident	79.4	Confident	84 Å²	84	62 Å²	62	59%	0.587	38%	0.378	S	S	*	.	H	α-helix	trans	-66.6	-43.5	177.9	-61.2	0	0	0	0	111.8	G1044 P1045 S1046 K1051 L1052	G1044-S1048 PolarHBondContact O-N 3.46Å; G1044-S1048 PolarHBondContact O-OG 3.11Å; P1045-S1048 PolarHBondContact O-N 2.78Å; S1046-S1048 VanDerWaalsContact C-N 3.29Å; S1046-S1048 PolarHBondContact O-N 2.82Å; S1048-K1051 PolarHBondContact O-N 3.44Å; S1048-L1052 PolarHBondContact O-N 2.9Å; S1048-L1052 VanDerWaalsContact O-N 3.12Å
1049	T	82.9	Confident	79.9	Confident	90 Å²	90	61.5 Å²	61.5	55%	0.552	38%	0.383	S	S	*	.	H	α-helix	trans	-64.5	-43.4	175.6	-53.2	0	0	0	0	111.4	P1045 S1046 K1051 L1052 V1053	P1045-T1049 PolarHBondContact O-N 3.48Å; P1045-T1049 PolarHBondContact O-OG1 2.88Å; S1046-T1049 PolarHBondContact O-N 3.21Å; T1049-K1051 VanDerWaalsContact C-N 3.34Å; T1049-K1051 PolarHBondContact O-N 2.81Å; T1049-L1052 WeakPolarHBondContact O-CB 3.39Å; T1049-L1052 PolarHBondContact O-N 3.08Å; T1049-L1052 VanDerWaalsContact O-N 3.15Å; T1049-V1053 WeakPolarHBondContact O-CG2 3.31Å; T1049-V1053 PolarHBondContact O-N 3.48Å
1050	I	83.8	Confident	80.6	Confident	18 Å²	18	63.6 Å²	63.6	9%	0.092	39%	0.391	C	S	.	.	H	α-helix	trans	-64	-40.2	178.6	-68.4	164.4	0	0	0	111.2	L1036 V1040 S1046 Q1047 L1052 V1053 A1054 L1069 I1073	L1036-I1050 HydrophobicContact CD1-CD1 4.1Å; V1040-I1050 HydrophobicContact CB-CD1 4.46Å; V1040-I1050 HydrophobicContact CG1-CD1 4.28Å; V1040-I1050 HydrophobicContact CG2-CD1 3.34Å; S1046-I1050 WeakPolarHBondContact O-CD1 3.37Å; S1046-I1050 VanDerWaalsContact O-CG1 3.27Å; S1046-I1050 WeakPolarHBondContact O-CG1 3.49Å; S1046-I1050 PolarHBondContact O-N 3.22Å; Q1047-I1050 PolarHBondContact O-N 2.89Å; I1050-L1052 VanDerWaalsContact C-N 3.31Å; I1050-L1052 PolarHBondContact O-N 3.05Å; I1050-V1053 PolarHBondContact O-N 2.94Å; I1050-A1054 VanDerWaalsContact O-CB 3.27Å; I1050-A1054 WeakPolarHBondContact O-CB 3.48Å; I1050-A1054 PolarHBondContact O-N 2.92Å; I1050-L1069 HydrophobicContact CG2-CB 4.12Å; I1050-L1069 HydrophobicContact CG2-CD2 4.33Å; I1050-I1073 HydrophobicContact CB-CG2 4Å; I1050-I1073 HydrophobicContact CD1-CG2 4.21Å; I1050-I1073 HydrophobicContact CG2-CG2 3.68Å
1051	K	86.1	Confident	81.3	Confident	75 Å²	75	66 Å²	66	33%	0.326	42%	0.416	S	S	.	.	H	α-helix	trans	-59.1	-43.1	173.3	-172	173.9	-173.4	167.9	0	111.6	Q1047 S1048 T1049 A1054 T1055 L1070 I1073 D1078	Q1047-K1051 WeakPolarHBondContact O-CB 3.48Å; Q1047-K1051 PolarHBondContact O-N 2.9Å; S1048-K1051 PolarHBondContact O-N 3.44Å; T1049-K1051 VanDerWaalsContact C-N 3.34Å; T1049-K1051 PolarHBondContact O-N 2.81Å; K1051-A1054 PolarHBondContact O-N 2.66Å; K1051-T1055 WeakPolarHBondContact O-CB 3.21Å; K1051-T1055 VanDerWaalsContact O-CG2 3.31Å; K1051-T1055 WeakPolarHBondContact O-CG2 3.45Å; K1051-T1055 PolarHBondContact O-N 3.39Å; K1051-T1055 PolarHBondContact O-OG1 3.46Å; K1051-L1070 HydrophobicContact CG-CD2 4.07Å; K1051-I1073 HydrophobicContact CB-CD1 3.81Å; K1051-I1073 HydrophobicContact CG-CD1 4.36Å; K1051-D1078 WeakPolarHBondContact CE-OD2 3.35Å; K1051-D1078 IonicContact NZ-OD2 2.69Å; K1051-D1078 PolarHBondContact NZ-OD2 3.28Å
1052	L	86.6	Confident	82.4	Confident	118 Å²	118	66 Å²	66	62%	0.618	41%	0.406	S	S	*	.	H	α-helix	trans	-65.7	-41.4	178.4	-165.7	148.2	0	0	0	111.8	S1048 T1049 I1050 T1055 N1056	S1048-L1052 PolarHBondContact O-N 2.9Å; S1048-L1052 VanDerWaalsContact O-N 3.12Å; T1049-L1052 WeakPolarHBondContact O-CB 3.39Å; T1049-L1052 PolarHBondContact O-N 3.08Å; T1049-L1052 VanDerWaalsContact O-N 3.15Å; I1050-L1052 VanDerWaalsContact C-N 3.31Å; I1050-L1052 PolarHBondContact O-N 3.05Å; L1052-T1055 WeakPolarHBondContact CA-OG1 3.38Å; L1052-T1055 PolarHBondContact O-OG1 2.96Å; L1052-N1056 WeakPolarHBondContact O-CB 3.43Å; L1052-N1056 PolarHBondContact O-N 3.1Å; L1052-N1056 VanDerWaalsContact O-N 3.1Å
1053	V	87.4	Confident	83.8	Confident	69 Å²	69	63.2 Å²	63.2	42%	0.418	38%	0.383	S	S	.	.	H	α-helix	trans	-63.5	-47.5	174.3	174.1	0	0	0	0	110.9	T1049 I1050 T1055 N1056 M1057 L1069	T1049-V1053 WeakPolarHBondContact O-CG2 3.31Å; T1049-V1053 PolarHBondContact O-N 3.48Å; I1050-V1053 PolarHBondContact O-N 2.94Å; V1053-T1055 PolarHBondContact O-N 3.36Å; V1053-N1056 PolarHBondContact O-N 2.84Å; V1053-M1057 HydrophobicContact CG1-CG 4.4Å; V1053-M1057 HydrophobicContact CG1-SD 4.07Å; V1053-M1057 WeakPolarHBondContact O-CG 3.27Å; V1053-M1057 PolarHBondContact O-N 2.89Å; V1053-L1069 HydrophobicContact CG1-CD1 4.29Å
1054	A	87.4	Confident	84.6	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-60.7	-44.1	-179.2	0	0	0	0	0	112.3	I1050 K1051 M1057 I1058 L1069 L1070	I1050-A1054 VanDerWaalsContact O-CB 3.27Å; I1050-A1054 WeakPolarHBondContact O-CB 3.48Å; I1050-A1054 PolarHBondContact O-N 2.92Å; K1051-A1054 PolarHBondContact O-N 2.66Å; A1054-M1057 PolarHBondContact O-N 3.01Å; A1054-I1058 VanDerWaalsContact O-CG1 3.32Å; A1054-I1058 WeakPolarHBondContact O-CG1 3.38Å; A1054-I1058 PolarHBondContact O-N 3.24Å; A1054-L1069 HydrophobicContact CB-CB 3.78Å; A1054-L1069 HydrophobicContact CB-CD1 4.28Å; A1054-L1070 HydrophobicContact CB-CD2 3.94Å; A1054-L1070 HydrophobicContact CB-CG 3.85Å
1055	T	88.1	Confident	85.2	Confident	39 Å²	39	63.3 Å²	63.3	24%	0.239	37%	0.373	C	S	.	.	H	α-helix	trans	-65.4	-38.4	177.1	49.6	0	0	0	0	112.5	K1051 L1052 V1053 I1058 A1059 Y1082	K1051-T1055 WeakPolarHBondContact O-CB 3.21Å; K1051-T1055 VanDerWaalsContact O-CG2 3.31Å; K1051-T1055 WeakPolarHBondContact O-CG2 3.45Å; K1051-T1055 PolarHBondContact O-N 3.39Å; K1051-T1055 PolarHBondContact O-OG1 3.46Å; L1052-T1055 WeakPolarHBondContact CA-OG1 3.38Å; L1052-T1055 PolarHBondContact O-OG1 2.96Å; V1053-T1055 PolarHBondContact O-N 3.36Å; T1055-I1058 PolarHBondContact O-N 2.89Å; T1055-A1059 WeakPolarHBondContact O-CB 3.3Å; T1055-A1059 PolarHBondContact O-N 2.89Å; T1055-Y1082 HydrophobicContact CG2-CE2 4.1Å; T1055-Y1082 WeakPolarHBondContact CG2-OH 3.42Å
1056	N	92.1	Very high	85.7	Confident	90 Å²	90	58.6 Å²	58.6	48%	0.481	34%	0.343	S	S	.	.	H	α-helix	trans	-65.2	-40.6	173.2	-168.4	-11	0	0	0	111.8	L1052 V1053 I1058 A1059 N1060	L1052-N1056 WeakPolarHBondContact O-CB 3.43Å; L1052-N1056 PolarHBondContact O-N 3.1Å; L1052-N1056 VanDerWaalsContact O-N 3.1Å; V1053-N1056 PolarHBondContact O-N 2.84Å; N1056-I1058 PolarHBondContact O-N 3.34Å; N1056-A1059 PolarHBondContact O-N 2.87Å; N1056-N1060 PolarHBondContact O-N 3.39Å; N1056-N1060 PolarHBondContact O-ND2 2.89Å; N1056-N1060 VanDerWaalsContact O-ND2 3.14Å; N1056-N1060 PolarHBondContact OD1-ND2 2.96Å
1057	M	87.9	Confident	86.4	Confident	44 Å²	44	57.1 Å²	57.1	22%	0.217	33%	0.332	C	S	.	.	H	α-helix	trans	-63.8	-41.2	175.7	-71.2	-177.7	76.1	0	0	112.5	V1053 A1054 N1060 G1061 K1062 E1065 L1069	V1053-M1057 HydrophobicContact CG1-CG 4.4Å; V1053-M1057 HydrophobicContact CG1-SD 4.07Å; V1053-M1057 WeakPolarHBondContact O-CG 3.27Å; V1053-M1057 PolarHBondContact O-N 2.89Å; A1054-M1057 PolarHBondContact O-N 3.01Å; M1057-N1060 PolarHBondContact O-N 3.25Å; M1057-G1061 PolarHBondContact O-N 2.74Å; M1057-K1062 HydrophobicContact CB-CB 4.39Å; M1057-K1062 HydrophobicContact CE-CB 4.4Å; M1057-K1062 HydrophobicContact CE-CD 4.09Å; M1057-K1062 WeakPolarHBondContact O-CA 3.22Å; M1057-K1062 PolarHBondContact O-N 2.92Å; M1057-E1065 HydrophobicContact CE-CB 3.53Å; M1057-E1065 HydrophobicContact CE-CG 4.38Å; M1057-E1065 WeakPolarHBondContact CE-OE2 3.12Å; M1057-L1069 HydrophobicContact SD-CD1 3.79Å
1058	I	90.3	Very high	86.6	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.01	32%	0.322	C	S	.	.	H	α-helix	trans	-60.1	-47.9	174.1	-73.7	165.9	0	0	0	110.4	A1054 T1055 N1056 N1060 G1061 L1063 L1070 Y1082 Y1086	A1054-I1058 VanDerWaalsContact O-CG1 3.32Å; A1054-I1058 WeakPolarHBondContact O-CG1 3.38Å; A1054-I1058 PolarHBondContact O-N 3.24Å; T1055-I1058 PolarHBondContact O-N 2.89Å; N1056-I1058 PolarHBondContact O-N 3.34Å; I1058-N1060 PolarHBondContact O-N 3.07Å; I1058-G1061 PolarHBondContact O-N 2.85Å; I1058-L1063 HydrophobicContact CB-CD2 4.46Å; I1058-L1063 HydrophobicContact CG1-CD2 4.48Å; I1058-L1063 HydrophobicContact CG2-CD2 3.79Å; I1058-L1070 HydrophobicContact CD1-CD1 3.75Å; I1058-Y1082 HydrophobicContact CD1-CD2 3.87Å; I1058-Y1082 HydrophobicContact CD1-CE2 4.43Å; I1058-Y1082 HydrophobicContact CD1-CG 3.95Å; I1058-Y1082 HydrophobicContact CG2-CD1 3.95Å; I1058-Y1082 HydrophobicContact CG2-CG 4.24Å; I1058-Y1086 HydrophobicContact CG2-CE2 3.65Å; I1058-Y1086 PolarHBondContact O-OH 2.72Å
1059	A	87.1	Confident	86.8	Confident	69 Å²	69	52.1 Å²	52.1	57%	0.57	30%	0.3	S	S	*	.	H	α-helix	trans	-60.1	-34	178.5	0	0	0	0	0	112.7	T1055 N1056 G1061	T1055-A1059 WeakPolarHBondContact O-CB 3.3Å; T1055-A1059 PolarHBondContact O-N 2.89Å; N1056-A1059 PolarHBondContact O-N 2.87Å; A1059-G1061 PolarHBondContact O-N 3.34Å
1060	N	90.1	Very high	87	Confident	121 Å²	121	47.9 Å²	47.9	65%	0.647	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	12.1	176.6	-67.2	-35.5	0	0	0	114.2	N1056 M1057 I1058 K1062	N1056-N1060 PolarHBondContact O-N 3.39Å; N1056-N1060 PolarHBondContact O-ND2 2.89Å; N1056-N1060 VanDerWaalsContact O-ND2 3.14Å; N1056-N1060 PolarHBondContact OD1-ND2 2.96Å; M1057-N1060 PolarHBondContact O-N 3.25Å; I1058-N1060 PolarHBondContact O-N 3.07Å; N1060-K1062 PolarHBondContact O-N 3.14Å
1061	G	83.5	Confident	87.1	Confident	53 Å²	53	47.1 Å²	47.1	55%	0.546	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.5	1.5	175.4	0	0	0	0	0	115.3	M1057 I1058 A1059 L1063	M1057-G1061 PolarHBondContact O-N 2.74Å; I1058-G1061 PolarHBondContact O-N 2.85Å; A1059-G1061 PolarHBondContact O-N 3.34Å; G1061-L1063 VanDerWaalsContact C-N 3.28Å; G1061-L1063 PolarHBondContact O-N 2.87Å; G1061-L1063 VanDerWaalsContact O-N 3.14Å
1062	K	86.6	Confident	86.9	Confident	121 Å²	121	44.9 Å²	44.9	53%	0.526	26%	0.262	S	S	.	.			trans	-89	63.5	174.2	-66.2	-172.6	173.2	-166.9	0	111.2	M1057 N1060 A1064 E1065 G1066	M1057-K1062 HydrophobicContact CB-CB 4.39Å; M1057-K1062 HydrophobicContact CE-CB 4.4Å; M1057-K1062 HydrophobicContact CE-CD 4.09Å; M1057-K1062 WeakPolarHBondContact O-CA 3.22Å; M1057-K1062 PolarHBondContact O-N 2.92Å; N1060-K1062 PolarHBondContact O-N 3.14Å; K1062-A1064 PolarHBondContact O-N 2.71Å; K1062-E1065 WeakPolarHBondContact CD-OE2 3.37Å; K1062-E1065 IonicContact NZ-OE2 3.64Å; K1062-G1066 PolarHBondContact O-N 2.83Å
1063	L	87.1	Confident	86.8	Confident	35 Å²	35	39.5 Å²	39.5	18%	0.183	23%	0.234	C	C	.	.	H	α-helix	trans	-59.2	-46.9	-174.1	-71.6	162.9	0	0	0	113.3	I1058 G1061 E1065 G1066 V1067 Y1086	I1058-L1063 HydrophobicContact CB-CD2 4.46Å; I1058-L1063 HydrophobicContact CG1-CD2 4.48Å; I1058-L1063 HydrophobicContact CG2-CD2 3.79Å; G1061-L1063 VanDerWaalsContact C-N 3.28Å; G1061-L1063 PolarHBondContact O-N 2.87Å; G1061-L1063 VanDerWaalsContact O-N 3.14Å; L1063-E1065 PolarHBondContact O-N 2.78Å; L1063-G1066 PolarHBondContact O-N 3Å; L1063-V1067 WeakPolarHBondContact O-CB 3.48Å; L1063-V1067 VanDerWaalsContact O-CG2 3.23Å; L1063-V1067 WeakPolarHBondContact O-CG2 3.39Å; L1063-V1067 PolarHBondContact O-N 3Å; L1063-Y1086 HydrophobicContact CD1-CD1 3.81Å; L1063-Y1086 HydrophobicContact CD1-CE1 4.44Å; L1063-Y1086 HydrophobicContact CD1-CG 3.85Å; L1063-Y1086 HydrophobicContact CD2-CD1 3.98Å; L1063-Y1086 HydrophobicContact CD2-CD2 3.46Å; L1063-Y1086 VanDerWaalsContact CD2-CD2 3.46Å; L1063-Y1086 HydrophobicContact CD2-CE1 4.17Å; L1063-Y1086 HydrophobicContact CD2-CE2 3.68Å; L1063-Y1086 HydrophobicContact CD2-CG 3.61Å; L1063-Y1086 HydrophobicContact CG-CD1 4.39Å; L1063-Y1086 HydrophobicContact CG-CG 4.36Å
1064	A	84.4	Confident	86.5	Confident	44 Å²	44	41.4 Å²	41.4	36%	0.364	24%	0.242	S	C	.	.	H	α-helix	trans	-62.4	-46.5	-175	0	0	0	0	0	113	K1062 V1067 Q1068	K1062-A1064 PolarHBondContact O-N 2.71Å; A1064-V1067 PolarHBondContact O-N 3.3Å; A1064-Q1068 WeakPolarHBondContact O-CB 3.45Å; A1064-Q1068 PolarHBondContact O-N 3.07Å
1065	E	85.3	Confident	86.5	Confident	57 Å²	57	46 Å²	46	27%	0.266	26%	0.262	S	S	.	.	H	α-helix	trans	-68.5	-39.7	-179.4	-63.6	179	171.9	0	0	111	R998 M1057 K1062 L1063 Q1068 L1069	R998-E1065 IonicContact NH2-OE1 2.71Å; R998-E1065 PolarHBondContact NH2-OE1 2.75Å; M1057-E1065 HydrophobicContact CE-CB 3.53Å; M1057-E1065 HydrophobicContact CE-CG 4.38Å; M1057-E1065 WeakPolarHBondContact CE-OE2 3.12Å; K1062-E1065 WeakPolarHBondContact CD-OE2 3.37Å; K1062-E1065 IonicContact NZ-OE2 3.64Å; L1063-E1065 PolarHBondContact O-N 2.78Å; E1065-Q1068 PolarHBondContact O-N 3.09Å; E1065-L1069 WeakPolarHBondContact O-CG 3.29Å; E1065-L1069 PolarHBondContact O-N 3.01Å; E1065-L1069 VanDerWaalsContact O-N 3.09Å
1066	G	86.8	Confident	86.4	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-66.5	-40.6	175.4	0	0	0	0	0	113.2	K1062 L1063 L1069 L1070	K1062-G1066 PolarHBondContact O-N 2.83Å; L1063-G1066 PolarHBondContact O-N 3Å; G1066-L1069 PolarHBondContact O-N 2.95Å; G1066-L1070 WeakPolarHBondContact O-CG 3.47Å; G1066-L1070 PolarHBondContact O-N 2.93Å
1067	V	87.9	Confident	86.2	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.012	24%	0.238	C	C	.	.	H	α-helix	trans	-61.4	-44.2	174.4	164	0	0	0	0	111.1	L1006 L1063 A1064 L1069 L1070 C1071 A1079 L1083 L1095	L1006-V1067 HydrophobicContact CD2-CG1 4.46Å; L1063-V1067 WeakPolarHBondContact O-CB 3.48Å; L1063-V1067 VanDerWaalsContact O-CG2 3.23Å; L1063-V1067 WeakPolarHBondContact O-CG2 3.39Å; L1063-V1067 PolarHBondContact O-N 3Å; A1064-V1067 PolarHBondContact O-N 3.3Å; V1067-L1069 PolarHBondContact O-N 3.42Å; V1067-L1070 PolarHBondContact O-N 3.38Å; V1067-C1071 PolarHBondContact O-N 3.39Å; V1067-C1071 PolarHBondContact O-SG 3.2Å; V1067-A1079 HydrophobicContact CB-CB 4.45Å; V1067-A1079 HydrophobicContact CG1-CB 4.06Å; V1067-A1079 HydrophobicContact CG2-CB 4.36Å; V1067-L1083 HydrophobicContact CG1-CD1 4.24Å; V1067-L1083 HydrophobicContact CG2-CD1 4.27Å; V1067-L1083 HydrophobicContact CG2-CD2 3.93Å; V1067-L1083 HydrophobicContact CG2-CG 3.85Å; V1067-L1095 HydrophobicContact CG1-CD2 3.77Å
1068	Q	85.9	Confident	86.2	Confident	21 Å²	21	40.6 Å²	40.6	10%	0.098	24%	0.236	C	C	.	.	H	α-helix	trans	-58.4	-46	176.6	-175.9	-178.8	21.4	0	0	111.8	D1002 L1005 A1064 E1065 L1070 C1071 L1072	D1002-Q1068 PolarHBondContact OD1-NE2 3.36Å; D1002-Q1068 PolarHBondContact OD1-OE1 3.09Å; L1005-Q1068 HydrophobicContact CD1-CG 4.49Å; A1064-Q1068 WeakPolarHBondContact O-CB 3.45Å; A1064-Q1068 PolarHBondContact O-N 3.07Å; E1065-Q1068 PolarHBondContact O-N 3.09Å; Q1068-L1070 VanDerWaalsContact C-N 3.33Å; Q1068-L1070 PolarHBondContact O-N 2.89Å; Q1068-C1071 WeakPolarHBondContact O-CB 3.07Å; Q1068-C1071 PolarHBondContact O-N 3.26Å; Q1068-L1072 WeakPolarHBondContact O-CG 3.4Å; Q1068-L1072 PolarHBondContact O-N 2.96Å; Q1068-L1072 VanDerWaalsContact O-N 3.07Å
1069	L	85.6	Confident	86.1	Confident	27 Å²	27	40.5 Å²	40.5	14%	0.141	24%	0.235	C	C	.	.	H	α-helix	trans	-62.2	-38.6	176.3	-72.2	175.2	0	0	0	112.6	L1036 I1050 V1053 A1054 M1057 E1065 G1066 V1067 C1071 L1072 I1073	L1036-L1069 HydrophobicContact CD2-CD2 4.07Å; I1050-L1069 HydrophobicContact CG2-CB 4.12Å; I1050-L1069 HydrophobicContact CG2-CD2 4.33Å; V1053-L1069 HydrophobicContact CG1-CD1 4.29Å; A1054-L1069 HydrophobicContact CB-CB 3.78Å; A1054-L1069 HydrophobicContact CB-CD1 4.28Å; M1057-L1069 HydrophobicContact SD-CD1 3.79Å; E1065-L1069 WeakPolarHBondContact O-CG 3.29Å; E1065-L1069 PolarHBondContact O-N 3.01Å; E1065-L1069 VanDerWaalsContact O-N 3.09Å; G1066-L1069 PolarHBondContact O-N 2.95Å; V1067-L1069 PolarHBondContact O-N 3.42Å; L1069-C1071 VanDerWaalsContact C-N 3.35Å; L1069-L1072 HydrophobicContact CD2-CD1 4.3Å; L1069-L1072 PolarHBondContact O-N 2.95Å; L1069-I1073 PolarHBondContact O-N 3.16Å
1070	L	87	Confident	86.3	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-66.4	-36.1	174.8	-70.6	175	0	0	0	112.2	K1051 A1054 I1058 G1066 V1067 Q1068 L1072 I1073 K1075 A1079 Y1082	K1051-L1070 HydrophobicContact CG-CD2 4.07Å; A1054-L1070 HydrophobicContact CB-CD2 3.94Å; A1054-L1070 HydrophobicContact CB-CG 3.85Å; I1058-L1070 HydrophobicContact CD1-CD1 3.75Å; G1066-L1070 WeakPolarHBondContact O-CG 3.47Å; G1066-L1070 PolarHBondContact O-N 2.93Å; V1067-L1070 PolarHBondContact O-N 3.38Å; Q1068-L1070 VanDerWaalsContact C-N 3.33Å; Q1068-L1070 PolarHBondContact O-N 2.89Å; L1070-L1072 VanDerWaalsContact C-N 3.35Å; L1070-I1073 HydrophobicContact CD2-CD1 4.1Å; L1070-I1073 VanDerWaalsContact O-CG1 3.23Å; L1070-I1073 WeakPolarHBondContact O-CG1 3.46Å; L1070-I1073 PolarHBondContact O-N 3.08Å; L1070-K1075 HydrophobicContact CD2-CB 4.46Å; L1070-K1075 CarbonylContact O-C 3.58Å; L1070-K1075 WeakPolarHBondContact O-CA 3.4Å; L1070-K1075 PolarHBondContact O-N 2.78Å; L1070-A1079 HydrophobicContact CB-CB 3.77Å; L1070-A1079 HydrophobicContact CD1-CB 3.92Å; L1070-Y1082 HydrophobicContact CD1-CD2 3.8Å; L1070-Y1082 HydrophobicContact CD1-CE2 4.09Å
1071	C	85.9	Confident	86.3	Confident	2 Å²	2	37.2 Å²	37.2	1%	0.014	20%	0.199	C	C	.	.	H	α-helix	trans	-66.6	-34.8	175	-69.5	0	0	0	0	112.5	L1006 V1067 Q1068 L1069 I1073 D1074	L1006-C1071 HydrophobicContact CD2-CB 4.25Å; V1067-C1071 PolarHBondContact O-N 3.39Å; V1067-C1071 PolarHBondContact O-SG 3.2Å; Q1068-C1071 WeakPolarHBondContact O-CB 3.07Å; Q1068-C1071 PolarHBondContact O-N 3.26Å; L1069-C1071 VanDerWaalsContact C-N 3.35Å; C1071-I1073 VanDerWaalsContact C-N 3.33Å; C1071-I1073 PolarHBondContact O-N 2.86Å; C1071-D1074 PolarHBondContact O-N 2.95Å
1072	L	82.5	Confident	86.7	Confident	28 Å²	28	38.4 Å²	38.4	15%	0.147	19%	0.188	C	C	.	.	H	α-helix	trans	-66.4	-30.4	177.7	-71.6	174.1	0	0	0	113.8	L1005 V1037 Q1068 L1069 L1070 D1074	L1005-L1072 HydrophobicContact CD2-CD2 3.99Å; V1037-L1072 HydrophobicContact CG1-CD2 4.26Å; V1037-L1072 HydrophobicContact CG2-CD1 3.99Å; V1037-L1072 HydrophobicContact CG2-CD2 4.01Å; Q1068-L1072 WeakPolarHBondContact O-CG 3.4Å; Q1068-L1072 PolarHBondContact O-N 2.96Å; Q1068-L1072 VanDerWaalsContact O-N 3.07Å; L1069-L1072 HydrophobicContact CD2-CD1 4.3Å; L1069-L1072 PolarHBondContact O-N 2.95Å; L1070-L1072 VanDerWaalsContact C-N 3.35Å; L1072-D1074 VanDerWaalsContact C-N 3.29Å
1073	I	84.7	Confident	86.9	Confident	5 Å²	5	32.7 Å²	32.7	3%	0.026	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	16.6	177.4	61.9	167.6	0	0	0	112.7	V1040 Q1047 I1050 K1051 L1069 L1070 C1071 K1075	V1040-I1073 HydrophobicContact CG1-CG2 3.8Å; Q1047-I1073 HydrophobicContact CB-CB 4.44Å; Q1047-I1073 HydrophobicContact CB-CG2 4.26Å; Q1047-I1073 HydrophobicContact CG-CB 4.32Å; Q1047-I1073 HydrophobicContact CG-CG2 4.14Å; I1050-I1073 HydrophobicContact CB-CG2 4Å; I1050-I1073 HydrophobicContact CD1-CG2 4.21Å; I1050-I1073 HydrophobicContact CG2-CG2 3.68Å; K1051-I1073 HydrophobicContact CB-CD1 3.81Å; K1051-I1073 HydrophobicContact CG-CD1 4.36Å; L1069-I1073 PolarHBondContact O-N 3.16Å; L1070-I1073 HydrophobicContact CD2-CD1 4.1Å; L1070-I1073 VanDerWaalsContact O-CG1 3.23Å; L1070-I1073 WeakPolarHBondContact O-CG1 3.46Å; L1070-I1073 PolarHBondContact O-N 3.08Å; C1071-I1073 VanDerWaalsContact C-N 3.33Å; C1071-I1073 PolarHBondContact O-N 2.86Å; I1073-K1075 HydrophobicContact CD1-CB 4.02Å; I1073-K1075 HydrophobicContact CD1-CG 3.69Å; I1073-K1075 HydrophobicContact CG1-CB 3.92Å; I1073-K1075 HydrophobicContact CG1-CG 3.8Å; I1073-K1075 PolarHBondContact O-N 3.2Å
1074	D	81	Confident	87.1	Confident	110 Å²	110	31.7 Å²	31.7	59%	0.588	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	53	33.8	-174.8	-64.1	-38.1	0	0	0	113.9	C1071 L1072 R1099	C1071-D1074 PolarHBondContact O-N 2.95Å; L1072-D1074 VanDerWaalsContact C-N 3.29Å; D1074-R1099 IonicContact OD1-CZ 2.96Å; D1074-R1099 IonicContact OD1-NE 3.59Å; D1074-R1099 IonicContact OD1-NH2 3.88Å; D1074-R1099 PolarHBondContact OD1-NH2 2.96Å
1075	K	86.6	Confident	87.3	Confident	97 Å²	97	34.6 Å²	34.6	42%	0.422	17%	0.171	S	C	.	.			trans	-106.9	40.2	170.4	-60.3	-59	177.8	-167.1	0	111.5	L1070 I1073 A1077 D1078 A1079	L1070-K1075 HydrophobicContact CD2-CB 4.46Å; L1070-K1075 CarbonylContact O-C 3.58Å; L1070-K1075 WeakPolarHBondContact O-CA 3.4Å; L1070-K1075 PolarHBondContact O-N 2.78Å; I1073-K1075 HydrophobicContact CD1-CB 4.02Å; I1073-K1075 HydrophobicContact CD1-CG 3.69Å; I1073-K1075 HydrophobicContact CG1-CB 3.92Å; I1073-K1075 HydrophobicContact CG1-CG 3.8Å; I1073-K1075 PolarHBondContact O-N 3.2Å; K1075-A1077 PolarHBondContact O-N 3.33Å; K1075-D1078 HydrophobicContact CB-CB 4.47Å; K1075-D1078 PolarHBondContact O-N 2.82Å; K1075-A1079 PolarHBondContact O-N 3.03Å; K1075-A1079 VanDerWaalsContact O-N 3.17Å
1076	A	86	Confident	87.5	Confident	4 Å²	4	37.2 Å²	37.2	3%	0.033	18%	0.179	C	C	.	.	H	α-helix	trans	-61.3	-29.1	179	0	0	0	0	0	113	A1079 C1080 R1099 L1100	A1076-A1079 WeakPolarHBondContact O-CB 3.44Å; A1076-A1079 PolarHBondContact O-N 3.17Å; A1076-C1080 PolarHBondContact O-N 2.99Å; A1076-C1080 PolarHBondContact O-SG 2.94Å; A1076-R1099 HydrophobicContact CB-CB 4.39Å; A1076-R1099 HydrophobicContact CB-CG 3.85Å; A1076-L1100 HydrophobicContact CB-CD2 3.6Å
1077	A	88	Confident	87.4	Confident	23 Å²	23	39.3 Å²	39.3	19%	0.19	20%	0.201	C	C	.	.	H	α-helix	trans	-66.1	-40.9	176.4	0	0	0	0	0	112.1	K1075 A1079 C1080 R1081 L1100	K1075-A1077 PolarHBondContact O-N 3.33Å; A1077-A1079 VanDerWaalsContact C-N 3.32Å; A1077-C1080 PolarHBondContact O-N 2.86Å; A1077-R1081 WeakPolarHBondContact O-CG 3.48Å; A1077-R1081 PolarHBondContact O-N 3.25Å; A1077-L1100 HydrophobicContact CB-CD2 4.13Å
1078	D	87.6	Confident	87.3	Confident	31 Å²	31	43.6 Å²	43.6	17%	0.166	22%	0.221	C	C	.	.	H	α-helix	trans	-65	-39.7	172.9	-73.9	-17.3	0	0	0	110.4	K1051 K1075 C1080 R1081 Y1082	K1051-D1078 WeakPolarHBondContact CE-OD2 3.35Å; K1051-D1078 IonicContact NZ-OD2 2.69Å; K1051-D1078 PolarHBondContact NZ-OD2 3.28Å; K1075-D1078 HydrophobicContact CB-CB 4.47Å; K1075-D1078 PolarHBondContact O-N 2.82Å; D1078-C1080 VanDerWaalsContact C-N 3.34Å; D1078-C1080 PolarHBondContact O-N 2.85Å; D1078-R1081 WeakPolarHBondContact O-CB 3.31Å; D1078-R1081 PolarHBondContact O-N 2.98Å; D1078-R1081 VanDerWaalsContact O-N 3.17Å; D1078-R1081 IonicContact OD1-CZ 2.61Å; D1078-R1081 IonicContact OD1-NH1 3.72Å; D1078-R1081 PolarHBondContact OD1-NH1 2.62Å; D1078-Y1082 WeakPolarHBondContact O-CD2 3.43Å; D1078-Y1082 PolarHBondContact O-N 2.92Å
1079	A	88.9	Confident	87.4	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60.4	-41.8	176.4	0	0	0	0	0	112.3	V1067 L1070 K1075 A1076 A1077 R1081 Y1082 L1083 L1095	V1067-A1079 HydrophobicContact CB-CB 4.45Å; V1067-A1079 HydrophobicContact CG1-CB 4.06Å; V1067-A1079 HydrophobicContact CG2-CB 4.36Å; L1070-A1079 HydrophobicContact CB-CB 3.77Å; L1070-A1079 HydrophobicContact CD1-CB 3.92Å; K1075-A1079 PolarHBondContact O-N 3.03Å; K1075-A1079 VanDerWaalsContact O-N 3.17Å; A1076-A1079 WeakPolarHBondContact O-CB 3.44Å; A1076-A1079 PolarHBondContact O-N 3.17Å; A1077-A1079 VanDerWaalsContact C-N 3.32Å; A1079-R1081 PolarHBondContact O-N 3.46Å; A1079-Y1082 PolarHBondContact O-N 3.02Å; A1079-L1083 WeakPolarHBondContact O-CG 3.42Å; A1079-L1083 PolarHBondContact O-N 2.78Å; A1079-L1095 HydrophobicContact CB-CD2 4.26Å
1080	C	91.5	Very high	87.5	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-62.2	-41	174.4	-66.8	0	0	0	0	112	A1076 A1077 D1078 Y1082 L1083 Q1084 V1108	A1076-C1080 PolarHBondContact O-N 2.99Å; A1076-C1080 PolarHBondContact O-SG 2.94Å; A1077-C1080 PolarHBondContact O-N 2.86Å; D1078-C1080 VanDerWaalsContact C-N 3.34Å; D1078-C1080 PolarHBondContact O-N 2.85Å; C1080-Y1082 PolarHBondContact O-N 2.82Å; C1080-L1083 PolarHBondContact O-N 2.75Å; C1080-Q1084 WeakPolarHBondContact O-CG 3.26Å; C1080-Q1084 PolarHBondContact O-N 2.76Å; C1080-V1108 HydrophobicContact CB-CG1 4.03Å; C1080-V1108 HydrophobicContact CB-CG2 3.87Å
1081	R	90.4	Very high	87.5	Confident	122 Å²	122	50 Å²	50	46%	0.46	25%	0.245	S	C	.	.	H	α-helix	trans	-60.8	-45.1	175.7	-68.5	175.6	-174.5	146	-3.4	111.4	A1077 D1078 A1079 Q1084 T1085	A1077-R1081 WeakPolarHBondContact O-CG 3.48Å; A1077-R1081 PolarHBondContact O-N 3.25Å; D1078-R1081 WeakPolarHBondContact O-CB 3.31Å; D1078-R1081 PolarHBondContact O-N 2.98Å; D1078-R1081 VanDerWaalsContact O-N 3.17Å; D1078-R1081 IonicContact OD1-CZ 2.61Å; D1078-R1081 IonicContact OD1-NH1 3.72Å; D1078-R1081 PolarHBondContact OD1-NH1 2.62Å; A1079-R1081 PolarHBondContact O-N 3.46Å; R1081-Q1084 PolarHBondContact O-N 3.36Å; R1081-T1085 WeakPolarHBondContact O-CG2 3.3Å; R1081-T1085 PolarHBondContact O-N 3.08Å; R1081-T1085 PolarHBondContact O-OG1 3.21Å
1082	Y	91.3	Very high	87.7	Confident	78 Å²	78	50 Å²	50	31%	0.306	24%	0.244	S	C	.	.	H	α-helix	trans	-60.5	-46.8	175.6	-73.9	-65.2	0	0	0	111.4	T1055 I1058 L1070 D1078 A1079 C1080 Q1084 T1085 Y1086	T1055-Y1082 HydrophobicContact CG2-CE2 4.1Å; T1055-Y1082 WeakPolarHBondContact CG2-OH 3.42Å; I1058-Y1082 HydrophobicContact CD1-CD2 3.87Å; I1058-Y1082 HydrophobicContact CD1-CE2 4.43Å; I1058-Y1082 HydrophobicContact CD1-CG 3.95Å; I1058-Y1082 HydrophobicContact CG2-CD1 3.95Å; I1058-Y1082 HydrophobicContact CG2-CG 4.24Å; L1070-Y1082 HydrophobicContact CD1-CD2 3.8Å; L1070-Y1082 HydrophobicContact CD1-CE2 4.09Å; D1078-Y1082 WeakPolarHBondContact O-CD2 3.43Å; D1078-Y1082 PolarHBondContact O-N 2.92Å; A1079-Y1082 PolarHBondContact O-N 3.02Å; C1080-Y1082 PolarHBondContact O-N 2.82Å; Y1082-Q1084 VanDerWaalsContact C-N 3.29Å; Y1082-Q1084 PolarHBondContact O-N 3.5Å; Y1082-T1085 WeakPolarHBondContact CA-OG1 3.14Å; Y1082-T1085 PolarHBondContact O-N 2.87Å; Y1082-T1085 VanDerWaalsContact O-N 3.11Å; Y1082-T1085 PolarHBondContact O-OG1 2.63Å; Y1082-Y1086 WeakPolarHBondContact O-CD2 3.41Å; Y1082-Y1086 PolarHBondContact O-N 3.07Å; Y1082-Y1086 VanDerWaalsContact O-N 3.15Å
1083	L	89.9	Confident	88	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-56.1	-42.9	176	-72.8	171.9	0	0	0	112.5	V1067 A1079 C1080 Y1086 G1087 E1088 R1091 A1092 L1095	V1067-L1083 HydrophobicContact CG1-CD1 4.24Å; V1067-L1083 HydrophobicContact CG2-CD1 4.27Å; V1067-L1083 HydrophobicContact CG2-CD2 3.93Å; V1067-L1083 HydrophobicContact CG2-CG 3.85Å; A1079-L1083 WeakPolarHBondContact O-CG 3.42Å; A1079-L1083 PolarHBondContact O-N 2.78Å; C1080-L1083 PolarHBondContact O-N 2.75Å; L1083-Y1086 PolarHBondContact O-N 3.22Å; L1083-G1087 PolarHBondContact O-N 2.81Å; L1083-E1088 HydrophobicContact CB-CB 4.35Å; L1083-E1088 HydrophobicContact CD2-CB 4.03Å; L1083-E1088 PolarHBondContact O-N 3.25Å; L1083-R1091 HydrophobicContact CD1-CG 4.21Å; L1083-R1091 HydrophobicContact CD2-CG 4.48Å; L1083-A1092 HydrophobicContact CB-CB 3.8Å; L1083-A1092 HydrophobicContact CD1-CB 4.35Å; L1083-L1095 HydrophobicContact CD1-CD2 3.99Å
1084	Q	91.4	Very high	88.3	Confident	14 Å²	14	49.9 Å²	49.9	7%	0.065	24%	0.242	C	C	.	.	H	α-helix	trans	-62.8	-42.1	176.1	-69.6	-179.4	-31.7	0	0	112.4	C1080 R1081 Y1082 Y1086 G1087 W1089 A1092 V1108	C1080-Q1084 WeakPolarHBondContact O-CG 3.26Å; C1080-Q1084 PolarHBondContact O-N 2.76Å; R1081-Q1084 PolarHBondContact O-N 3.36Å; Y1082-Q1084 VanDerWaalsContact C-N 3.29Å; Y1082-Q1084 PolarHBondContact O-N 3.5Å; Q1084-Y1086 VanDerWaalsContact C-N 3.25Å; Q1084-Y1086 PolarHBondContact O-N 3.45Å; Q1084-G1087 PolarHBondContact O-N 3.12Å; Q1084-G1087 VanDerWaalsContact O-N 3.1Å; Q1084-W1089 HydrophobicContact CB-CE3 4.12Å; Q1084-W1089 HydrophobicContact CB-CH2 3.9Å; Q1084-W1089 HydrophobicContact CB-CZ2 4.32Å; Q1084-W1089 HydrophobicContact CB-CZ3 3.79Å; Q1084-W1089 HydrophobicContact CG-CD2 4.34Å; Q1084-W1089 HydrophobicContact CG-CE3 3.61Å; Q1084-W1089 HydrophobicContact CG-CH2 4.16Å; Q1084-W1089 HydrophobicContact CG-CZ3 3.52Å; Q1084-A1092 HydrophobicContact CG-CB 3.85Å; Q1084-V1108 PolarHBondContact NE2-O 3.01Å
1085	T	90.1	Very high	88.7	Confident	105 Å²	105	44.8 Å²	44.8	64%	0.644	22%	0.215	S	C	*	.	H	α-helix	trans	-64.3	-28.6	178.3	55.9	0	0	0	0	113.7	R1081 Y1082	R1081-T1085 WeakPolarHBondContact O-CG2 3.3Å; R1081-T1085 PolarHBondContact O-N 3.08Å; R1081-T1085 PolarHBondContact O-OG1 3.21Å; Y1082-T1085 WeakPolarHBondContact CA-OG1 3.14Å; Y1082-T1085 PolarHBondContact O-N 2.87Å; Y1082-T1085 VanDerWaalsContact O-N 3.11Å; Y1082-T1085 PolarHBondContact O-OG1 2.63Å
1086	Y	88.3	Confident	88.8	Confident	111 Å²	111	40.1 Å²	40.1	44%	0.435	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	5.6	176.8	-76.9	-93	0	0	0	113.3	I1058 L1063 Y1082 L1083 Q1084	I1058-Y1086 HydrophobicContact CG2-CE2 3.65Å; I1058-Y1086 PolarHBondContact O-OH 2.72Å; L1063-Y1086 HydrophobicContact CD1-CD1 3.81Å; L1063-Y1086 HydrophobicContact CD1-CE1 4.44Å; L1063-Y1086 HydrophobicContact CD1-CG 3.85Å; L1063-Y1086 HydrophobicContact CD2-CD1 3.98Å; L1063-Y1086 HydrophobicContact CD2-CD2 3.46Å; L1063-Y1086 VanDerWaalsContact CD2-CD2 3.46Å; L1063-Y1086 HydrophobicContact CD2-CE1 4.17Å; L1063-Y1086 HydrophobicContact CD2-CE2 3.68Å; L1063-Y1086 HydrophobicContact CD2-CG 3.61Å; L1063-Y1086 HydrophobicContact CG-CD1 4.39Å; L1063-Y1086 HydrophobicContact CG-CG 4.36Å; Y1082-Y1086 WeakPolarHBondContact O-CD2 3.41Å; Y1082-Y1086 PolarHBondContact O-N 3.07Å; Y1082-Y1086 VanDerWaalsContact O-N 3.15Å; L1083-Y1086 PolarHBondContact O-N 3.22Å; Q1084-Y1086 VanDerWaalsContact C-N 3.25Å; Q1084-Y1086 PolarHBondContact O-N 3.45Å
1087	G	84.9	Confident	88.9	Confident	45 Å²	45	40.3 Å²	40.3	46%	0.464	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.2	6.2	175.8	0	0	0	0	0	115.6	L1083 Q1084 W1089	L1083-G1087 PolarHBondContact O-N 2.81Å; Q1084-G1087 PolarHBondContact O-N 3.12Å; Q1084-G1087 VanDerWaalsContact O-N 3.1Å; G1087-W1089 VanDerWaalsContact C-N 3.28Å; G1087-W1089 VanDerWaalsContact O-CD1 3.26Å; G1087-W1089 PolarHBondContact O-N 3.08Å; G1087-W1089 VanDerWaalsContact O-N 3.07Å
1088	E	85.8	Confident	88.8	Confident	92 Å²	92	39.3 Å²	39.3	43%	0.43	19%	0.186	S	C	.	.			trans	-87.4	58.3	-178.5	-70.2	-69.4	172.9	0	0	111.8	L1083 R1091 A1092	L1083-E1088 HydrophobicContact CB-CB 4.35Å; L1083-E1088 HydrophobicContact CD2-CB 4.03Å; L1083-E1088 PolarHBondContact O-N 3.25Å; E1088-R1091 HydrophobicContact CB-CB 4.31Å; E1088-R1091 PolarHBondContact O-N 3.06Å; E1088-A1092 PolarHBondContact O-N 3.49Å
1089	W	88.5	Confident	88.7	Confident	52 Å²	52	41.6 Å²	41.6	20%	0.197	19%	0.192	C	C	.	.	H	α-helix	trans	-65.3	-43.9	-171.5	-65	95.4	0	0	0	114	Q1084 G1087 R1091 A1092 A1093 R1111 W1112 H1115	Q1084-W1089 HydrophobicContact CB-CE3 4.12Å; Q1084-W1089 HydrophobicContact CB-CH2 3.9Å; Q1084-W1089 HydrophobicContact CB-CZ2 4.32Å; Q1084-W1089 HydrophobicContact CB-CZ3 3.79Å; Q1084-W1089 HydrophobicContact CG-CD2 4.34Å; Q1084-W1089 HydrophobicContact CG-CE3 3.61Å; Q1084-W1089 HydrophobicContact CG-CH2 4.16Å; Q1084-W1089 HydrophobicContact CG-CZ3 3.52Å; G1087-W1089 VanDerWaalsContact C-N 3.28Å; G1087-W1089 VanDerWaalsContact O-CD1 3.26Å; G1087-W1089 PolarHBondContact O-N 3.08Å; G1087-W1089 VanDerWaalsContact O-N 3.07Å; W1089-R1091 VanDerWaalsContact C-N 3.28Å; W1089-R1091 PolarHBondContact O-N 2.9Å; W1089-A1092 PolarHBondContact O-N 3.43Å; W1089-A1093 WeakPolarHBondContact O-CB 3.37Å; W1089-A1093 PolarHBondContact O-N 3.04Å; W1089-R1111 HydrophobicContact CZ3-CB 4.37Å; W1089-W1112 HydrophobicContact CE3-CB 4.07Å; W1089-W1112 AromaticContact CE3-CD1 3.79Å; W1089-W1112 HydrophobicContact CE3-CG 4.25Å; W1089-W1112 HydrophobicContact CZ3-CB 4.49Å; W1089-H1115 AromaticContact CD1-CD2 3.48Å; W1089-H1115 VanDerWaalsContact CD1-CD2 3.48Å; W1089-H1115 AromaticContact CD1-NE2 3.37Å; W1089-H1115 HydrophobicContact CD2-CB 4.14Å; W1089-H1115 AromaticContact CD2-CD2 3.71Å; W1089-H1115 AromaticContact CD2-CG 3.88Å; W1089-H1115 AromaticContact CE2-CD2 3.59Å; W1089-H1115 AromaticContact CE2-CE1 3.98Å; W1089-H1115 AromaticContact CE2-CG 3.46Å; W1089-H1115 VanDerWaalsContact CE2-CG 3.46Å; W1089-H1115 AromaticContact CE2-ND1 3.73Å; W1089-H1115 AromaticContact CE2-NE2 3.91Å; W1089-H1115 HydrophobicContact CE3-CB 4.16Å; W1089-H1115 AromaticContact CG-CD2 3.69Å; W1089-H1115 HydrophobicContact CH2-CB 3.86Å; W1089-H1115 HydrophobicContact CZ2-CB 3.83Å; W1089-H1115 AromaticContact CZ2-CG 3.68Å; W1089-H1115 AromaticContact CZ2-ND1 3.79Å; W1089-H1115 HydrophobicContact CZ3-CB 4.01Å; W1089-H1115 AromaticContact NE1-CD2 3.42Å; W1089-H1115 PolarHBondContact NE1-CD2 2.93Å; W1089-H1115 AromaticContact NE1-CE1 3.43Å; W1089-H1115 PolarHBondContact NE1-CE1 2.83Å; W1089-H1115 AromaticContact NE1-CG 3.65Å; W1089-H1115 AromaticContact NE1-ND1 3.66Å; W1089-H1115 AromaticContact NE1-NE2 3.27Å; W1089-H1115 PolarHBondContact NE1-NE2 3.26Å
1090	N	87.8	Confident	88.6	Confident	36 Å²	36	42.2 Å²	42.2	19%	0.193	20%	0.196	C	C	.	.	H	α-helix	trans	-61.6	-38.8	178.2	-76.4	-37.1	0	0	0	111.4	D170 A1093 W1094 W1112	D170-N1090 PolarHBondContact OD2-ND2 3.15Å; N1090-A1093 PolarHBondContact O-N 3.38Å; N1090-W1094 PolarHBondContact O-N 3.08Å; N1090-W1112 VanDerWaalsContact OD1-CZ2 3.32Å; N1090-W1112 WeakPolarHBondContact OD1-CZ2 3.39Å
1091	R	86.5	Confident	88.4	Confident	95 Å²	95	47.4 Å²	47.4	36%	0.358	22%	0.224	S	C	.	.	H	α-helix	trans	-71.3	-37.9	177.5	-169.5	175.9	178.5	175.4	1.3	112.1	L1083 E1088 W1089 L1095	L1083-R1091 HydrophobicContact CD1-CG 4.21Å; L1083-R1091 HydrophobicContact CD2-CG 4.48Å; E1088-R1091 HydrophobicContact CB-CB 4.31Å; E1088-R1091 PolarHBondContact O-N 3.06Å; W1089-R1091 VanDerWaalsContact C-N 3.28Å; W1089-R1091 PolarHBondContact O-N 2.9Å; R1091-L1095 WeakPolarHBondContact O-CB 3.4Å; R1091-L1095 PolarHBondContact O-N 3.23Å
1092	A	90.6	Very high	88.1	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-62.8	-43.7	173.3	0	0	0	0	0	111.6	L1083 Q1084 E1088 W1089 L1095 A1096	L1083-A1092 HydrophobicContact CB-CB 3.8Å; L1083-A1092 HydrophobicContact CD1-CB 4.35Å; Q1084-A1092 HydrophobicContact CG-CB 3.85Å; E1088-A1092 PolarHBondContact O-N 3.49Å; W1089-A1092 PolarHBondContact O-N 3.43Å; A1092-L1095 PolarHBondContact O-N 3.09Å; A1092-A1096 VanDerWaalsContact O-CB 3.29Å; A1092-A1096 WeakPolarHBondContact O-CB 3.31Å; A1092-A1096 PolarHBondContact O-N 3.03Å
1093	A	89.2	Confident	87.8	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.008	25%	0.253	C	S	.	.	H	α-helix	trans	-63.4	-43.7	177.4	0	0	0	0	0	112.2	V969 W1089 N1090 A1096 K1097 L1109 W1112	V969-A1093 HydrophobicContact CG1-CB 4.17Å; W1089-A1093 WeakPolarHBondContact O-CB 3.37Å; W1089-A1093 PolarHBondContact O-N 3.04Å; N1090-A1093 PolarHBondContact O-N 3.38Å; A1093-A1096 PolarHBondContact O-N 3.09Å; A1093-K1097 PolarHBondContact O-N 3.49Å; A1093-K1097 VanDerWaalsContact O-N 3.08Å; A1093-L1109 HydrophobicContact CB-CD2 3.71Å; A1093-W1112 HydrophobicContact CB-CD2 4.22Å; A1093-W1112 HydrophobicContact CB-CE3 3.73Å; A1093-W1112 HydrophobicContact CB-CH2 4.2Å; A1093-W1112 HydrophobicContact CB-CZ3 3.72Å
1094	W	90.3	Very high	87.7	Confident	30 Å²	30	54.7 Å²	54.7	11%	0.114	27%	0.274	C	S	.	.	H	α-helix	trans	-59.6	-49.3	174.4	-179.4	94.6	0	0	0	111.8	F976 Q980 L1006 N1090 A1096 K1097 V1098	F976-W1094 AromaticContact CE1-CD1 3.74Å; F976-W1094 HydrophobicContact CE1-CG 4.4Å; F976-W1094 AromaticContact CE1-NE1 3.96Å; F976-W1094 AromaticContact CZ-CD1 3.61Å; F976-W1094 AromaticContact CZ-NE1 3.95Å; Q980-W1094 HydrophobicContact CG-CZ2 4.4Å; L1006-W1094 HydrophobicContact CB-CH2 4.2Å; L1006-W1094 HydrophobicContact CB-CZ3 4.07Å; L1006-W1094 HydrophobicContact CD1-CH2 4.47Å; L1006-W1094 HydrophobicContact CD1-CZ3 4.04Å; N1090-W1094 PolarHBondContact O-N 3.08Å; W1094-A1096 VanDerWaalsContact C-N 3.32Å; W1094-A1096 PolarHBondContact O-N 3.13Å; W1094-K1097 PolarHBondContact O-N 3.48Å; W1094-V1098 HydrophobicContact CD2-CG2 4.2Å; W1094-V1098 HydrophobicContact CE3-CG2 4.5Å; W1094-V1098 HydrophobicContact CH2-CG2 4.32Å; W1094-V1098 HydrophobicContact CZ2-CG2 4.02Å; W1094-V1098 WeakPolarHBondContact O-CG2 3.07Å; W1094-V1098 PolarHBondContact O-N 2.96Å; W1094-V1098 VanDerWaalsContact O-N 3.13Å
1095	L	88.8	Confident	87.5	Confident	3 Å²	3	54.2 Å²	54.2	2%	0.016	27%	0.272	C	S	.	.	H	α-helix	trans	-63	-41	-179.5	-178.4	61.4	0	0	0	111.8	L1006 V1067 A1079 L1083 R1091 A1092 K1097 V1098 R1099	L1006-L1095 HydrophobicContact CB-CD1 4.41Å; L1006-L1095 HydrophobicContact CD2-CD1 3.98Å; V1067-L1095 HydrophobicContact CG1-CD2 3.77Å; A1079-L1095 HydrophobicContact CB-CD2 4.26Å; L1083-L1095 HydrophobicContact CD1-CD2 3.99Å; R1091-L1095 WeakPolarHBondContact O-CB 3.4Å; R1091-L1095 PolarHBondContact O-N 3.23Å; A1092-L1095 PolarHBondContact O-N 3.09Å; L1095-K1097 VanDerWaalsContact C-N 3.33Å; L1095-K1097 PolarHBondContact O-N 3.26Å; L1095-V1098 PolarHBondContact O-N 3.04Å; L1095-R1099 HydrophobicContact CD1-CB 4.38Å; L1095-R1099 PolarHBondContact O-N 2.83Å
1096	A	88.8	Confident	87.4	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-60.5	-42.1	176.8	0	0	0	0	0	111.9	A1092 A1093 W1094 V1098 L1100 C1105 V1108	A1092-A1096 VanDerWaalsContact O-CB 3.29Å; A1092-A1096 WeakPolarHBondContact O-CB 3.31Å; A1092-A1096 PolarHBondContact O-N 3.03Å; A1093-A1096 PolarHBondContact O-N 3.09Å; W1094-A1096 VanDerWaalsContact C-N 3.32Å; W1094-A1096 PolarHBondContact O-N 3.13Å; A1096-V1098 VanDerWaalsContact C-N 3.34Å; A1096-L1100 HydrophobicContact CB-CD1 3.82Å; A1096-L1100 HydrophobicContact CB-CG 4.48Å; A1096-L1100 WeakPolarHBondContact O-CB 3.36Å; A1096-L1100 PolarHBondContact O-N 3.5Å; A1096-C1105 VanDerWaalsContact C-SG 3.57Å; A1096-C1105 PolarHBondContact O-SG 2.78Å; A1096-C1105 VanDerWaalsContact O-SG 3.4Å; A1096-V1108 HydrophobicContact CB-CB 3.99Å; A1096-V1108 HydrophobicContact CB-CG1 3.88Å; A1096-V1108 HydrophobicContact CB-CG2 4.38Å
1097	K	87.4	Confident	87.5	Confident	7 Å²	7	48.6 Å²	48.6	3%	0.03	25%	0.248	C	C	.	.	H	α-helix	trans	-68.6	-31.9	178.8	-79.8	-72.9	-178.8	161.8	0	113.6	V969 C971 N973 F976 A1093 W1094 L1095 L1109	V969-K1097 HydrophobicContact CG1-CG 4.09Å; V969-K1097 WeakPolarHBondContact O-CE 3.27Å; C971-K1097 PolarHBondContact O-NZ 2.87Å; N973-K1097 WeakPolarHBondContact OD1-CD 3.42Å; N973-K1097 WeakPolarHBondContact OD1-CE 3.48Å; N973-K1097 PolarHBondContact OD1-NZ 3.43Å; F976-K1097 HydrophobicContact CD1-CB 3.73Å; F976-K1097 HydrophobicContact CE1-CB 4.01Å; A1093-K1097 PolarHBondContact O-N 3.49Å; A1093-K1097 VanDerWaalsContact O-N 3.08Å; W1094-K1097 PolarHBondContact O-N 3.48Å; L1095-K1097 VanDerWaalsContact C-N 3.33Å; L1095-K1097 PolarHBondContact O-N 3.26Å; K1097-L1109 HydrophobicContact CD-CD1 4.46Å
1098	V	86.9	Confident	87.8	Confident	3 Å²	3	46.6 Å²	46.6	2%	0.018	23%	0.227	C	C	.	.	H	α-helix	trans	-83.8	-40.8	-175.3	165.3	0	0	0	0	113	F976 Q977 Q980 L1007 W1094 L1095 A1096	F976-V1098 HydrophobicContact CD1-CG2 3.97Å; F976-V1098 HydrophobicContact CE1-CG2 3.84Å; Q977-V1098 PolarHBondContact NE2-O 3.07Å; Q980-V1098 HydrophobicContact CG-CG2 4.18Å; L1007-V1098 HydrophobicContact CB-CG1 4.36Å; L1007-V1098 HydrophobicContact CD2-CB 4.4Å; L1007-V1098 HydrophobicContact CD2-CG1 3.35Å; L1007-V1098 HydrophobicContact CD2-CG2 4.15Å; L1007-V1098 HydrophobicContact CG-CG1 4Å; W1094-V1098 HydrophobicContact CD2-CG2 4.2Å; W1094-V1098 HydrophobicContact CE3-CG2 4.5Å; W1094-V1098 HydrophobicContact CH2-CG2 4.32Å; W1094-V1098 HydrophobicContact CZ2-CG2 4.02Å; W1094-V1098 WeakPolarHBondContact O-CG2 3.07Å; W1094-V1098 PolarHBondContact O-N 2.96Å; W1094-V1098 VanDerWaalsContact O-N 3.13Å; L1095-V1098 PolarHBondContact O-N 3.04Å; A1096-V1098 VanDerWaalsContact C-N 3.34Å
1099	R	85	Confident	88.1	Confident	78 Å²	78	42.2 Å²	42.2	29%	0.294	21%	0.206	S	C	.	.	H	α-helix	trans	-115.7	-27.5	-167.2	-170.1	64.4	178	171.3	1.9	114.5	D1074 A1076 L1095	D1074-R1099 IonicContact OD1-CZ 2.96Å; D1074-R1099 IonicContact OD1-NE 3.59Å; D1074-R1099 IonicContact OD1-NH2 3.88Å; D1074-R1099 PolarHBondContact OD1-NH2 2.96Å; A1076-R1099 HydrophobicContact CB-CB 4.39Å; A1076-R1099 HydrophobicContact CB-CG 3.85Å; L1095-R1099 HydrophobicContact CD1-CB 4.38Å; L1095-R1099 PolarHBondContact O-N 2.83Å
1100	L	86.7	Confident	88.2	Confident	13 Å²	13	44 Å²	44	7%	0.068	22%	0.215	C	C	.	.	S	Bend	trans	-86.7	152.9	-174.9	-59.2	-180	0	0	0	112.2	A1076 A1077 A1096 E1104 C1105 V1108	A1076-L1100 HydrophobicContact CB-CD2 3.6Å; A1077-L1100 HydrophobicContact CB-CD2 4.13Å; A1096-L1100 HydrophobicContact CB-CD1 3.82Å; A1096-L1100 HydrophobicContact CB-CG 4.48Å; A1096-L1100 WeakPolarHBondContact O-CB 3.36Å; A1096-L1100 PolarHBondContact O-N 3.5Å; L1100-E1104 HydrophobicContact CB-CB 4.15Å; L1100-E1104 HydrophobicContact CD1-CB 4.28Å; L1100-C1105 HydrophobicContact CB-CB 4.22Å; L1100-V1108 HydrophobicContact CD1-CG2 3.88Å
1101	N	87.1	Confident	88.4	Confident	110 Å²	110	46.6 Å²	46.6	59%	0.588	22%	0.222	S	C	*	.			trans	-62.1	153.3	168.4	-69	-3.9	0	0	0	110.2	E1103 E1104 C1105	N1101-E1103 PolarHBondContact O-N 3.33Å; N1101-E1103 VanDerWaalsContact O-N 3.11Å; N1101-E1104 PolarHBondContact O-N 3.2Å; N1101-C1105 VanDerWaalsContact O-CB 3.23Å; N1101-C1105 WeakPolarHBondContact O-CB 3.17Å; N1101-C1105 PolarHBondContact O-N 3.13Å
1102	P	84.4	Confident	88.7	Confident	95 Å²	95	42.5 Å²	42.5	62%	0.617	21%	0.207	S	C	*	.	H	α-helix	trans	-52.1	-36.8	-177.5	-29.1	35.5	0	0	0	114.6	A1106	P1102-A1106 WeakPolarHBondContact O-CB 3.12Å; P1102-A1106 PolarHBondContact O-N 2.9Å
1103	E	85.6	Confident	88.7	Confident	166 Å²	166	42.9 Å²	42.9	78%	0.776	21%	0.209	S	C	*	.	H	α-helix	trans	-68.5	-51.7	178.8	-63	-176.7	172.6	0	0	112.5	N1101 C1105 A1106 D1107	N1101-E1103 PolarHBondContact O-N 3.33Å; N1101-E1103 VanDerWaalsContact O-N 3.11Å; E1103-C1105 VanDerWaalsContact C-N 3.28Å; E1103-C1105 PolarHBondContact O-N 2.8Å; E1103-A1106 WeakPolarHBondContact O-CB 3.28Å; E1103-A1106 PolarHBondContact O-N 2.83Å; E1103-A1106 VanDerWaalsContact O-N 3.16Å; E1103-D1107 PolarHBondContact O-N 2.84Å; E1103-D1107 VanDerWaalsContact O-N 3.16Å
1104	E	87	Confident	88.8	Confident	93 Å²	93	48.2 Å²	48.2	44%	0.435	24%	0.238	S	C	.	.	H	α-helix	trans	-64.6	-35.9	177.4	-64.4	-174.8	160.9	0	0	111.6	L1100 N1101 D1107 V1108	L1100-E1104 HydrophobicContact CB-CB 4.15Å; L1100-E1104 HydrophobicContact CD1-CB 4.28Å; N1101-E1104 PolarHBondContact O-N 3.2Å; E1104-D1107 PolarHBondContact O-N 2.88Å; E1104-V1108 WeakPolarHBondContact O-CG2 3.49Å; E1104-V1108 PolarHBondContact O-N 2.77Å
1105	C	88.2	Confident	88.8	Confident	3 Å²	3	49.3 Å²	49.3	2%	0.02	24%	0.244	C	C	.	.	H	α-helix	trans	-60.5	-45.2	173.1	-174.8	0	0	0	0	111	A1096 L1100 N1101 E1103 D1107 V1108 L1109	A1096-C1105 VanDerWaalsContact C-SG 3.57Å; A1096-C1105 PolarHBondContact O-SG 2.78Å; A1096-C1105 VanDerWaalsContact O-SG 3.4Å; L1100-C1105 HydrophobicContact CB-CB 4.22Å; N1101-C1105 VanDerWaalsContact O-CB 3.23Å; N1101-C1105 WeakPolarHBondContact O-CB 3.17Å; N1101-C1105 PolarHBondContact O-N 3.13Å; E1103-C1105 VanDerWaalsContact C-N 3.28Å; E1103-C1105 PolarHBondContact O-N 2.8Å; C1105-D1107 VanDerWaalsContact C-N 3.3Å; C1105-D1107 PolarHBondContact O-N 3.13Å; C1105-V1108 PolarHBondContact O-N 3.36Å; C1105-L1109 WeakPolarHBondContact O-CG 3.32Å; C1105-L1109 PolarHBondContact O-N 3.06Å
1106	A	88.7	Confident	88.6	Confident	19 Å²	19	49.4 Å²	49.4	16%	0.157	24%	0.244	C	C	.	.	H	α-helix	trans	-60	-40.3	177.8	0	0	0	0	0	112	P1102 E1103 V1108 L1109 K1110 L1134	P1102-A1106 WeakPolarHBondContact O-CB 3.12Å; P1102-A1106 PolarHBondContact O-N 2.9Å; E1103-A1106 WeakPolarHBondContact O-CB 3.28Å; E1103-A1106 PolarHBondContact O-N 2.83Å; E1103-A1106 VanDerWaalsContact O-N 3.16Å; A1106-V1108 PolarHBondContact O-N 2.91Å; A1106-L1109 PolarHBondContact O-N 2.71Å; A1106-K1110 WeakPolarHBondContact O-CB 3.33Å; A1106-K1110 VanDerWaalsContact O-CG 3.28Å; A1106-K1110 WeakPolarHBondContact O-CG 3.41Å; A1106-K1110 PolarHBondContact O-N 2.8Å; A1106-L1134 HydrophobicContact CB-CD2 3.87Å
1107	D	89.9	Confident	88.5	Confident	79 Å²	79	51.3 Å²	51.3	42%	0.422	26%	0.257	S	S	.	.	H	α-helix	trans	-64.6	-39.8	177	-75.8	-12.5	0	0	0	113.1	E1103 E1104 C1105 R1111	E1103-D1107 PolarHBondContact O-N 2.84Å; E1103-D1107 VanDerWaalsContact O-N 3.16Å; E1104-D1107 PolarHBondContact O-N 2.88Å; C1105-D1107 VanDerWaalsContact C-N 3.3Å; C1105-D1107 PolarHBondContact O-N 3.13Å; D1107-R1111 PolarHBondContact O-N 3.05Å
1108	V	91.5	Very high	88.5	Confident	3 Å²	3	52.4 Å²	52.4	2%	0.018	27%	0.266	C	S	.	.	H	α-helix	trans	-65.3	-43.8	176	176.6	0	0	0	0	110.4	C1080 Q1084 A1096 L1100 E1104 C1105 A1106 R1111 W1112	C1080-V1108 HydrophobicContact CB-CG1 4.03Å; C1080-V1108 HydrophobicContact CB-CG2 3.87Å; Q1084-V1108 PolarHBondContact NE2-O 3.01Å; A1096-V1108 HydrophobicContact CB-CB 3.99Å; A1096-V1108 HydrophobicContact CB-CG1 3.88Å; A1096-V1108 HydrophobicContact CB-CG2 4.38Å; L1100-V1108 HydrophobicContact CD1-CG2 3.88Å; E1104-V1108 WeakPolarHBondContact O-CG2 3.49Å; E1104-V1108 PolarHBondContact O-N 2.77Å; C1105-V1108 PolarHBondContact O-N 3.36Å; A1106-V1108 PolarHBondContact O-N 2.91Å; V1108-R1111 PolarHBondContact O-N 2.94Å; V1108-W1112 PolarHBondContact O-N 2.81Å; V1108-W1112 VanDerWaalsContact O-N 3.16Å
1109	L	90.8	Very high	88.1	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-70.5	-33.4	-179.8	-67.7	174.1	0	0	0	112.8	V969 A1093 K1097 C1105 A1106 W1112 V1113 V1130 L1134	V969-L1109 HydrophobicContact CG1-CD2 4.36Å; A1093-L1109 HydrophobicContact CB-CD2 3.71Å; K1097-L1109 HydrophobicContact CD-CD1 4.46Å; C1105-L1109 WeakPolarHBondContact O-CG 3.32Å; C1105-L1109 PolarHBondContact O-N 3.06Å; A1106-L1109 PolarHBondContact O-N 2.71Å; L1109-W1112 HydrophobicContact CD2-CE3 3.62Å; L1109-W1112 HydrophobicContact CD2-CZ3 4.06Å; L1109-W1112 CarbonylContact O-C 3.59Å; L1109-W1112 WeakPolarHBondContact O-CA 3.25Å; L1109-W1112 WeakPolarHBondContact O-CB 3.47Å; L1109-W1112 PolarHBondContact O-N 2.84Å; L1109-W1112 VanDerWaalsContact O-N 3.12Å; L1109-V1113 WeakPolarHBondContact O-CG2 3.43Å; L1109-V1113 PolarHBondContact O-N 2.8Å; L1109-V1130 HydrophobicContact CB-CG1 4.1Å; L1109-L1134 HydrophobicContact CB-CD1 3.87Å; L1109-L1134 HydrophobicContact CB-CD2 4.09Å; L1109-L1134 HydrophobicContact CB-CG 4.41Å; L1109-L1134 HydrophobicContact CD1-CD2 3.75Å
1110	K	91.5	Very high	87.6	Confident	89 Å²	89	63.3 Å²	63.3	39%	0.387	33%	0.331	S	S	.	.	H	α-helix	trans	-60.3	-45.1	171.3	-77.2	172.7	-176.2	174	0	111.9	A1106 W1112 V1113 D1114 L1134	A1106-K1110 WeakPolarHBondContact O-CB 3.33Å; A1106-K1110 VanDerWaalsContact O-CG 3.28Å; A1106-K1110 WeakPolarHBondContact O-CG 3.41Å; A1106-K1110 PolarHBondContact O-N 2.8Å; K1110-W1112 PolarHBondContact O-N 3Å; K1110-V1113 WeakPolarHBondContact O-CB 3.44Å; K1110-V1113 PolarHBondContact O-N 2.95Å; K1110-V1113 VanDerWaalsContact O-N 3.11Å; K1110-D1114 PolarHBondContact O-N 2.84Å; K1110-L1134 HydrophobicContact CG-CD1 4.04Å
1111	R	91.9	Very high	87.2	Confident	91 Å²	91	64.7 Å²	64.7	34%	0.343	34%	0.34	S	S	.	.	H	α-helix	trans	-61.5	-34	173.6	-65.1	-178.1	-163.4	101.5	13.2	112.2	W1089 D1107 V1108 D1114 H1115	W1089-R1111 HydrophobicContact CZ3-CB 4.37Å; D1107-R1111 PolarHBondContact O-N 3.05Å; V1108-R1111 PolarHBondContact O-N 2.94Å; R1111-D1114 PolarHBondContact O-N 3.23Å; R1111-H1115 PolarHBondContact O-N 3.11Å; R1111-H1115 VanDerWaalsContact O-N 3.17Å
1112	W	91.8	Very high	86.8	Confident	10 Å²	10	62.8 Å²	62.8	4%	0.038	33%	0.33	C	S	.	.	H	α-helix	trans	-68.7	-39.8	175	-175.1	33.2	0	0	0	111.9	V969 W1089 N1090 A1093 V1108 L1109 K1110 D1114 H1115 L1116 V1130	V969-W1112 HydrophobicContact CG1-CZ3 4.05Å; W1089-W1112 HydrophobicContact CE3-CB 4.07Å; W1089-W1112 AromaticContact CE3-CD1 3.79Å; W1089-W1112 HydrophobicContact CE3-CG 4.25Å; W1089-W1112 HydrophobicContact CZ3-CB 4.49Å; N1090-W1112 VanDerWaalsContact OD1-CZ2 3.32Å; N1090-W1112 WeakPolarHBondContact OD1-CZ2 3.39Å; A1093-W1112 HydrophobicContact CB-CD2 4.22Å; A1093-W1112 HydrophobicContact CB-CE3 3.73Å; A1093-W1112 HydrophobicContact CB-CH2 4.2Å; A1093-W1112 HydrophobicContact CB-CZ3 3.72Å; V1108-W1112 PolarHBondContact O-N 2.81Å; V1108-W1112 VanDerWaalsContact O-N 3.16Å; L1109-W1112 HydrophobicContact CD2-CE3 3.62Å; L1109-W1112 HydrophobicContact CD2-CZ3 4.06Å; L1109-W1112 CarbonylContact O-C 3.59Å; L1109-W1112 WeakPolarHBondContact O-CA 3.25Å; L1109-W1112 WeakPolarHBondContact O-CB 3.47Å; L1109-W1112 PolarHBondContact O-N 2.84Å; L1109-W1112 VanDerWaalsContact O-N 3.12Å; K1110-W1112 PolarHBondContact O-N 3Å; W1112-D1114 VanDerWaalsContact C-N 3.33Å; W1112-D1114 PolarHBondContact O-N 3.09Å; W1112-H1115 WeakPolarHBondContact O-CB 3.22Å; W1112-H1115 PolarHBondContact O-N 3.13Å; W1112-H1115 VanDerWaalsContact O-N 3.16Å; W1112-L1116 HydrophobicContact CD2-CD1 4.14Å; W1112-L1116 HydrophobicContact CG-CD1 4.41Å; W1112-L1116 HydrophobicContact CZ2-CD1 4.32Å; W1112-L1116 WeakPolarHBondContact O-CG 3.41Å; W1112-L1116 PolarHBondContact O-N 2.88Å; W1112-V1130 HydrophobicContact CE3-CG1 4.38Å; W1112-V1130 HydrophobicContact CE3-CG2 4.09Å; W1112-V1130 HydrophobicContact CH2-CG2 4.44Å; W1112-V1130 HydrophobicContact CZ3-CG2 3.75Å
1113	V	91.3	Very high	86.7	Confident	7 Å²	7	59.8 Å²	59.8	4%	0.042	31%	0.307	C	S	.	.	H	α-helix	trans	-57	-46.4	172	165.5	0	0	0	0	110.9	L1109 K1110 H1115 L1116 C1117 A1127 V1130 L1131	L1109-V1113 WeakPolarHBondContact O-CG2 3.43Å; L1109-V1113 PolarHBondContact O-N 2.8Å; K1110-V1113 WeakPolarHBondContact O-CB 3.44Å; K1110-V1113 PolarHBondContact O-N 2.95Å; K1110-V1113 VanDerWaalsContact O-N 3.11Å; V1113-H1115 VanDerWaalsContact C-N 3.26Å; V1113-H1115 PolarHBondContact O-N 2.91Å; V1113-L1116 PolarHBondContact O-N 3.47Å; V1113-L1116 VanDerWaalsContact O-N 3.15Å; V1113-C1117 WeakPolarHBondContact O-CB 3.24Å; V1113-C1117 PolarHBondContact O-N 3.39Å; V1113-C1117 PolarHBondContact O-SG 2.75Å; V1113-A1127 HydrophobicContact CG1-CB 4.23Å; V1113-V1130 HydrophobicContact CG2-CB 3.93Å; V1113-V1130 HydrophobicContact CG2-CG1 3.66Å; V1113-L1131 HydrophobicContact CB-CD2 4.49Å; V1113-L1131 HydrophobicContact CG1-CD1 3.95Å; V1113-L1131 HydrophobicContact CG1-CD2 3.97Å; V1113-L1131 HydrophobicContact CG1-CG 3.84Å; V1113-L1131 HydrophobicContact CG2-CD2 4.11Å; V1113-L1131 HydrophobicContact CG2-CG 3.96Å
1114	D	90.6	Very high	86.7	Confident	113 Å²	113	54.9 Å²	54.9	60%	0.604	28%	0.283	S	S	*	.	H	α-helix	trans	-59.3	-39.7	177.1	-62.8	-31.8	0	0	0	111.8	K1110 R1111 W1112 S1118	K1110-D1114 PolarHBondContact O-N 2.84Å; R1111-D1114 PolarHBondContact O-N 3.23Å; W1112-D1114 VanDerWaalsContact C-N 3.33Å; W1112-D1114 PolarHBondContact O-N 3.09Å; D1114-S1118 PolarHBondContact O-N 2.9Å; D1114-S1118 VanDerWaalsContact O-N 3.14Å
1115	H	90	Very high	86.6	Confident	54 Å²	54	52.6 Å²	52.6	25%	0.25	28%	0.278	C	S	.	.	H	α-helix	trans	-66.1	-43.6	174.7	178.5	67.1	0	0	0	112.6	W1089 R1111 W1112 V1113 C1117 S1118	W1089-H1115 AromaticContact CD1-CD2 3.48Å; W1089-H1115 VanDerWaalsContact CD1-CD2 3.48Å; W1089-H1115 AromaticContact CD1-NE2 3.37Å; W1089-H1115 HydrophobicContact CD2-CB 4.14Å; W1089-H1115 AromaticContact CD2-CD2 3.71Å; W1089-H1115 AromaticContact CD2-CG 3.88Å; W1089-H1115 AromaticContact CE2-CD2 3.59Å; W1089-H1115 AromaticContact CE2-CE1 3.98Å; W1089-H1115 AromaticContact CE2-CG 3.46Å; W1089-H1115 VanDerWaalsContact CE2-CG 3.46Å; W1089-H1115 AromaticContact CE2-ND1 3.73Å; W1089-H1115 AromaticContact CE2-NE2 3.91Å; W1089-H1115 HydrophobicContact CE3-CB 4.16Å; W1089-H1115 AromaticContact CG-CD2 3.69Å; W1089-H1115 HydrophobicContact CH2-CB 3.86Å; W1089-H1115 HydrophobicContact CZ2-CB 3.83Å; W1089-H1115 AromaticContact CZ2-CG 3.68Å; W1089-H1115 AromaticContact CZ2-ND1 3.79Å; W1089-H1115 HydrophobicContact CZ3-CB 4.01Å; W1089-H1115 AromaticContact NE1-CD2 3.42Å; W1089-H1115 PolarHBondContact NE1-CD2 2.93Å; W1089-H1115 AromaticContact NE1-CE1 3.43Å; W1089-H1115 PolarHBondContact NE1-CE1 2.83Å; W1089-H1115 AromaticContact NE1-CG 3.65Å; W1089-H1115 AromaticContact NE1-ND1 3.66Å; W1089-H1115 AromaticContact NE1-NE2 3.27Å; W1089-H1115 PolarHBondContact NE1-NE2 3.26Å; R1111-H1115 PolarHBondContact O-N 3.11Å; R1111-H1115 VanDerWaalsContact O-N 3.17Å; W1112-H1115 WeakPolarHBondContact O-CB 3.22Å; W1112-H1115 PolarHBondContact O-N 3.13Å; W1112-H1115 VanDerWaalsContact O-N 3.16Å; V1113-H1115 VanDerWaalsContact C-N 3.26Å; V1113-H1115 PolarHBondContact O-N 2.91Å; H1115-C1117 VanDerWaalsContact C-N 3.32Å; H1115-C1117 PolarHBondContact O-N 3.14Å; H1115-S1118 WeakPolarHBondContact O-CB 3.31Å; H1115-S1118 PolarHBondContact O-N 3.06Å; H1115-S1118 VanDerWaalsContact O-N 3.14Å; H1115-S1118 PolarHBondContact O-OG 3.14Å
1116	L	85.9	Confident	86.6	Confident	4 Å²	4	54.9 Å²	54.9	2%	0.021	29%	0.287	C	S	.	.	H	α-helix	trans	-64.7	-36.8	177.7	-68.9	173.8	0	0	0	112.1	W1112 V1113 S1118 V1121 N1122 Q1123 K1126 A1127	W1112-L1116 HydrophobicContact CD2-CD1 4.14Å; W1112-L1116 HydrophobicContact CG-CD1 4.41Å; W1112-L1116 HydrophobicContact CZ2-CD1 4.32Å; W1112-L1116 WeakPolarHBondContact O-CG 3.41Å; W1112-L1116 PolarHBondContact O-N 2.88Å; V1113-L1116 PolarHBondContact O-N 3.47Å; V1113-L1116 VanDerWaalsContact O-N 3.15Å; L1116-S1118 VanDerWaalsContact C-N 3.25Å; L1116-S1118 PolarHBondContact O-N 3.25Å; L1116-V1121 HydrophobicContact CD2-CG1 4.18Å; L1116-N1122 PolarHBondContact O-N 3.33Å; L1116-Q1123 HydrophobicContact CD2-CB 4.13Å; L1116-Q1123 PolarHBondContact O-N 2.77Å; L1116-K1126 HydrophobicContact CD1-CB 4.46Å; L1116-K1126 HydrophobicContact CD1-CG 4.21Å; L1116-A1127 HydrophobicContact CB-CB 3.89Å; L1116-A1127 HydrophobicContact CD1-CB 4.23Å
1117	C	86.5	Confident	86.6	Confident	41 Å²	41	54 Å²	54	28%	0.277	28%	0.28	S	S	.	.	H	α-helix	trans	-74.8	-11.9	175.4	-72.9	0	0	0	0	113.6	V1113 H1115	V1113-C1117 WeakPolarHBondContact O-CB 3.24Å; V1113-C1117 PolarHBondContact O-N 3.39Å; V1113-C1117 PolarHBondContact O-SG 2.75Å; H1115-C1117 VanDerWaalsContact C-N 3.32Å; H1115-C1117 PolarHBondContact O-N 3.14Å
1118	S	86.3	Confident	86.6	Confident	29 Å²	29	50.4 Å²	50.4	20%	0.203	26%	0.261	C	S	.	.	S	Bend	trans	-60.5	147.2	178.4	78.2	0	0	0	0	111.4	D1114 H1115 L1116 Q1120 V1121 N1122	D1114-S1118 PolarHBondContact O-N 2.9Å; D1114-S1118 VanDerWaalsContact O-N 3.14Å; H1115-S1118 WeakPolarHBondContact O-CB 3.31Å; H1115-S1118 PolarHBondContact O-N 3.06Å; H1115-S1118 VanDerWaalsContact O-N 3.14Å; H1115-S1118 PolarHBondContact O-OG 3.14Å; L1116-S1118 VanDerWaalsContact C-N 3.25Å; L1116-S1118 PolarHBondContact O-N 3.25Å; S1118-Q1120 PolarHBondContact O-N 3.31Å; S1118-V1121 PolarHBondContact O-N 3.27Å; S1118-N1122 PolarHBondContact O-N 3.09Å
1119	P	79.7	Confident	86.6	Confident	128 Å²	128	51.7 Å²	51.7	83%	0.831	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-16.9	-175.9	25.2	-34.8	0	0	0	113.9
1120	Q	74.8	Confident	86.6	Confident	182 Å²	182	51.8 Å²	51.8	85%	0.85	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-34.6	178.3	-65.1	-178.6	-3.1	0	0	112.7	S1118	S1118-Q1120 PolarHBondContact O-N 3.31Å
1121	V	76.7	Confident	86.6	Confident	43 Å²	43	48 Å²	48	26%	0.261	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-44.6	-176.8	-178.1	0	0	0	0	110.9	L1116 S1118 Q1123	L1116-V1121 HydrophobicContact CD2-CG1 4.18Å; S1118-V1121 PolarHBondContact O-N 3.27Å; V1121-Q1123 VanDerWaalsContact C-N 3.26Å; V1121-Q1123 HydrophobicContact CG1-CB 4.14Å; V1121-Q1123 HydrophobicContact CG1-CG 3.95Å; V1121-Q1123 PolarHBondContact O-N 2.77Å
1122	N	80.1	Confident	86.5	Confident	69 Å²	69	43.7 Å²	43.7	37%	0.369	24%	0.236	S	C	.	.			trans	46	44.5	175.3	-164.8	55.6	0	0	0	114.1	L1116 S1118 K1124	L1116-N1122 PolarHBondContact O-N 3.33Å; S1118-N1122 PolarHBondContact O-N 3.09Å; N1122-K1124 WeakPolarHBondContact OD1-CE 3.46Å
1123	Q	82.1	Confident	86.4	Confident	32 Å²	32	43.8 Å²	43.8	15%	0.15	24%	0.238	C	C	.	.			trans	-105	59.7	174.1	-71.6	176.2	9.5	0	0	109.4	N124 L1116 V1121 S1125 K1126 A1127	N124-Q1123 PolarHBondContact ND2-NE2 3.05Å; L1116-Q1123 HydrophobicContact CD2-CB 4.13Å; L1116-Q1123 PolarHBondContact O-N 2.77Å; V1121-Q1123 VanDerWaalsContact C-N 3.26Å; V1121-Q1123 HydrophobicContact CG1-CB 4.14Å; V1121-Q1123 HydrophobicContact CG1-CG 3.95Å; V1121-Q1123 PolarHBondContact O-N 2.77Å; Q1123-S1125 VanDerWaalsContact C-N 3.34Å; Q1123-K1126 HydrophobicContact CB-CB 4.37Å; Q1123-K1126 PolarHBondContact O-N 3.37Å; Q1123-A1127 PolarHBondContact O-N 3.05Å; Q1123-A1127 VanDerWaalsContact O-N 3.11Å
1124	K	85.4	Confident	86.2	Confident	63 Å²	63	45.1 Å²	45.1	27%	0.274	25%	0.245	S	C	.	.	H	α-helix	trans	-67.9	-30.8	-178	-60.5	-176.5	177.2	-176	0	112.6	D126 N1122 A1127 L1128 M1147	D126-K1124 VanDerWaalsContact OD2-CA 3.32Å; D126-K1124 WeakPolarHBondContact OD2-CA 3.35Å; D126-K1124 WeakPolarHBondContact OD2-CB 3.17Å; D126-K1124 PolarHBondContact OD2-N 3.34Å; N1122-K1124 WeakPolarHBondContact OD1-CE 3.46Å; K1124-A1127 WeakPolarHBondContact O-CB 3.24Å; K1124-A1127 PolarHBondContact O-N 2.73Å; K1124-L1128 WeakPolarHBondContact O-CG 3.34Å; K1124-L1128 PolarHBondContact O-N 3.3Å; K1124-M1147 HydrophobicContact CB-CE 3.49Å; K1124-M1147 VanDerWaalsContact CB-CE 3.49Å; K1124-M1147 HydrophobicContact CB-SD 3.61Å; K1124-M1147 HydrophobicContact CD-CE 3.84Å; K1124-M1147 HydrophobicContact CD-CG 4.03Å; K1124-M1147 HydrophobicContact CD-SD 3.61Å; K1124-M1147 HydrophobicContact CG-CE 4.19Å; K1124-M1147 HydrophobicContact CG-SD 4.28Å
1125	S	85.8	Confident	86	Confident	46 Å²	46	41.3 Å²	41.3	32%	0.322	23%	0.232	S	C	.	.	H	α-helix	trans	-60.2	-47.5	173.4	58	0	0	0	0	112	D126 Q1123 A1127 L1128 L1129	D126-S1125 WeakPolarHBondContact OD1-CB 3.38Å; D126-S1125 PolarHBondContact OD1-OG 2.96Å; D126-S1125 PolarHBondContact OD2-N 2.91Å; Q1123-S1125 VanDerWaalsContact C-N 3.34Å; S1125-A1127 VanDerWaalsContact C-N 3.31Å; S1125-A1127 PolarHBondContact O-N 3.25Å; S1125-L1128 WeakPolarHBondContact O-CB 3.02Å; S1125-L1128 PolarHBondContact O-N 3.31Å; S1125-L1129 PolarHBondContact O-N 3.43Å
1126	K	86.3	Confident	85.9	Confident	50 Å²	50	40.1 Å²	40.1	22%	0.217	23%	0.229	C	C	.	.	H	α-helix	trans	-62.3	-39.5	173.5	-170.7	171.3	-179	171.8	0	111.5	L1116 Q1123 L1128 L1129 V1130	L1116-K1126 HydrophobicContact CD1-CB 4.46Å; L1116-K1126 HydrophobicContact CD1-CG 4.21Å; Q1123-K1126 HydrophobicContact CB-CB 4.37Å; Q1123-K1126 PolarHBondContact O-N 3.37Å; K1126-L1128 PolarHBondContact O-N 3Å; K1126-L1129 PolarHBondContact O-N 2.93Å; K1126-V1130 WeakPolarHBondContact O-CG2 3.43Å; K1126-V1130 PolarHBondContact O-N 2.94Å; K1126-V1130 VanDerWaalsContact O-N 3.11Å
1127	A	89.2	Confident	86.2	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.008	23%	0.23	C	C	.	.	H	α-helix	trans	-61.4	-40.8	176.3	0	0	0	0	0	112.7	V1113 L1116 Q1123 K1124 S1125 V1130 L1131	V1113-A1127 HydrophobicContact CG1-CB 4.23Å; L1116-A1127 HydrophobicContact CB-CB 3.89Å; L1116-A1127 HydrophobicContact CD1-CB 4.23Å; Q1123-A1127 PolarHBondContact O-N 3.05Å; Q1123-A1127 VanDerWaalsContact O-N 3.11Å; K1124-A1127 WeakPolarHBondContact O-CB 3.24Å; K1124-A1127 PolarHBondContact O-N 2.73Å; S1125-A1127 VanDerWaalsContact C-N 3.31Å; S1125-A1127 PolarHBondContact O-N 3.25Å; A1127-V1130 PolarHBondContact O-N 3.43Å; A1127-L1131 WeakPolarHBondContact O-CG 3.35Å; A1127-L1131 PolarHBondContact O-N 3.28Å
1128	L	91.3	Very high	86.4	Confident	4 Å²	4	41.7 Å²	41.7	2%	0.021	23%	0.232	C	C	.	.	H	α-helix	trans	-60.4	-44.2	174.7	-73.1	166.7	0	0	0	111.9	K1124 S1125 K1126 V1130 L1131 L1132 V1140 T1143 L1144 M1147	K1124-L1128 WeakPolarHBondContact O-CG 3.34Å; K1124-L1128 PolarHBondContact O-N 3.3Å; S1125-L1128 WeakPolarHBondContact O-CB 3.02Å; S1125-L1128 PolarHBondContact O-N 3.31Å; K1126-L1128 PolarHBondContact O-N 3Å; L1128-V1130 VanDerWaalsContact C-N 3.35Å; L1128-V1130 PolarHBondContact O-N 2.84Å; L1128-L1131 PolarHBondContact O-N 2.91Å; L1128-L1132 WeakPolarHBondContact O-CG 3.38Å; L1128-L1132 PolarHBondContact O-N 3.42Å; L1128-V1140 HydrophobicContact CD2-CG1 4.04Å; L1128-T1143 WeakPolarHBondContact CD2-OG1 3.09Å; L1128-L1144 HydrophobicContact CD1-CD2 3.68Å; L1128-L1144 HydrophobicContact CD1-CG 4.46Å; L1128-L1144 HydrophobicContact CD2-CD2 4.05Å; L1128-L1144 HydrophobicContact CD2-CG 3.93Å; L1128-M1147 HydrophobicContact CD1-CE 3.91Å; L1128-M1147 HydrophobicContact CD2-CE 4.33Å; L1128-M1147 HydrophobicContact CG-CE 4.09Å
1129	L	90.6	Very high	86.6	Confident	29 Å²	29	42.4 Å²	42.4	15%	0.152	24%	0.237	C	C	.	.	H	α-helix	trans	-62.5	-42.2	177.7	-62.2	177.8	0	0	0	111.7	H927 F928 V931 L970 S1125 K1126 L1132 S1133	H927-L1129 HydrophobicContact CB-CD1 4.49Å; F928-L1129 HydrophobicContact CB-CD2 4.49Å; V931-L1129 HydrophobicContact CB-CD2 4.3Å; V931-L1129 HydrophobicContact CG2-CD2 4.17Å; L970-L1129 HydrophobicContact CD1-CB 3.8Å; L970-L1129 HydrophobicContact CD1-CD1 4.13Å; L970-L1129 HydrophobicContact CD2-CB 3.98Å; S1125-L1129 PolarHBondContact O-N 3.43Å; K1126-L1129 PolarHBondContact O-N 2.93Å; L1129-L1132 HydrophobicContact CD2-CD1 4.48Å; L1129-L1132 WeakPolarHBondContact O-CB 3.49Å; L1129-L1132 PolarHBondContact O-N 3.03Å; L1129-S1133 PolarHBondContact O-N 3.29Å
1130	V	90.8	Very high	87.2	Confident	3 Å²	3	36.3 Å²	36.3	2%	0.018	20%	0.197	C	C	.	.	H	α-helix	trans	-63.4	-46	175.5	176.6	0	0	0	0	110.8	L970 L1109 W1112 V1113 K1126 A1127 L1128 L1132 S1133 L1134	L970-V1130 HydrophobicContact CD2-CB 4.44Å; L970-V1130 HydrophobicContact CD2-CG2 3.93Å; L1109-V1130 HydrophobicContact CB-CG1 4.1Å; W1112-V1130 HydrophobicContact CE3-CG1 4.38Å; W1112-V1130 HydrophobicContact CE3-CG2 4.09Å; W1112-V1130 HydrophobicContact CH2-CG2 4.44Å; W1112-V1130 HydrophobicContact CZ3-CG2 3.75Å; V1113-V1130 HydrophobicContact CG2-CB 3.93Å; V1113-V1130 HydrophobicContact CG2-CG1 3.66Å; K1126-V1130 WeakPolarHBondContact O-CG2 3.43Å; K1126-V1130 PolarHBondContact O-N 2.94Å; K1126-V1130 VanDerWaalsContact O-N 3.11Å; A1127-V1130 PolarHBondContact O-N 3.43Å; L1128-V1130 VanDerWaalsContact C-N 3.35Å; L1128-V1130 PolarHBondContact O-N 2.84Å; V1130-L1132 VanDerWaalsContact C-N 3.3Å; V1130-L1132 PolarHBondContact O-N 3.3Å; V1130-S1133 PolarHBondContact O-N 3.18Å; V1130-S1133 VanDerWaalsContact O-N 3.16Å; V1130-S1133 PolarHBondContact O-OG 3.39Å; V1130-L1134 HydrophobicContact CG1-CD1 4.36Å; V1130-L1134 WeakPolarHBondContact O-CG 3.48Å; V1130-L1134 PolarHBondContact O-N 3.33Å; V1130-L1134 VanDerWaalsContact O-N 3.12Å
1131	L	90.6	Very high	88	Confident	9 Å²	9	27.7 Å²	27.7	5%	0.047	16%	0.157	C	C	.	.	H	α-helix	trans	-59.7	-38.2	176.2	-75.5	173.5	0	0	0	113	V1113 A1127 L1128 L1134 G1135 C1136 V1140 T1143	V1113-L1131 HydrophobicContact CB-CD2 4.49Å; V1113-L1131 HydrophobicContact CG1-CD1 3.95Å; V1113-L1131 HydrophobicContact CG1-CD2 3.97Å; V1113-L1131 HydrophobicContact CG1-CG 3.84Å; V1113-L1131 HydrophobicContact CG2-CD2 4.11Å; V1113-L1131 HydrophobicContact CG2-CG 3.96Å; A1127-L1131 WeakPolarHBondContact O-CG 3.35Å; A1127-L1131 PolarHBondContact O-N 3.28Å; L1128-L1131 PolarHBondContact O-N 2.91Å; L1131-L1134 PolarHBondContact O-N 2.69Å; L1131-G1135 PolarHBondContact O-N 3.03Å; L1131-C1136 HydrophobicContact CD2-CB 4.1Å; L1131-C1136 PolarHBondContact O-N 2.82Å; L1131-C1136 VanDerWaalsContact O-N 3.13Å; L1131-V1140 HydrophobicContact CB-CG2 3.46Å; L1131-V1140 VanDerWaalsContact CB-CG2 3.46Å; L1131-V1140 HydrophobicContact CD1-CG2 4.4Å; L1131-T1143 HydrophobicContact CD1-CG2 4.38Å
1132	L	90.6	Very high	88.7	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-61.6	-45.9	174	-75.9	171.9	0	0	0	111.4	F928 V931 A932 L1128 L1129 V1130 L1134 G1135 V1140 F1156	F928-L1132 HydrophobicContact CD2-CD1 3.66Å; F928-L1132 HydrophobicContact CE2-CD1 3.64Å; F928-L1132 HydrophobicContact CE2-CG 4.35Å; F928-L1132 HydrophobicContact CG-CD1 4.4Å; F928-L1132 HydrophobicContact CZ-CD1 4.35Å; V931-L1132 HydrophobicContact CB-CD1 4.4Å; V931-L1132 HydrophobicContact CG1-CB 3.88Å; V931-L1132 HydrophobicContact CG1-CD1 4.26Å; A932-L1132 HydrophobicContact CB-CD1 4.02Å; A932-L1132 HydrophobicContact CB-CD2 4.01Å; L1128-L1132 WeakPolarHBondContact O-CG 3.38Å; L1128-L1132 PolarHBondContact O-N 3.42Å; L1129-L1132 HydrophobicContact CD2-CD1 4.48Å; L1129-L1132 WeakPolarHBondContact O-CB 3.49Å; L1129-L1132 PolarHBondContact O-N 3.03Å; V1130-L1132 VanDerWaalsContact C-N 3.3Å; V1130-L1132 PolarHBondContact O-N 3.3Å; L1132-L1134 PolarHBondContact O-N 2.95Å; L1132-G1135 PolarHBondContact O-N 3.43Å; L1132-V1140 HydrophobicContact CD2-CG1 4.05Å; L1132-V1140 HydrophobicContact CD2-CG2 4.09Å; L1132-V1140 HydrophobicContact CG-CG1 4.33Å; L1132-V1140 HydrophobicContact CG-CG2 4.13Å; L1132-F1156 HydrophobicContact CD2-CE2 3.51Å; L1132-F1156 HydrophobicContact CD2-CZ 3.54Å
1133	S	88.8	Confident	89.3	Confident	12 Å²	12	28.3 Å²	28.3	8%	0.084	16%	0.156	C	C	.	.	H	α-helix	trans	-63.1	-23.5	177.4	76.6	0	0	0	0	114.4	Y935 L1129 V1130 G1135	Y935-S1133 WeakPolarHBondContact CE1-O 3Å; Y935-S1133 VanDerWaalsContact CE2-CA 3.46Å; L1129-S1133 PolarHBondContact O-N 3.29Å; V1130-S1133 PolarHBondContact O-N 3.18Å; V1130-S1133 VanDerWaalsContact O-N 3.16Å; V1130-S1133 PolarHBondContact O-OG 3.39Å; S1133-G1135 VanDerWaalsContact C-N 3.34Å
1134	L	87.7	Confident	89.7	Confident	36 Å²	36	26.8 Å²	26.8	19%	0.188	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-5.9	175.7	-65.9	-179.6	0	0	0	112.9	A1106 L1109 K1110 V1130 L1131 L1132 C1136	A1106-L1134 HydrophobicContact CB-CD2 3.87Å; L1109-L1134 HydrophobicContact CB-CD1 3.87Å; L1109-L1134 HydrophobicContact CB-CD2 4.09Å; L1109-L1134 HydrophobicContact CB-CG 4.41Å; L1109-L1134 HydrophobicContact CD1-CD2 3.75Å; K1110-L1134 HydrophobicContact CG-CD1 4.04Å; V1130-L1134 HydrophobicContact CG1-CD1 4.36Å; V1130-L1134 WeakPolarHBondContact O-CG 3.48Å; V1130-L1134 PolarHBondContact O-N 3.33Å; V1130-L1134 VanDerWaalsContact O-N 3.12Å; L1131-L1134 PolarHBondContact O-N 2.69Å; L1132-L1134 PolarHBondContact O-N 2.95Å; L1134-C1136 PolarHBondContact O-N 2.8Å
1135	G	86.2	Confident	90.1	Very high	32 Å²	32	25.9 Å²	25.9	33%	0.33	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	18.3	-173.7	0	0	0	0	0	114.1	L1131 L1132 S1133 F1137	L1131-G1135 PolarHBondContact O-N 3.03Å; L1132-G1135 PolarHBondContact O-N 3.43Å; S1133-G1135 VanDerWaalsContact C-N 3.34Å; G1135-F1137 WeakPolarHBondContact O-CD2 3.38Å; G1135-F1137 VanDerWaalsContact O-CE2 3.28Å; G1135-F1137 WeakPolarHBondContact O-CE2 3.26Å; G1135-F1137 PolarHBondContact O-N 2.89Å
1136	C	89.3	Confident	90.3	Very high	29 Å²	29	27.5 Å²	27.5	20%	0.196	16%	0.157	C	C	.	.			trans	-82.7	59.9	179.4	-68.7	0	0	0	0	111.2	L1131 L1134 F1138 S1139 V1140	L1131-C1136 HydrophobicContact CD2-CB 4.1Å; L1131-C1136 PolarHBondContact O-N 2.82Å; L1131-C1136 VanDerWaalsContact O-N 3.13Å; L1134-C1136 PolarHBondContact O-N 2.8Å; C1136-F1138 VanDerWaalsContact C-N 3.28Å; C1136-F1138 PolarHBondContact O-N 2.99Å; C1136-S1139 PolarHBondContact O-N 3.13Å; C1136-V1140 WeakPolarHBondContact O-CG2 3.31Å; C1136-V1140 PolarHBondContact O-N 2.98Å
1137	F	90.8	Very high	90.3	Very high	9 Å²	9	26.5 Å²	26.5	4%	0.039	15%	0.154	C	C	.	.	H	α-helix	trans	-59.9	-32.7	-170.1	-55.8	-74.1	0	0	0	113.8	L936 L939 G1135 V1140 A1141 F1156 A1165 F1166	L936-F1137 HydrophobicContact CD2-CD1 3.74Å; L936-F1137 HydrophobicContact CD2-CE1 3.44Å; L936-F1137 VanDerWaalsContact CD2-CE1 3.44Å; L936-F1137 HydrophobicContact CD2-CG 4.41Å; L936-F1137 HydrophobicContact CD2-CZ 3.88Å; L936-F1137 HydrophobicContact CG-CD1 4.46Å; L936-F1137 HydrophobicContact CG-CE1 3.9Å; L936-F1137 HydrophobicContact CG-CZ 4.48Å; L939-F1137 HydrophobicContact CD1-CD2 4.47Å; L939-F1137 HydrophobicContact CD1-CE2 3.65Å; L939-F1137 HydrophobicContact CD1-CZ 4.42Å; G1135-F1137 WeakPolarHBondContact O-CD2 3.38Å; G1135-F1137 VanDerWaalsContact O-CE2 3.28Å; G1135-F1137 WeakPolarHBondContact O-CE2 3.26Å; G1135-F1137 PolarHBondContact O-N 2.89Å; F1137-V1140 PolarHBondContact O-N 2.84Å; F1137-A1141 PolarHBondContact O-N 3.04Å; F1137-F1156 HydrophobicContact CB-CZ 4.35Å; F1137-F1156 HydrophobicContact CD1-CE2 4.39Å; F1137-F1156 AromaticContact CD1-CZ 3.81Å; F1137-F1156 HydrophobicContact CD1-CZ 3.81Å; F1137-A1165 HydrophobicContact CD2-CB 3.79Å; F1137-A1165 HydrophobicContact CE2-CB 4.18Å; F1137-A1165 HydrophobicContact CG-CB 4.11Å; F1137-F1166 HydrophobicContact CB-CE1 4.07Å
1138	F	90.3	Very high	90.3	Very high	69 Å²	69	35.1 Å²	35.1	30%	0.303	19%	0.186	S	C	.	.	H	α-helix	trans	-63	-50.6	177.1	178.7	-97.2	0	0	0	112	C1136 V1140 A1141 E1142 F1166 T1172 L1175	C1136-F1138 VanDerWaalsContact C-N 3.28Å; C1136-F1138 PolarHBondContact O-N 2.99Å; F1138-V1140 PolarHBondContact O-N 3.07Å; F1138-A1141 PolarHBondContact O-N 2.76Å; F1138-A1141 VanDerWaalsContact O-N 3.13Å; F1138-E1142 PolarHBondContact O-N 3.49Å; F1138-F1166 HydrophobicContact CB-CE1 4.37Å; F1138-T1172 HydrophobicContact CD2-CG2 3.61Å; F1138-T1172 HydrophobicContact CE2-CG2 3.89Å; F1138-L1175 HydrophobicContact CD2-CD2 3.75Å; F1138-L1175 HydrophobicContact CE2-CB 4.05Å; F1138-L1175 HydrophobicContact CE2-CD2 3.48Å; F1138-L1175 VanDerWaalsContact CE2-CD2 3.48Å; F1138-L1175 HydrophobicContact CE2-CG 4.41Å; F1138-L1175 HydrophobicContact CZ-CD2 4.04Å
1139	S	90.4	Very high	90.3	Very high	45 Å²	45	36.4 Å²	36.4	32%	0.315	19%	0.191	S	C	.	.	H	α-helix	trans	-63.4	-31.3	177.6	-54.6	0	0	0	0	112.2	C1136 T1143	C1136-S1139 PolarHBondContact O-N 3.13Å; S1139-T1143 WeakPolarHBondContact O-CB 3.47Å; S1139-T1143 VanDerWaalsContact O-CG2 3.27Å; S1139-T1143 WeakPolarHBondContact O-CG2 3.47Å; S1139-T1143 PolarHBondContact O-N 3.39Å; S1139-T1143 PolarHBondContact O-OG1 3Å
1140	V	93.1	Very high	90.2	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-63.9	-48.3	172.5	177.4	0	0	0	0	110.7	F928 L1128 L1131 L1132 C1136 F1137 F1138 E1142 T1143 L1144 F1156	F928-V1140 HydrophobicContact CE2-CG1 4.01Å; F928-V1140 HydrophobicContact CZ-CG1 4.3Å; L1128-V1140 HydrophobicContact CD2-CG1 4.04Å; L1131-V1140 HydrophobicContact CB-CG2 3.46Å; L1131-V1140 VanDerWaalsContact CB-CG2 3.46Å; L1131-V1140 HydrophobicContact CD1-CG2 4.4Å; L1132-V1140 HydrophobicContact CD2-CG1 4.05Å; L1132-V1140 HydrophobicContact CD2-CG2 4.09Å; L1132-V1140 HydrophobicContact CG-CG1 4.33Å; L1132-V1140 HydrophobicContact CG-CG2 4.13Å; C1136-V1140 WeakPolarHBondContact O-CG2 3.31Å; C1136-V1140 PolarHBondContact O-N 2.98Å; F1137-V1140 PolarHBondContact O-N 2.84Å; F1138-V1140 PolarHBondContact O-N 3.07Å; V1140-E1142 PolarHBondContact O-N 2.81Å; V1140-T1143 WeakPolarHBondContact CA-OG1 3.38Å; V1140-T1143 PolarHBondContact O-N 3.42Å; V1140-T1143 PolarHBondContact O-OG1 2.68Å; V1140-L1144 HydrophobicContact CG1-CD1 3.95Å; V1140-L1144 HydrophobicContact CG1-CG 4.38Å; V1140-L1144 WeakPolarHBondContact O-CB 3.5Å; V1140-L1144 VanDerWaalsContact O-CG 3.24Å; V1140-L1144 WeakPolarHBondContact O-CG 3.42Å; V1140-L1144 PolarHBondContact O-N 2.87Å; V1140-F1156 HydrophobicContact CB-CE1 3.7Å; V1140-F1156 HydrophobicContact CB-CZ 3.91Å; V1140-F1156 HydrophobicContact CG1-CD1 4.11Å; V1140-F1156 HydrophobicContact CG1-CE1 3.45Å; V1140-F1156 VanDerWaalsContact CG1-CE1 3.45Å; V1140-F1156 HydrophobicContact CG1-CE2 4.37Å; V1140-F1156 HydrophobicContact CG1-CZ 3.57Å
1141	A	91.9	Very high	90.1	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-62.8	-42.3	178.6	0	0	0	0	0	112	F1137 F1138 H1145 F1156 V1157 F1166 L1175	F1137-A1141 PolarHBondContact O-N 3.04Å; F1138-A1141 PolarHBondContact O-N 2.76Å; F1138-A1141 VanDerWaalsContact O-N 3.13Å; A1141-H1145 WeakPolarHBondContact O-CB 3.35Å; A1141-H1145 PolarHBondContact O-N 3.42Å; A1141-F1156 HydrophobicContact CB-CD1 4.34Å; A1141-F1156 HydrophobicContact CB-CE1 4.46Å; A1141-V1157 HydrophobicContact CB-CG2 3.91Å; A1141-F1166 HydrophobicContact CB-CZ 4.2Å; A1141-L1175 HydrophobicContact CB-CD2 3.95Å
1142	E	92.2	Very high	90.1	Very high	100 Å²	100	38.4 Å²	38.4	47%	0.467	20%	0.199	S	C	.	.	H	α-helix	trans	-62.2	-46.9	176.2	-176.1	-176.5	-160.4	0	0	111.9	F1138 V1140 H1145 S1146 L1175	F1138-E1142 PolarHBondContact O-N 3.49Å; V1140-E1142 PolarHBondContact O-N 2.81Å; E1142-H1145 PolarHBondContact O-N 2.94Å; E1142-S1146 WeakPolarHBondContact O-CB 3.37Å; E1142-S1146 PolarHBondContact O-N 2.83Å; E1142-L1175 HydrophobicContact CB-CD2 4.25Å
1143	T	91.2	Very high	90.2	Very high	25 Å²	25	38.4 Å²	38.4	15%	0.153	20%	0.199	C	C	.	.	H	α-helix	trans	-66.3	-41.4	179.7	47.8	0	0	0	0	112	L1128 L1131 S1139 V1140 H1145 S1146 M1147	L1128-T1143 WeakPolarHBondContact CD2-OG1 3.09Å; L1131-T1143 HydrophobicContact CD1-CG2 4.38Å; S1139-T1143 WeakPolarHBondContact O-CB 3.47Å; S1139-T1143 VanDerWaalsContact O-CG2 3.27Å; S1139-T1143 WeakPolarHBondContact O-CG2 3.47Å; S1139-T1143 PolarHBondContact O-N 3.39Å; S1139-T1143 PolarHBondContact O-OG1 3Å; V1140-T1143 WeakPolarHBondContact CA-OG1 3.38Å; V1140-T1143 PolarHBondContact O-N 3.42Å; V1140-T1143 PolarHBondContact O-OG1 2.68Å; T1143-H1145 VanDerWaalsContact C-N 3.34Å; T1143-H1145 PolarHBondContact O-N 2.97Å; T1143-S1146 PolarHBondContact O-N 2.89Å; T1143-S1146 PolarHBondContact O-OG 2.97Å; T1143-M1147 WeakPolarHBondContact O-CG 3.29Å; T1143-M1147 PolarHBondContact O-N 3.07Å
1144	L	91.9	Very high	90.3	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-59.2	-44.3	172.7	-72.7	172	0	0	0	112	F928 L1128 V1140 M1147 R1148 Y1149 R1152 A1153 F1156	F928-L1144 HydrophobicContact CE2-CD1 4.08Å; F928-L1144 HydrophobicContact CE2-CD2 4.45Å; F928-L1144 HydrophobicContact CZ-CD1 3.76Å; L1128-L1144 HydrophobicContact CD1-CD2 3.68Å; L1128-L1144 HydrophobicContact CD1-CG 4.46Å; L1128-L1144 HydrophobicContact CD2-CD2 4.05Å; L1128-L1144 HydrophobicContact CD2-CG 3.93Å; V1140-L1144 HydrophobicContact CG1-CD1 3.95Å; V1140-L1144 HydrophobicContact CG1-CG 4.38Å; V1140-L1144 WeakPolarHBondContact O-CB 3.5Å; V1140-L1144 VanDerWaalsContact O-CG 3.24Å; V1140-L1144 WeakPolarHBondContact O-CG 3.42Å; V1140-L1144 PolarHBondContact O-N 2.87Å; L1144-M1147 PolarHBondContact O-N 2.8Å; L1144-R1148 PolarHBondContact O-N 3.37Å; L1144-Y1149 HydrophobicContact CD2-CD2 3.88Å; L1144-Y1149 PolarHBondContact O-N 3.39Å; L1144-R1152 HydrophobicContact CD1-CG 4.42Å; L1144-R1152 HydrophobicContact CD2-CG 4.32Å; L1144-A1153 HydrophobicContact CB-CB 3.86Å; L1144-F1156 HydrophobicContact CD1-CB 4.37Å; L1144-F1156 HydrophobicContact CD1-CD1 4.24Å; L1144-F1156 HydrophobicContact CD1-CG 4.41Å
1145	H	92.2	Very high	90.4	Very high	45 Å²	45	36.2 Å²	36.2	21%	0.208	19%	0.186	C	C	.	.	H	α-helix	trans	-63.6	-44.5	177	-177	-104.8	0	0	0	111.8	A1141 E1142 T1143 M1147 R1148 V1179 D1182	A1141-H1145 WeakPolarHBondContact O-CB 3.35Å; A1141-H1145 PolarHBondContact O-N 3.42Å; E1142-H1145 PolarHBondContact O-N 2.94Å; T1143-H1145 VanDerWaalsContact C-N 3.34Å; T1143-H1145 PolarHBondContact O-N 2.97Å; H1145-M1147 PolarHBondContact O-N 3.09Å; H1145-R1148 WeakPolarHBondContact O-CA 3.38Å; H1145-R1148 PolarHBondContact O-N 2.96Å; H1145-V1179 HydrophobicContact CB-CG2 4Å; H1145-D1182 IonicContact CD2-OD2 3.99Å; H1145-D1182 IonicContact CE1-OD2 3.13Å; H1145-D1182 IonicContact NE2-OD2 2.78Å; H1145-D1182 PolarHBondContact NE2-OD2 3.35Å
1146	S	90.4	Very high	90.6	Very high	79 Å²	79	34.7 Å²	34.7	55%	0.552	17%	0.171	S	C	*	.	H	α-helix	trans	-61.8	-30.9	176.7	80.4	0	0	0	0	113.2	E1142 T1143 R1148	E1142-S1146 WeakPolarHBondContact O-CB 3.37Å; E1142-S1146 PolarHBondContact O-N 2.83Å; T1143-S1146 PolarHBondContact O-N 2.89Å; T1143-S1146 PolarHBondContact O-OG 2.97Å; S1146-R1148 VanDerWaalsContact C-N 3.26Å; S1146-R1148 PolarHBondContact O-N 2.97Å
1147	M	87.6	Confident	90.7	Very high	30 Å²	30	33.4 Å²	33.4	15%	0.148	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-2.7	174.7	-70.7	-173.6	-119.5	0	0	113.4	K1124 L1128 T1143 L1144 H1145 Y1149	K1124-M1147 HydrophobicContact CB-CE 3.49Å; K1124-M1147 VanDerWaalsContact CB-CE 3.49Å; K1124-M1147 HydrophobicContact CB-SD 3.61Å; K1124-M1147 HydrophobicContact CD-CE 3.84Å; K1124-M1147 HydrophobicContact CD-CG 4.03Å; K1124-M1147 HydrophobicContact CD-SD 3.61Å; K1124-M1147 HydrophobicContact CG-CE 4.19Å; K1124-M1147 HydrophobicContact CG-SD 4.28Å; L1128-M1147 HydrophobicContact CD1-CE 3.91Å; L1128-M1147 HydrophobicContact CD2-CE 4.33Å; L1128-M1147 HydrophobicContact CG-CE 4.09Å; T1143-M1147 WeakPolarHBondContact O-CG 3.29Å; T1143-M1147 PolarHBondContact O-N 3.07Å; L1144-M1147 PolarHBondContact O-N 2.8Å; H1145-M1147 PolarHBondContact O-N 3.09Å; M1147-Y1149 VanDerWaalsContact C-N 3.29Å; M1147-Y1149 HydrophobicContact CB-CD1 4.03Å; M1147-Y1149 HydrophobicContact CB-CD2 4.24Å; M1147-Y1149 HydrophobicContact CB-CE1 4Å; M1147-Y1149 HydrophobicContact CB-CE2 4.23Å; M1147-Y1149 HydrophobicContact CB-CG 4.15Å; M1147-Y1149 WeakPolarHBondContact O-CD1 3.48Å; M1147-Y1149 WeakPolarHBondContact O-CE1 3.31Å; M1147-Y1149 HydrophobicContact SD-CE2 4.11Å
1148	R	89.3	Confident	90.6	Very high	182 Å²	182	34.5 Å²	34.5	69%	0.687	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.6	28	-176.5	-52.4	180	175.5	-173.3	-2.9	113.9	L1144 H1145 S1146 F1150	L1144-R1148 PolarHBondContact O-N 3.37Å; H1145-R1148 WeakPolarHBondContact O-CA 3.38Å; H1145-R1148 PolarHBondContact O-N 2.96Å; S1146-R1148 VanDerWaalsContact C-N 3.26Å; S1146-R1148 PolarHBondContact O-N 2.97Å; R1148-F1150 HydrophobicContact CB-CD2 4.47Å; R1148-F1150 HydrophobicContact CB-CE1 4.29Å; R1148-F1150 HydrophobicContact CB-CE2 3.81Å; R1148-F1150 HydrophobicContact CB-CZ 3.7Å; R1148-F1150 HydrophobicContact CG-CE2 4.41Å; R1148-F1150 HydrophobicContact CG-CZ 3.93Å; R1148-F1150 WeakPolarHBondContact O-CD2 3.24Å; R1148-F1150 PolarHBondContact O-N 2.92Å
1149	Y	89.5	Confident	90.5	Very high	30 Å²	30	31.3 Å²	31.3	12%	0.118	15%	0.153	C	C	.	.			trans	-85.8	64.1	174.8	-61.8	-4.5	0	0	0	109	H75 L1144 M1147 D1151 R1152 A1153	H75-Y1149 HydrophobicContact CB-CD1 3.67Å; H75-Y1149 HydrophobicContact CB-CD2 4.18Å; H75-Y1149 HydrophobicContact CB-CE1 3.32Å; H75-Y1149 HydrophobicContact CB-CE2 3.85Å; H75-Y1149 HydrophobicContact CB-CG 4.1Å; H75-Y1149 VanDerWaalsContact CB-CZ 3.4Å; H75-Y1149 AromaticContact CD2-CD1 3.13Å; H75-Y1149 WeakPolarHBondContact CD2-CD1 3.29Å; H75-Y1149 AromaticContact CD2-CE1 3.53Å; H75-Y1149 AromaticContact CD2-CG 3.83Å; H75-Y1149 AromaticContact CG-CD1 3.41Å; H75-Y1149 VanDerWaalsContact CG-CD1 3.41Å; H75-Y1149 AromaticContact CG-CE1 3.62Å; H75-Y1149 AromaticContact CG-CG 3.78Å; H75-Y1149 AromaticContact NE2-CD1 3.9Å; L1144-Y1149 HydrophobicContact CD2-CD2 3.88Å; L1144-Y1149 PolarHBondContact O-N 3.39Å; M1147-Y1149 VanDerWaalsContact C-N 3.29Å; M1147-Y1149 HydrophobicContact CB-CD1 4.03Å; M1147-Y1149 HydrophobicContact CB-CD2 4.24Å; M1147-Y1149 HydrophobicContact CB-CE1 4Å; M1147-Y1149 HydrophobicContact CB-CE2 4.23Å; M1147-Y1149 HydrophobicContact CB-CG 4.15Å; M1147-Y1149 WeakPolarHBondContact O-CD1 3.48Å; M1147-Y1149 WeakPolarHBondContact O-CE1 3.31Å; M1147-Y1149 HydrophobicContact SD-CE2 4.11Å; Y1149-D1151 PolarHBondContact O-N 3.11Å; Y1149-R1152 PolarHBondContact O-N 2.95Å; Y1149-A1153 VanDerWaalsContact O-CB 3.23Å; Y1149-A1153 WeakPolarHBondContact O-CB 3.4Å; Y1149-A1153 PolarHBondContact O-N 3.2Å
1150	F	89.7	Confident	90.4	Very high	49 Å²	49	29.1 Å²	29.1	22%	0.215	14%	0.138	C	C	.	.	H	α-helix	trans	-63.4	-38.8	-165.3	-59.4	-58.4	0	0	0	113.5	R1148 A1154 D1182 Y1183	R1148-F1150 HydrophobicContact CB-CD2 4.47Å; R1148-F1150 HydrophobicContact CB-CE1 4.29Å; R1148-F1150 HydrophobicContact CB-CE2 3.81Å; R1148-F1150 HydrophobicContact CB-CZ 3.7Å; R1148-F1150 HydrophobicContact CG-CE2 4.41Å; R1148-F1150 HydrophobicContact CG-CZ 3.93Å; R1148-F1150 WeakPolarHBondContact O-CD2 3.24Å; R1148-F1150 PolarHBondContact O-N 2.92Å; F1150-A1154 WeakPolarHBondContact O-CB 3.43Å; F1150-A1154 PolarHBondContact O-N 3.32Å; F1150-D1182 HydrophobicContact CD1-CB 3.62Å; F1150-D1182 HydrophobicContact CE1-CB 3.65Å; F1150-D1182 HydrophobicContact CG-CB 4.31Å; F1150-D1182 HydrophobicContact CZ-CB 4.36Å; F1150-Y1183 HydrophobicContact CB-CD2 4.16Å
1151	D	88.6	Confident	90.1	Very high	26 Å²	26	33.1 Å²	33.1	14%	0.139	16%	0.159	C	C	.	.	H	α-helix	trans	-63.8	-52.6	176.2	59.4	-22.9	0	0	0	111.9	H75 Y1149 A1153 A1154 L1155 Y1183	H75-D1151 IonicContact CE1-OD1 2.8Å; H75-D1151 PolarHBondContact CE1-OD1 3.04Å; H75-D1151 IonicContact CE1-OD2 3.9Å; H75-D1151 IonicContact ND1-OD1 3.12Å; H75-D1151 IonicContact NE2-OD1 3.51Å; Y1149-D1151 PolarHBondContact O-N 3.11Å; D1151-A1153 VanDerWaalsContact C-N 3.33Å; D1151-A1153 PolarHBondContact O-N 2.91Å; D1151-A1154 PolarHBondContact O-N 3.37Å; D1151-L1155 WeakPolarHBondContact O-CB 3.47Å; D1151-L1155 WeakPolarHBondContact O-CG 3.35Å; D1151-L1155 PolarHBondContact O-N 3.46Å; D1151-Y1183 VanDerWaalsContact CA-CE2 3.4Å; D1151-Y1183 HydrophobicContact CB-CD2 4.25Å; D1151-Y1183 HydrophobicContact CB-CE2 3.6Å
1152	R	90.5	Very high	89.7	Confident	9 Å²	9	40 Å²	40	3%	0.034	19%	0.189	C	C	.	.	H	α-helix	trans	-62.8	-41.2	178.6	-164.8	-177.3	-57.9	-178.4	4.5	110.9	S924 E925 F928 W929 L1144 Y1149 F1156	S924-R1152 PolarHBondContact OG-NH2 3.45Å; E925-R1152 VanDerWaalsContact CG-CZ 3.45Å; E925-R1152 IonicContact OE1-CZ 3.66Å; E925-R1152 IonicContact OE1-NE 3.02Å; E925-R1152 IonicContact OE1-NH2 3.57Å; E925-R1152 PolarHBondContact OE1-NH2 2.91Å; F928-R1152 HydrophobicContact CD1-CG 4.06Å; F928-R1152 HydrophobicContact CE1-CG 3.76Å; F928-R1152 HydrophobicContact CZ-CG 4.27Å; W929-R1152 HydrophobicContact CZ2-CG 3.94Å; L1144-R1152 HydrophobicContact CD1-CG 4.42Å; L1144-R1152 HydrophobicContact CD2-CG 4.32Å; Y1149-R1152 PolarHBondContact O-N 2.95Å; R1152-F1156 WeakPolarHBondContact O-CB 3.29Å; R1152-F1156 PolarHBondContact O-N 3.45Å
1153	A	92.3	Very high	89.3	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-62.7	-50	177.6	0	0	0	0	0	111.9	L1144 Y1149 D1151 F1156 V1157 V1179	L1144-A1153 HydrophobicContact CB-CB 3.86Å; Y1149-A1153 VanDerWaalsContact O-CB 3.23Å; Y1149-A1153 WeakPolarHBondContact O-CB 3.4Å; Y1149-A1153 PolarHBondContact O-N 3.2Å; D1151-A1153 VanDerWaalsContact C-N 3.33Å; D1151-A1153 PolarHBondContact O-N 2.91Å; A1153-F1156 PolarHBondContact O-N 3.16Å; A1153-V1157 WeakPolarHBondContact O-CB 3.39Å; A1153-V1157 VanDerWaalsContact O-CG2 3.27Å; A1153-V1157 WeakPolarHBondContact O-CG2 3.28Å; A1153-V1157 PolarHBondContact O-N 2.84Å; A1153-V1179 HydrophobicContact CB-CG1 3.86Å
1154	A	90.3	Very high	88.9	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-64.5	-44.8	-178.8	0	0	0	0	0	112.3	F1150 D1151 F1156 V1157 E1158 V1179 Y1180 Y1183	F1150-A1154 WeakPolarHBondContact O-CB 3.43Å; F1150-A1154 PolarHBondContact O-N 3.32Å; D1151-A1154 PolarHBondContact O-N 3.37Å; A1154-F1156 VanDerWaalsContact C-N 3.34Å; A1154-F1156 PolarHBondContact O-N 2.9Å; A1154-V1157 PolarHBondContact O-N 3.47Å; A1154-E1158 PolarHBondContact O-N 2.91Å; A1154-V1179 HydrophobicContact CB-CG1 3.98Å; A1154-Y1180 HydrophobicContact CB-CD1 4.2Å; A1154-Y1180 HydrophobicContact CB-CE1 4.42Å; A1154-Y1183 HydrophobicContact CB-CD1 3.34Å; A1154-Y1183 HydrophobicContact CB-CE1 4.05Å; A1154-Y1183 HydrophobicContact CB-CG 3.63Å
1155	L	89.8	Confident	88.3	Confident	2 Å²	2	38.1 Å²	38.1	1%	0.01	19%	0.188	C	C	.	.	H	α-helix	trans	-63.1	-40.6	176.7	-77.4	170.4	0	0	0	112.5	L860 H861 L909 W929 D1151 E1158 A1159	L860-L1155 HydrophobicContact CB-CD1 4.27Å; L860-L1155 HydrophobicContact CD1-CD1 3.87Å; L860-L1155 HydrophobicContact CD2-CD1 4.28Å; L860-L1155 HydrophobicContact CG-CD1 4.36Å; H861-L1155 WeakPolarHBondContact CE1-CD2 3.49Å; L909-L1155 HydrophobicContact CD1-CD2 3.74Å; L909-L1155 HydrophobicContact CD2-CD2 4.16Å; L909-L1155 HydrophobicContact CG-CD2 4.25Å; W929-L1155 HydrophobicContact CH2-CB 3.81Å; W929-L1155 HydrophobicContact CZ2-CB 4.14Å; D1151-L1155 WeakPolarHBondContact O-CB 3.47Å; D1151-L1155 WeakPolarHBondContact O-CG 3.35Å; D1151-L1155 PolarHBondContact O-N 3.46Å; L1155-E1158 PolarHBondContact O-N 2.68Å; L1155-A1159 PolarHBondContact O-N 2.88Å
1156	F	92.2	Very high	87.9	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-66.3	-41.7	176.8	178.3	-107.9	0	0	0	111.3	F928 W929 A932 L936 L1132 F1137 V1140 A1141 L1144 R1152 A1153 A1154 E1158 A1159 C1160	F928-F1156 HydrophobicContact CE1-CD2 4.15Å; F928-F1156 HydrophobicContact CZ-CB 4.4Å; F928-F1156 AromaticContact CZ-CD2 3.78Å; F928-F1156 HydrophobicContact CZ-CD2 3.78Å; F928-F1156 HydrophobicContact CZ-CE2 4.16Å; F928-F1156 HydrophobicContact CZ-CG 4.08Å; W929-F1156 HydrophobicContact CH2-CB 4.14Å; W929-F1156 HydrophobicContact CZ3-CB 4.45Å; W929-F1156 HydrophobicContact CZ3-CD2 4.44Å; A932-F1156 HydrophobicContact CB-CD2 4.48Å; A932-F1156 HydrophobicContact CB-CE2 4.17Å; L936-F1156 HydrophobicContact CD1-CE2 4.41Å; L1132-F1156 HydrophobicContact CD2-CE2 3.51Å; L1132-F1156 HydrophobicContact CD2-CZ 3.54Å; F1137-F1156 HydrophobicContact CB-CZ 4.35Å; F1137-F1156 HydrophobicContact CD1-CE2 4.39Å; F1137-F1156 AromaticContact CD1-CZ 3.81Å; F1137-F1156 HydrophobicContact CD1-CZ 3.81Å; V1140-F1156 HydrophobicContact CB-CE1 3.7Å; V1140-F1156 HydrophobicContact CB-CZ 3.91Å; V1140-F1156 HydrophobicContact CG1-CD1 4.11Å; V1140-F1156 HydrophobicContact CG1-CE1 3.45Å; V1140-F1156 VanDerWaalsContact CG1-CE1 3.45Å; V1140-F1156 HydrophobicContact CG1-CE2 4.37Å; V1140-F1156 HydrophobicContact CG1-CZ 3.57Å; A1141-F1156 HydrophobicContact CB-CD1 4.34Å; A1141-F1156 HydrophobicContact CB-CE1 4.46Å; L1144-F1156 HydrophobicContact CD1-CB 4.37Å; L1144-F1156 HydrophobicContact CD1-CD1 4.24Å; L1144-F1156 HydrophobicContact CD1-CG 4.41Å; R1152-F1156 WeakPolarHBondContact O-CB 3.29Å; R1152-F1156 PolarHBondContact O-N 3.45Å; A1153-F1156 PolarHBondContact O-N 3.16Å; A1154-F1156 VanDerWaalsContact C-N 3.34Å; A1154-F1156 PolarHBondContact O-N 2.9Å; F1156-E1158 PolarHBondContact O-N 2.94Å; F1156-A1159 PolarHBondContact O-N 2.93Å; F1156-C1160 WeakPolarHBondContact O-CB 3.32Å; F1156-C1160 PolarHBondContact O-N 3.4Å; F1156-C1160 PolarHBondContact O-SG 3.4Å
1157	V	90.6	Very high	87	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.006	19%	0.192	C	C	.	.	H	α-helix	trans	-61.1	-44.1	174.7	165.8	0	0	0	0	111.4	A1141 A1153 A1154 A1159 C1160 L1161 F1166 I1176 V1179 Y1180	A1141-V1157 HydrophobicContact CB-CG2 3.91Å; A1153-V1157 WeakPolarHBondContact O-CB 3.39Å; A1153-V1157 VanDerWaalsContact O-CG2 3.27Å; A1153-V1157 WeakPolarHBondContact O-CG2 3.28Å; A1153-V1157 PolarHBondContact O-N 2.84Å; A1154-V1157 PolarHBondContact O-N 3.47Å; V1157-A1159 VanDerWaalsContact C-N 3.34Å; V1157-A1159 PolarHBondContact O-N 3.15Å; V1157-C1160 PolarHBondContact O-N 2.86Å; V1157-L1161 HydrophobicContact CG1-CD1 4.17Å; V1157-L1161 WeakPolarHBondContact O-CG 3.44Å; V1157-L1161 PolarHBondContact O-N 2.84Å; V1157-F1166 HydrophobicContact CB-CE2 4.23Å; V1157-F1166 HydrophobicContact CG1-CE2 4.03Å; V1157-F1166 HydrophobicContact CG2-CE2 4.07Å; V1157-F1166 HydrophobicContact CG2-CZ 4.23Å; V1157-I1176 HydrophobicContact CG1-CB 4.37Å; V1157-I1176 HydrophobicContact CG1-CG1 3.79Å; V1157-I1176 HydrophobicContact CG1-CG2 4.06Å; V1157-V1179 HydrophobicContact CG2-CG1 4.44Å; V1157-Y1180 HydrophobicContact CB-CE1 4.5Å; V1157-Y1180 HydrophobicContact CG1-CE1 4.05Å
1158	E	88.1	Confident	86.1	Confident	32 Å²	32	45.5 Å²	45.5	15%	0.15	22%	0.222	C	C	.	.	H	α-helix	trans	-60.6	-42.5	174.7	-76.4	-164.9	156.7	0	0	112.3	L909 A1154 L1155 F1156 L1161 K1162 Y1180 F1199 K1202	L909-E1158 HydrophobicContact CD2-CB 3.85Å; A1154-E1158 PolarHBondContact O-N 2.91Å; L1155-E1158 PolarHBondContact O-N 2.68Å; F1156-E1158 PolarHBondContact O-N 2.94Å; E1158-L1161 PolarHBondContact O-N 3.02Å; E1158-K1162 PolarHBondContact O-N 2.93Å; E1158-Y1180 HydrophobicContact CG-CE1 4.08Å; E1158-Y1180 WeakPolarHBondContact CG-OH 3.38Å; E1158-F1199 HydrophobicContact CG-CE1 4.36Å; E1158-F1199 WeakPolarHBondContact OE1-CE1 3.27Å; E1158-F1199 WeakPolarHBondContact OE1-CZ 3.36Å; E1158-K1202 IonicContact OE1-NZ 2.69Å; E1158-K1202 PolarHBondContact OE1-NZ 3.47Å
1159	A	88	Confident	85.6	Confident	2 Å²	2	39.8 Å²	39.8	2%	0.017	21%	0.207	C	C	.	.	H	α-helix	trans	-62.3	-48	174.6	0	0	0	0	0	111	L909 L910 L936 L1155 F1156 V1157 L1161 K1162 Y1163	L909-A1159 HydrophobicContact CD2-CB 4.48Å; L910-A1159 HydrophobicContact CD2-CB 3.77Å; L910-A1159 HydrophobicContact CG-CB 4.08Å; L936-A1159 HydrophobicContact CD1-CB 4.09Å; L1155-A1159 PolarHBondContact O-N 2.88Å; F1156-A1159 PolarHBondContact O-N 2.93Å; V1157-A1159 VanDerWaalsContact C-N 3.34Å; V1157-A1159 PolarHBondContact O-N 3.15Å; A1159-L1161 VanDerWaalsContact C-N 3.31Å; A1159-L1161 PolarHBondContact O-N 3.32Å; A1159-K1162 PolarHBondContact O-N 2.9Å; A1159-K1162 VanDerWaalsContact O-N 3.13Å; A1159-Y1163 VanDerWaalsContact O-CD2 3.3Å; A1159-Y1163 WeakPolarHBondContact O-CD2 3.32Å; A1159-Y1163 PolarHBondContact O-N 2.82Å
1160	C	89.1	Confident	85.2	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-56.8	-42.1	176.6	-73.1	0	0	0	0	112.3	F1156 V1157 G1164 A1165 F1166	F1156-C1160 WeakPolarHBondContact O-CB 3.32Å; F1156-C1160 PolarHBondContact O-N 3.4Å; F1156-C1160 PolarHBondContact O-SG 3.4Å; V1157-C1160 PolarHBondContact O-N 2.86Å; C1160-G1164 CarbonylContact O-C 3.38Å; C1160-G1164 PolarHBondContact O-N 2.87Å; C1160-A1165 HydrophobicContact CB-CB 4.01Å; C1160-A1165 PolarHBondContact O-N 2.84Å; C1160-F1166 HydrophobicContact CB-CD2 3.66Å; C1160-F1166 HydrophobicContact CB-CE1 4.38Å; C1160-F1166 HydrophobicContact CB-CE2 3.31Å; C1160-F1166 HydrophobicContact CB-CG 4.34Å; C1160-F1166 HydrophobicContact CB-CZ 3.71Å
1161	L	86.2	Confident	84.9	Confident	84 Å²	84	47.7 Å²	47.7	44%	0.44	25%	0.249	S	C	.	.	H	α-helix	trans	-64.6	-42.7	176	-70.4	171.3	0	0	0	111.9	V1157 E1158 A1159 Y1163 G1164 F1166 I1176 Y1180	V1157-L1161 HydrophobicContact CG1-CD1 4.17Å; V1157-L1161 WeakPolarHBondContact O-CG 3.44Å; V1157-L1161 PolarHBondContact O-N 2.84Å; E1158-L1161 PolarHBondContact O-N 3.02Å; A1159-L1161 VanDerWaalsContact C-N 3.31Å; A1159-L1161 PolarHBondContact O-N 3.32Å; L1161-Y1163 PolarHBondContact O-N 3.36Å; L1161-G1164 PolarHBondContact O-N 2.87Å; L1161-G1164 VanDerWaalsContact O-N 3.15Å; L1161-F1166 HydrophobicContact CD2-CD2 4.06Å; L1161-F1166 HydrophobicContact CG-CD2 4.22Å; L1161-I1176 HydrophobicContact CD2-CD1 4.16Å; L1161-Y1180 WeakPolarHBondContact CD1-OH 3.43Å
1162	K	84.6	Confident	84.7	Confident	144 Å²	144	47 Å²	47	63%	0.626	25%	0.246	S	C	*	.	H	α-helix	trans	-63.7	-38.7	179.1	-172.7	176.5	-178.7	178.3	0	112.9	E1158 A1159 G1164	E1158-K1162 PolarHBondContact O-N 2.93Å; A1159-K1162 PolarHBondContact O-N 2.9Å; A1159-K1162 VanDerWaalsContact O-N 3.13Å; K1162-G1164 VanDerWaalsContact C-N 3.31Å
1163	Y	83.7	Confident	84.4	Confident	39 Å²	39	51.8 Å²	51.8	15%	0.153	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	2.5	177.3	-72.1	-93.2	0	0	0	112.9	L910 L936 A1159 L1161 A1165	L910-Y1163 HydrophobicContact CD1-CD2 4.15Å; L910-Y1163 HydrophobicContact CD1-CE2 3.44Å; L910-Y1163 VanDerWaalsContact CD1-CE2 3.44Å; L910-Y1163 HydrophobicContact CG-CE2 4.34Å; L936-Y1163 HydrophobicContact CB-CG 4.33Å; A1159-Y1163 VanDerWaalsContact O-CD2 3.3Å; A1159-Y1163 WeakPolarHBondContact O-CD2 3.32Å; A1159-Y1163 PolarHBondContact O-N 2.82Å; L1161-Y1163 PolarHBondContact O-N 3.36Å; Y1163-A1165 VanDerWaalsContact C-N 3.35Å; Y1163-A1165 PolarHBondContact O-N 2.99Å
1164	G	81.8	Confident	84.2	Confident	32 Å²	32	57.4 Å²	57.4	33%	0.33	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.5	32	178.4	0	0	0	0	0	114	K943 C1160 L1161 K1162	K943-G1164 PolarHBondContact NZ-O 2.82Å; C1160-G1164 CarbonylContact O-C 3.38Å; C1160-G1164 PolarHBondContact O-N 2.87Å; L1161-G1164 PolarHBondContact O-N 2.87Å; L1161-G1164 VanDerWaalsContact O-N 3.15Å; K1162-G1164 VanDerWaalsContact C-N 3.31Å
1165	A	81.1	Confident	84.1	Confident	15 Å²	15	58.4 Å²	58.4	12%	0.124	30%	0.298	C	S	.	.			trans	-77.3	-25.9	-177.3	0	0	0	0	0	113.8	L936 L939 F1137 C1160 Y1163	L936-A1165 HydrophobicContact CD2-CB 3.84Å; L939-A1165 HydrophobicContact CD2-CB 4.23Å; F1137-A1165 HydrophobicContact CD2-CB 3.79Å; F1137-A1165 HydrophobicContact CE2-CB 4.18Å; F1137-A1165 HydrophobicContact CG-CB 4.11Å; C1160-A1165 HydrophobicContact CB-CB 4.01Å; C1160-A1165 PolarHBondContact O-N 2.84Å; Y1163-A1165 VanDerWaalsContact C-N 3.35Å; Y1163-A1165 PolarHBondContact O-N 2.99Å
1166	F	82.2	Confident	84	Confident	28 Å²	28	59.4 Å²	59.4	12%	0.123	30%	0.303	C	S	.	.	S	Bend	trans	-88.3	136.5	175.3	-67.4	-47.7	0	0	0	112.1	F1137 F1138 A1141 V1157 C1160 L1161 I1176	F1137-F1166 HydrophobicContact CB-CE1 4.07Å; F1138-F1166 HydrophobicContact CB-CE1 4.37Å; A1141-F1166 HydrophobicContact CB-CZ 4.2Å; V1157-F1166 HydrophobicContact CB-CE2 4.23Å; V1157-F1166 HydrophobicContact CG1-CE2 4.03Å; V1157-F1166 HydrophobicContact CG2-CE2 4.07Å; V1157-F1166 HydrophobicContact CG2-CZ 4.23Å; C1160-F1166 HydrophobicContact CB-CD2 3.66Å; C1160-F1166 HydrophobicContact CB-CE1 4.38Å; C1160-F1166 HydrophobicContact CB-CE2 3.31Å; C1160-F1166 HydrophobicContact CB-CG 4.34Å; C1160-F1166 HydrophobicContact CB-CZ 3.71Å; L1161-F1166 HydrophobicContact CD2-CD2 4.06Å; L1161-F1166 HydrophobicContact CG-CD2 4.22Å; F1166-I1176 HydrophobicContact CD2-CD1 4.27Å
1167	E	71.9	Confident	83.9	Confident	153 Å²	153	61.6 Å²	61.6	72%	0.715	32%	0.317	S	S	*	.			trans	-84.3	143.8	164.5	-63.5	-177.3	173.1	0	0	109.2	T1169 T1172	E1167-T1169 PolarHBondContact O-N 2.87Å; E1167-T1172 PolarHBondContact O-OG1 2.87Å
1168	V	68.2	Low	84	Confident	127 Å²	127	63.2 Å²	63.2	77%	0.77	33%	0.33	S	S	*	.			trans	-75.5	98.4	-179.7	-174.5	0	0	0	0	108.1
1169	T	80.4	Confident	84.1	Confident	62 Å²	62	61.7 Å²	61.7	38%	0.38	32%	0.323	S	S	.	.			trans	-128.4	153.8	173.7	63.8	0	0	0	0	108.7	E1167 D1171 T1172 E1173	E1167-T1169 PolarHBondContact O-N 2.87Å; T1169-D1171 PolarHBondContact O-N 2.87Å; T1169-D1171 VanDerWaalsContact O-N 3.17Å; T1169-T1172 PolarHBondContact N-OG1 3.12Å; T1169-T1172 PolarHBondContact O-N 2.99Å; T1169-T1172 VanDerWaalsContact O-N 3.16Å; T1169-T1172 PolarHBondContact O-OG1 3.1Å; T1169-T1172 WeakPolarHBondContact OG1-CG2 3.09Å; T1169-T1172 PolarHBondContact OG1-N 2.86Å; T1169-T1172 PolarHBondContact OG1-OG1 2.62Å; T1169-E1173 PolarHBondContact O-N 3.05Å; T1169-E1173 VanDerWaalsContact O-N 3.1Å
1170	E	80.4	Confident	84.3	Confident	147 Å²	147	62.1 Å²	62.1	69%	0.687	32%	0.324	S	S	*	.	H	α-helix	trans	-58.5	-32.2	-179.8	-68.9	-173.9	178.2	0	0	112.4	K1174	E1170-K1174 VanDerWaalsContact O-CG 3.27Å; E1170-K1174 WeakPolarHBondContact O-CG 3.36Å; E1170-K1174 PolarHBondContact O-N 3.13Å
1171	D	82.8	Confident	84.4	Confident	98 Å²	98	62.2 Å²	62.2	52%	0.524	33%	0.325	S	S	.	.	H	α-helix	trans	-77.2	-32.7	-179.5	-62.8	-28.5	0	0	0	112.3	T1169 K1174 L1175	T1169-D1171 PolarHBondContact O-N 2.87Å; T1169-D1171 VanDerWaalsContact O-N 3.17Å; D1171-K1174 IonicContact OD1-NZ 3.13Å; D1171-K1174 PolarHBondContact OD1-NZ 2.95Å; D1171-K1174 VanDerWaalsContact OD1-NZ 3.13Å; D1171-L1175 PolarHBondContact O-N 3.45Å; D1171-L1175 VanDerWaalsContact O-N 3.08Å
1172	T	84.1	Confident	84.6	Confident	13 Å²	13	59.7 Å²	59.7	8%	0.08	31%	0.312	C	S	.	.	H	α-helix	trans	-66.8	-41.5	171.5	57.7	0	0	0	0	110.7	F1138 E1167 T1169 L1175 I1176	F1138-T1172 HydrophobicContact CD2-CG2 3.61Å; F1138-T1172 HydrophobicContact CE2-CG2 3.89Å; E1167-T1172 PolarHBondContact O-OG1 2.87Å; T1169-T1172 PolarHBondContact N-OG1 3.12Å; T1169-T1172 PolarHBondContact O-N 2.99Å; T1169-T1172 VanDerWaalsContact O-N 3.16Å; T1169-T1172 PolarHBondContact O-OG1 3.1Å; T1169-T1172 WeakPolarHBondContact OG1-CG2 3.09Å; T1169-T1172 PolarHBondContact OG1-N 2.86Å; T1169-T1172 PolarHBondContact OG1-OG1 2.62Å; T1172-L1175 PolarHBondContact O-N 2.82Å; T1172-I1176 WeakPolarHBondContact O-CB 3.2Å; T1172-I1176 WeakPolarHBondContact O-CD1 3.45Å; T1172-I1176 WeakPolarHBondContact O-CG1 3.42Å; T1172-I1176 PolarHBondContact O-N 2.94Å
1173	E	85.2	Confident	84.9	Confident	108 Å²	108	53 Å²	53	51%	0.505	28%	0.283	S	S	.	.	H	α-helix	trans	-63.4	-42	175.8	-71	-172.8	170.6	0	0	112.9	T1169 L1175 I1176 T1177	T1169-E1173 PolarHBondContact O-N 3.05Å; T1169-E1173 VanDerWaalsContact O-N 3.1Å; E1173-L1175 PolarHBondContact O-N 3.21Å; E1173-I1176 PolarHBondContact O-N 2.83Å; E1173-T1177 WeakPolarHBondContact O-CB 3.48Å; E1173-T1177 WeakPolarHBondContact O-CG2 3.41Å; E1173-T1177 PolarHBondContact O-N 3.21Å; E1173-T1177 PolarHBondContact O-OG1 3.42Å
1174	K	87.6	Confident	85.1	Confident	118 Å²	118	51.2 Å²	51.2	51%	0.513	28%	0.276	S	S	.	.	H	α-helix	trans	-60.2	-44	174.3	-73.8	168.9	-160.7	155.1	0	112	E1170 D1171 T1177 A1178	E1170-K1174 VanDerWaalsContact O-CG 3.27Å; E1170-K1174 WeakPolarHBondContact O-CG 3.36Å; E1170-K1174 PolarHBondContact O-N 3.13Å; D1171-K1174 IonicContact OD1-NZ 3.13Å; D1171-K1174 PolarHBondContact OD1-NZ 2.95Å; D1171-K1174 VanDerWaalsContact OD1-NZ 3.13Å; K1174-T1177 PolarHBondContact O-OG1 2.95Å; K1174-A1178 WeakPolarHBondContact O-CB 3.48Å; K1174-A1178 PolarHBondContact O-N 2.93Å; K1174-A1178 VanDerWaalsContact O-N 3.08Å
1175	L	88.4	Confident	85.4	Confident	21 Å²	21	55.2 Å²	55.2	11%	0.11	28%	0.281	C	S	.	.	H	α-helix	trans	-65	-46.6	177.8	-179.2	65.2	0	0	0	111.3	F1138 A1141 E1142 D1171 T1172 E1173 T1177 A1178 V1179	F1138-L1175 HydrophobicContact CD2-CD2 3.75Å; F1138-L1175 HydrophobicContact CE2-CB 4.05Å; F1138-L1175 HydrophobicContact CE2-CD2 3.48Å; F1138-L1175 VanDerWaalsContact CE2-CD2 3.48Å; F1138-L1175 HydrophobicContact CE2-CG 4.41Å; F1138-L1175 HydrophobicContact CZ-CD2 4.04Å; A1141-L1175 HydrophobicContact CB-CD2 3.95Å; E1142-L1175 HydrophobicContact CB-CD2 4.25Å; D1171-L1175 PolarHBondContact O-N 3.45Å; D1171-L1175 VanDerWaalsContact O-N 3.08Å; T1172-L1175 PolarHBondContact O-N 2.82Å; E1173-L1175 PolarHBondContact O-N 3.21Å; L1175-T1177 PolarHBondContact O-N 2.83Å; L1175-A1178 PolarHBondContact O-N 2.6Å; L1175-V1179 HydrophobicContact CD1-CG2 4.1Å; L1175-V1179 HydrophobicContact CG-CG2 4.31Å; L1175-V1179 WeakPolarHBondContact O-CB 3.22Å; L1175-V1179 VanDerWaalsContact O-CG2 3.26Å; L1175-V1179 WeakPolarHBondContact O-CG2 3.4Å; L1175-V1179 PolarHBondContact O-N 3.48Å
1176	I	88.1	Confident	85.7	Confident	23 Å²	23	56.1 Å²	56.1	12%	0.118	29%	0.287	C	S	.	.	H	α-helix	trans	-59	-48	-179.7	-68.7	164.7	0	0	0	110.7	V1157 L1161 F1166 T1172 E1173 A1178 V1179 Y1180	V1157-I1176 HydrophobicContact CG1-CB 4.37Å; V1157-I1176 HydrophobicContact CG1-CG1 3.79Å; V1157-I1176 HydrophobicContact CG1-CG2 4.06Å; L1161-I1176 HydrophobicContact CD2-CD1 4.16Å; F1166-I1176 HydrophobicContact CD2-CD1 4.27Å; T1172-I1176 WeakPolarHBondContact O-CB 3.2Å; T1172-I1176 WeakPolarHBondContact O-CD1 3.45Å; T1172-I1176 WeakPolarHBondContact O-CG1 3.42Å; T1172-I1176 PolarHBondContact O-N 2.94Å; E1173-I1176 PolarHBondContact O-N 2.83Å; I1176-A1178 PolarHBondContact O-N 2.57Å; I1176-V1179 PolarHBondContact O-N 3.27Å; I1176-Y1180 HydrophobicContact CG2-CD2 3.71Å; I1176-Y1180 HydrophobicContact CG2-CE2 3.32Å; I1176-Y1180 PolarHBondContact O-N 3.08Å
1177	T	90.4	Very high	85.8	Confident	47 Å²	47	54.9 Å²	54.9	29%	0.288	28%	0.282	S	S	.	.	H	α-helix	trans	-64.6	-39.7	179.8	51.3	0	0	0	0	112.2	E1173 K1174 L1175 A1181	E1173-T1177 WeakPolarHBondContact O-CB 3.48Å; E1173-T1177 WeakPolarHBondContact O-CG2 3.41Å; E1173-T1177 PolarHBondContact O-N 3.21Å; E1173-T1177 PolarHBondContact O-OG1 3.42Å; K1174-T1177 PolarHBondContact O-OG1 2.95Å; L1175-T1177 PolarHBondContact O-N 2.83Å; T1177-A1181 WeakPolarHBondContact O-CB 3.21Å; T1177-A1181 PolarHBondContact O-N 3.23Å
1178	A	90.9	Very high	86.4	Confident	34 Å²	34	50.9 Å²	50.9	28%	0.281	26%	0.262	S	S	.	.	H	α-helix	trans	-64.4	-46.6	174.8	0	0	0	0	0	112.5	K1174 L1175 I1176 Y1180 A1181 D1182	K1174-A1178 WeakPolarHBondContact O-CB 3.48Å; K1174-A1178 PolarHBondContact O-N 2.93Å; K1174-A1178 VanDerWaalsContact O-N 3.08Å; L1175-A1178 PolarHBondContact O-N 2.6Å; I1176-A1178 PolarHBondContact O-N 2.57Å; A1178-Y1180 PolarHBondContact O-N 3.26Å; A1178-A1181 PolarHBondContact O-N 3.38Å; A1178-D1182 PolarHBondContact O-N 3.07Å
1179	V	91.8	Very high	87.1	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-60.3	-46.1	178.3	169.9	0	0	0	0	111	H1145 A1153 A1154 V1157 L1175 I1176 D1182 Y1183	H1145-V1179 HydrophobicContact CB-CG2 4Å; A1153-V1179 HydrophobicContact CB-CG1 3.86Å; A1154-V1179 HydrophobicContact CB-CG1 3.98Å; V1157-V1179 HydrophobicContact CG2-CG1 4.44Å; L1175-V1179 HydrophobicContact CD1-CG2 4.1Å; L1175-V1179 HydrophobicContact CG-CG2 4.31Å; L1175-V1179 WeakPolarHBondContact O-CB 3.22Å; L1175-V1179 VanDerWaalsContact O-CG2 3.26Å; L1175-V1179 WeakPolarHBondContact O-CG2 3.4Å; L1175-V1179 PolarHBondContact O-N 3.48Å; I1176-V1179 PolarHBondContact O-N 3.27Å; V1179-D1182 PolarHBondContact O-N 2.69Å; V1179-Y1183 WeakPolarHBondContact O-CB 3.45Å; V1179-Y1183 PolarHBondContact O-N 3.41Å
1180	Y	91.7	Very high	87	Confident	11 Å²	11	47.9 Å²	47.9	4%	0.043	24%	0.239	C	C	.	.	H	α-helix	trans	-66.5	-38.7	178.1	-69.1	-24.1	0	0	0	113	A1154 V1157 E1158 L1161 I1176 A1178 Y1183 A1184 F1199 K1202	A1154-Y1180 HydrophobicContact CB-CD1 4.2Å; A1154-Y1180 HydrophobicContact CB-CE1 4.42Å; V1157-Y1180 HydrophobicContact CB-CE1 4.5Å; V1157-Y1180 HydrophobicContact CG1-CE1 4.05Å; E1158-Y1180 HydrophobicContact CG-CE1 4.08Å; E1158-Y1180 WeakPolarHBondContact CG-OH 3.38Å; L1161-Y1180 WeakPolarHBondContact CD1-OH 3.43Å; I1176-Y1180 HydrophobicContact CG2-CD2 3.71Å; I1176-Y1180 HydrophobicContact CG2-CE2 3.32Å; I1176-Y1180 PolarHBondContact O-N 3.08Å; A1178-Y1180 PolarHBondContact O-N 3.26Å; Y1180-Y1183 PolarHBondContact O-N 2.94Å; Y1180-A1184 VanDerWaalsContact O-CB 3.29Å; Y1180-A1184 WeakPolarHBondContact O-CB 3.47Å; Y1180-A1184 PolarHBondContact O-N 2.96Å; Y1180-F1199 AromaticContact CD1-CD1 3.62Å; Y1180-F1199 HydrophobicContact CD1-CD1 3.62Å; Y1180-F1199 AromaticContact CD1-CE1 3.89Å; Y1180-F1199 HydrophobicContact CD1-CE1 3.89Å; Y1180-F1199 HydrophobicContact CE1-CD1 4.08Å; Y1180-F1199 AromaticContact CE1-CE1 3.9Å; Y1180-F1199 HydrophobicContact CE1-CE1 3.9Å; Y1180-F1199 HydrophobicContact CG-CD1 4.07Å; Y1180-K1202 HydrophobicContact CD2-CB 3.77Å; Y1180-K1202 HydrophobicContact CE2-CB 4.08Å; Y1180-K1202 HydrophobicContact CE2-CD 4.47Å; Y1180-K1202 HydrophobicContact CG-CB 4.42Å
1181	A	91.1	Very high	86.7	Confident	3 Å²	3	41.7 Å²	41.7	3%	0.025	21%	0.214	C	C	.	.	H	α-helix	trans	-64.9	-44	176.9	0	0	0	0	0	112.1	T1177 A1178 A1184 R1185 A1203 A1206	T1177-A1181 WeakPolarHBondContact O-CB 3.21Å; T1177-A1181 PolarHBondContact O-N 3.23Å; A1178-A1181 PolarHBondContact O-N 3.38Å; A1181-A1184 PolarHBondContact O-N 2.9Å; A1181-R1185 PolarHBondContact O-N 2.8Å; A1181-R1185 VanDerWaalsContact O-N 3.08Å; A1181-A1203 HydrophobicContact CB-CB 4Å; A1181-A1206 HydrophobicContact CB-CB 4.14Å
1182	D	91.1	Very high	86.4	Confident	30 Å²	30	37.9 Å²	37.9	16%	0.16	19%	0.193	C	C	.	.	H	α-helix	trans	-67.4	-38.5	177.6	-71.7	-7	0	0	0	111.7	H1145 F1150 A1178 V1179 R1185 S1186	H1145-D1182 IonicContact CD2-OD2 3.99Å; H1145-D1182 IonicContact CE1-OD2 3.13Å; H1145-D1182 IonicContact NE2-OD2 2.78Å; H1145-D1182 PolarHBondContact NE2-OD2 3.35Å; F1150-D1182 HydrophobicContact CD1-CB 3.62Å; F1150-D1182 HydrophobicContact CE1-CB 3.65Å; F1150-D1182 HydrophobicContact CG-CB 4.31Å; F1150-D1182 HydrophobicContact CZ-CB 4.36Å; A1178-D1182 PolarHBondContact O-N 3.07Å; V1179-D1182 PolarHBondContact O-N 2.69Å; D1182-R1185 WeakPolarHBondContact O-CB 3.4Å; D1182-R1185 PolarHBondContact O-N 3.37Å; D1182-R1185 IonicContact OD1-CZ 2.62Å; D1182-R1185 IonicContact OD1-NH1 2.74Å; D1182-R1185 PolarHBondContact OD1-NH1 2.98Å; D1182-R1185 IonicContact OD1-NH2 3.06Å; D1182-R1185 PolarHBondContact OD1-NH2 2.84Å; D1182-S1186 PolarHBondContact O-N 3.49Å
1183	Y	89.9	Confident	86	Confident	5 Å²	5	40.1 Å²	40.1	2%	0.02	20%	0.202	C	C	.	.	H	α-helix	trans	-67.6	-40.7	175.6	-173.5	-133.9	0	0	0	112.5	H861 F1150 D1151 A1154 V1179 Y1180 R1185 S1186 L1187 F1199	H861-Y1183 PolarHBondContact CD2-OH 3.03Å; H861-Y1183 AromaticContact CE1-CE1 3.9Å; H861-Y1183 AromaticContact NE2-CE1 3.64Å; H861-Y1183 AromaticContact NE2-CZ 3.49Å; H861-Y1183 PolarHBondContact NE2-OH 2.78Å; F1150-Y1183 HydrophobicContact CB-CD2 4.16Å; D1151-Y1183 VanDerWaalsContact CA-CE2 3.4Å; D1151-Y1183 HydrophobicContact CB-CD2 4.25Å; D1151-Y1183 HydrophobicContact CB-CE2 3.6Å; A1154-Y1183 HydrophobicContact CB-CD1 3.34Å; A1154-Y1183 HydrophobicContact CB-CE1 4.05Å; A1154-Y1183 HydrophobicContact CB-CG 3.63Å; V1179-Y1183 WeakPolarHBondContact O-CB 3.45Å; V1179-Y1183 PolarHBondContact O-N 3.41Å; Y1180-Y1183 PolarHBondContact O-N 2.94Å; Y1183-R1185 VanDerWaalsContact C-N 3.28Å; Y1183-R1185 PolarHBondContact O-N 3.15Å; Y1183-S1186 WeakPolarHBondContact O-CA 3.41Å; Y1183-S1186 WeakPolarHBondContact O-CB 3.1Å; Y1183-S1186 PolarHBondContact O-N 3.36Å; Y1183-L1187 HydrophobicContact CD1-CD1 4.1Å; Y1183-L1187 HydrophobicContact CD2-CG 4.38Å; Y1183-L1187 HydrophobicContact CE1-CD1 3.72Å; Y1183-L1187 HydrophobicContact CE1-CG 4.2Å; Y1183-L1187 HydrophobicContact CE2-CD1 4.34Å; Y1183-L1187 HydrophobicContact CE2-CD2 4.09Å; Y1183-L1187 HydrophobicContact CE2-CG 3.89Å; Y1183-L1187 PolarHBondContact O-N 2.96Å; Y1183-F1199 HydrophobicContact CD1-CD1 4.17Å; Y1183-F1199 AromaticContact CD1-CD2 3.7Å; Y1183-F1199 HydrophobicContact CD1-CD2 3.7Å; Y1183-F1199 HydrophobicContact CD1-CE1 4.18Å; Y1183-F1199 AromaticContact CD1-CE2 3.66Å; Y1183-F1199 HydrophobicContact CD1-CE2 3.66Å; Y1183-F1199 AromaticContact CD1-CG 3.94Å; Y1183-F1199 HydrophobicContact CD1-CG 3.94Å; Y1183-F1199 AromaticContact CD1-CZ 3.94Å; Y1183-F1199 HydrophobicContact CD1-CZ 3.94Å; Y1183-F1199 AromaticContact CE1-CD2 3.81Å; Y1183-F1199 HydrophobicContact CE1-CD2 3.81Å; Y1183-F1199 HydrophobicContact CE1-CE1 4.5Å; Y1183-F1199 AromaticContact CE1-CE2 3.39Å; Y1183-F1199 HydrophobicContact CE1-CE2 3.39Å; Y1183-F1199 HydrophobicContact CE1-CG 4.49Å; Y1183-F1199 AromaticContact CE1-CZ 3.81Å; Y1183-F1199 HydrophobicContact CE1-CZ 3.81Å
1184	A	88.1	Confident	85.6	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-59.1	-39.4	173.5	0	0	0	0	0	112	Y1180 A1181 L1187 K1188 A1196 F1199 A1200 L1210	Y1180-A1184 VanDerWaalsContact O-CB 3.29Å; Y1180-A1184 WeakPolarHBondContact O-CB 3.47Å; Y1180-A1184 PolarHBondContact O-N 2.96Å; A1181-A1184 PolarHBondContact O-N 2.9Å; A1184-L1187 PolarHBondContact O-N 3.22Å; A1184-K1188 WeakPolarHBondContact O-CB 3.49Å; A1184-K1188 PolarHBondContact O-N 3.17Å; A1184-A1196 WeakPolarHBondContact CB-O 3.33Å; A1184-A1196 WeakPolarHBondContact O-CB 3.39Å; A1184-F1199 HydrophobicContact CB-CB 3.87Å; A1184-A1200 HydrophobicContact CB-CB 4.05Å; A1184-L1210 HydrophobicContact CB-CD2 3.51Å
1185	R	88.9	Confident	85.1	Confident	116 Å²	116	33.7 Å²	33.7	44%	0.438	18%	0.175	S	C	.	.	H	α-helix	trans	-61.9	-42.9	171.5	-81.8	-173.1	-107.5	106.8	5	112.3	A1181 D1182 Y1183 K1188 N1189 L1210	A1181-R1185 PolarHBondContact O-N 2.8Å; A1181-R1185 VanDerWaalsContact O-N 3.08Å; D1182-R1185 WeakPolarHBondContact O-CB 3.4Å; D1182-R1185 PolarHBondContact O-N 3.37Å; D1182-R1185 IonicContact OD1-CZ 2.62Å; D1182-R1185 IonicContact OD1-NH1 2.74Å; D1182-R1185 PolarHBondContact OD1-NH1 2.98Å; D1182-R1185 IonicContact OD1-NH2 3.06Å; D1182-R1185 PolarHBondContact OD1-NH2 2.84Å; Y1183-R1185 VanDerWaalsContact C-N 3.28Å; Y1183-R1185 PolarHBondContact O-N 3.15Å; R1185-K1188 PolarHBondContact O-N 3.38Å; R1185-N1189 VanDerWaalsContact O-CG 3.28Å; R1185-N1189 PolarHBondContact O-N 3.06Å; R1185-N1189 PolarHBondContact O-ND2 3.21Å; R1185-L1210 HydrophobicContact CB-CD1 4.5Å; R1185-L1210 HydrophobicContact CG-CD1 3.37Å; R1185-L1210 HydrophobicContact CG-CD2 4.45Å
1186	S	87.1	Confident	84.9	Confident	35 Å²	35	32.7 Å²	32.7	25%	0.245	17%	0.169	C	C	.	.	H	α-helix	trans	-60.9	-46	175.5	-167.8	0	0	0	0	112.1	D1182 Y1183 K1188 N1189 L1190	D1182-S1186 PolarHBondContact O-N 3.49Å; Y1183-S1186 WeakPolarHBondContact O-CA 3.41Å; Y1183-S1186 WeakPolarHBondContact O-CB 3.1Å; Y1183-S1186 PolarHBondContact O-N 3.36Å; S1186-K1188 PolarHBondContact O-N 2.98Å; S1186-N1189 WeakPolarHBondContact O-CB 3.42Å; S1186-N1189 PolarHBondContact O-N 3.16Å; S1186-L1190 PolarHBondContact O-N 2.95Å
1187	L	84.4	Confident	84.7	Confident	2 Å²	2	34.3 Å²	34.3	1%	0.01	18%	0.18	C	C	.	.	H	α-helix	trans	-63.9	-39.1	177.4	-72.6	175	0	0	0	112.8	A857 Y1183 A1184 N1189 L1190 G1191 F1192 A1196 F1199	A857-L1187 HydrophobicContact CB-CD2 4.25Å; Y1183-L1187 HydrophobicContact CD1-CD1 4.1Å; Y1183-L1187 HydrophobicContact CD2-CG 4.38Å; Y1183-L1187 HydrophobicContact CE1-CD1 3.72Å; Y1183-L1187 HydrophobicContact CE1-CG 4.2Å; Y1183-L1187 HydrophobicContact CE2-CD1 4.34Å; Y1183-L1187 HydrophobicContact CE2-CD2 4.09Å; Y1183-L1187 HydrophobicContact CE2-CG 3.89Å; Y1183-L1187 PolarHBondContact O-N 2.96Å; A1184-L1187 PolarHBondContact O-N 3.22Å; L1187-N1189 VanDerWaalsContact C-N 3.34Å; L1187-L1190 PolarHBondContact O-N 3.35Å; L1187-G1191 PolarHBondContact O-N 2.7Å; L1187-F1192 HydrophobicContact CB-CB 4.5Å; L1187-F1192 HydrophobicContact CD2-CB 4.43Å; L1187-F1192 PolarHBondContact O-N 2.72Å; L1187-A1196 HydrophobicContact CB-CB 4.12Å; L1187-F1199 HydrophobicContact CD1-CD2 3.66Å; L1187-F1199 HydrophobicContact CD1-CE2 4.14Å
1188	K	84.2	Confident	84.4	Confident	68 Å²	68	33.7 Å²	33.7	30%	0.296	18%	0.175	S	C	.	.	H	α-helix	trans	-58.9	-46.1	172.5	178.6	-179.6	176.7	175.9	0	110.8	A1184 R1185 S1186 L1190 G1191 A1196 L1210 E1213 L1214	A1184-K1188 WeakPolarHBondContact O-CB 3.49Å; A1184-K1188 PolarHBondContact O-N 3.17Å; R1185-K1188 PolarHBondContact O-N 3.38Å; S1186-K1188 PolarHBondContact O-N 2.98Å; K1188-L1190 VanDerWaalsContact C-N 3.25Å; K1188-L1190 PolarHBondContact O-N 3.12Å; K1188-G1191 PolarHBondContact O-N 2.81Å; K1188-A1196 HydrophobicContact CB-CB 4.11Å; K1188-L1210 HydrophobicContact CD-CD1 4.02Å; K1188-E1213 IonicContact NZ-OE2 3.79Å; K1188-E1213 PolarHBondContact NZ-OE2 2.92Å; K1188-L1214 HydrophobicContact CB-CD2 4.45Å; K1188-L1214 HydrophobicContact CD-CD2 3.87Å; K1188-L1214 HydrophobicContact CD-CG 4.37Å; K1188-L1214 HydrophobicContact CG-CD2 3.92Å
1189	N	82.9	Confident	84.1	Confident	107 Å²	107	32.1 Å²	32.1	57%	0.572	16%	0.162	S	C	*	.	H	α-helix	trans	-64.3	-28.3	178	-69.1	-17.9	0	0	0	113.2	R1185 S1186 L1187 G1191	R1185-N1189 VanDerWaalsContact O-CG 3.28Å; R1185-N1189 PolarHBondContact O-N 3.06Å; R1185-N1189 PolarHBondContact O-ND2 3.21Å; S1186-N1189 WeakPolarHBondContact O-CB 3.42Å; S1186-N1189 PolarHBondContact O-N 3.16Å; L1187-N1189 VanDerWaalsContact C-N 3.34Å; N1189-G1191 VanDerWaalsContact C-N 3.33Å
1190	L	77.8	Confident	83.9	Confident	20 Å²	20	32.1 Å²	32.1	11%	0.105	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-6.1	174.1	-69.4	173.5	0	0	0	113.5	I78 L853 Y877 S1186 L1187 K1188 F1192	I78-L1190 HydrophobicContact CD1-CD2 4.31Å; I78-L1190 HydrophobicContact CG1-CD2 4.44Å; L853-L1190 HydrophobicContact CB-CD2 3.91Å; L853-L1190 HydrophobicContact CD1-CD2 4.29Å; Y877-L1190 VanDerWaalsContact CE2-O 3.3Å; Y877-L1190 WeakPolarHBondContact CE2-O 3.36Å; S1186-L1190 PolarHBondContact O-N 2.95Å; L1187-L1190 PolarHBondContact O-N 3.35Å; K1188-L1190 VanDerWaalsContact C-N 3.25Å; K1188-L1190 PolarHBondContact O-N 3.12Å; L1190-F1192 HydrophobicContact CB-CD2 4.09Å
1191	G	74.8	Confident	83.6	Confident	16 Å²	16	34.9 Å²	34.9	17%	0.165	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.9	4.2	179.7	0	0	0	0	0	115.5	L1187 K1188 N1189 K1193	L1187-G1191 PolarHBondContact O-N 2.7Å; K1188-G1191 PolarHBondContact O-N 2.81Å; N1189-G1191 VanDerWaalsContact C-N 3.33Å; G1191-K1193 PolarHBondContact O-N 2.8Å
1192	F	75.9	Confident	83.3	Confident	19 Å²	19	39.2 Å²	39.2	8%	0.083	20%	0.201	C	C	.	.			trans	-88.2	78.9	178.9	-72.9	-89.7	0	0	0	112	A854 A857 F858 V875 L1187 L1190 Q1194 G1195 A1196	A854-F1192 VanDerWaalsContact CA-CE2 3.45Å; A854-F1192 HydrophobicContact CB-CE2 3.42Å; A854-F1192 VanDerWaalsContact CB-CE2 3.42Å; A854-F1192 HydrophobicContact CB-CZ 3.76Å; A854-F1192 WeakPolarHBondContact O-CZ 3.41Å; A857-F1192 HydrophobicContact CB-CD2 4.41Å; A857-F1192 HydrophobicContact CB-CE2 4.22Å; F858-F1192 HydrophobicContact CB-CE1 4.2Å; F858-F1192 HydrophobicContact CB-CZ 4.27Å; V875-F1192 HydrophobicContact CG1-CD1 3.79Å; V875-F1192 HydrophobicContact CG1-CE1 3.73Å; L1187-F1192 HydrophobicContact CB-CB 4.5Å; L1187-F1192 HydrophobicContact CD2-CB 4.43Å; L1187-F1192 PolarHBondContact O-N 2.72Å; L1190-F1192 HydrophobicContact CB-CD2 4.09Å; F1192-Q1194 PolarHBondContact O-N 2.8Å; F1192-G1195 PolarHBondContact O-N 2.85Å; F1192-A1196 WeakPolarHBondContact O-CB 3.44Å; F1192-A1196 PolarHBondContact O-N 2.94Å
1193	K	76	Confident	83	Confident	59 Å²	59	37.8 Å²	37.8	26%	0.257	19%	0.193	S	C	.	.	H	α-helix	trans	-57.8	-46.8	-178	-67.1	-167.2	177.6	-164.2	0	113.2	G1191 G1195 A1196 V1197 S1217	G1191-K1193 PolarHBondContact O-N 2.8Å; K1193-G1195 PolarHBondContact O-N 3.46Å; K1193-A1196 PolarHBondContact O-N 2.85Å; K1193-V1197 WeakPolarHBondContact O-CG2 3.45Å; K1193-V1197 PolarHBondContact O-N 3.5Å; K1193-S1217 PolarHBondContact NZ-OG 3.22Å
1194	Q	76	Confident	82.8	Confident	88 Å²	88	39.5 Å²	39.5	41%	0.411	21%	0.213	S	C	.	.	H	α-helix	trans	-63.2	-42.3	-176.5	-64.9	178.2	5.3	0	0	112.6	F1192 V1197 L1198	F1192-Q1194 PolarHBondContact O-N 2.8Å; Q1194-V1197 PolarHBondContact O-N 3.4Å; Q1194-L1198 PolarHBondContact O-N 2.94Å
1195	G	77.8	Confident	82.5	Confident	4 Å²	4	44 Å²	44	4%	0.041	25%	0.25	C	C	.	.	H	α-helix	trans	-67.8	-38.8	175.3	0	0	0	0	0	112.6	F1192 K1193 V1197 L1198 F1199	F1192-G1195 PolarHBondContact O-N 2.85Å; K1193-G1195 PolarHBondContact O-N 3.46Å; G1195-V1197 PolarHBondContact O-N 3.04Å; G1195-L1198 PolarHBondContact O-N 3.25Å; G1195-F1199 PolarHBondContact O-N 2.85Å; G1195-F1199 VanDerWaalsContact O-N 3.1Å
1196	A	83.3	Confident	82.1	Confident	0 Å²	0	41 Å²	41	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-60.8	-42.7	174.6	0	0	0	0	0	111.9	A1184 L1187 K1188 F1192 K1193 L1198 A1200 L1214	A1184-A1196 WeakPolarHBondContact CB-O 3.33Å; A1184-A1196 WeakPolarHBondContact O-CB 3.39Å; L1187-A1196 HydrophobicContact CB-CB 4.12Å; K1188-A1196 HydrophobicContact CB-CB 4.11Å; F1192-A1196 WeakPolarHBondContact O-CB 3.44Å; F1192-A1196 PolarHBondContact O-N 2.94Å; K1193-A1196 PolarHBondContact O-N 2.85Å; A1196-L1198 PolarHBondContact O-N 2.87Å; A1196-A1200 WeakPolarHBondContact O-CB 3.33Å; A1196-A1200 PolarHBondContact O-N 3.26Å; A1196-L1214 HydrophobicContact CB-CD1 3.78Å; A1196-L1214 HydrophobicContact CB-CD2 4.47Å
1197	V	84.1	Confident	81.8	Confident	56 Å²	56	39.4 Å²	39.4	34%	0.339	24%	0.239	S	C	.	.	H	α-helix	trans	-62.1	-41.9	176	171.8	0	0	0	0	111.7	K1193 Q1194 G1195 A1200 S1201 L1211 L1214	K1193-V1197 WeakPolarHBondContact O-CG2 3.45Å; K1193-V1197 PolarHBondContact O-N 3.5Å; Q1194-V1197 PolarHBondContact O-N 3.4Å; G1195-V1197 PolarHBondContact O-N 3.04Å; V1197-A1200 PolarHBondContact O-N 3.22Å; V1197-S1201 WeakPolarHBondContact O-CB 3.1Å; V1197-S1201 PolarHBondContact O-N 3.37Å; V1197-S1201 PolarHBondContact O-OG 3.01Å; V1197-L1211 HydrophobicContact CB-CD2 4.46Å; V1197-L1211 HydrophobicContact CG1-CD2 3.97Å; V1197-L1214 HydrophobicContact CG2-CB 4.16Å; V1197-L1214 HydrophobicContact CG2-CD1 3.91Å
1198	L	83.6	Confident	81.7	Confident	35 Å²	35	45.6 Å²	45.6	18%	0.183	27%	0.265	C	S	.	.	H	α-helix	trans	-62.6	-53.2	178.6	-178.4	105.4	0	0	0	111.6	W864 Q1194 G1195 A1196 A1200 S1201 K1202	W864-L1198 HydrophobicContact CB-CD1 3.53Å; W864-L1198 HydrophobicContact CB-CD2 4.38Å; W864-L1198 HydrophobicContact CB-CG 4.37Å; W864-L1198 HydrophobicContact CD2-CD2 3.73Å; W864-L1198 HydrophobicContact CD2-CG 4.45Å; W864-L1198 HydrophobicContact CE3-CD2 3.28Å; W864-L1198 HydrophobicContact CE3-CG 4.38Å; W864-L1198 HydrophobicContact CG-CB 4.43Å; W864-L1198 HydrophobicContact CG-CD1 4.12Å; W864-L1198 HydrophobicContact CG-CD2 4.22Å; W864-L1198 HydrophobicContact CG-CG 4.47Å; W864-L1198 HydrophobicContact CH2-CD2 4.28Å; W864-L1198 HydrophobicContact CZ3-CD2 3.59Å; Q1194-L1198 PolarHBondContact O-N 2.94Å; G1195-L1198 PolarHBondContact O-N 3.25Å; A1196-L1198 PolarHBondContact O-N 2.87Å; L1198-A1200 VanDerWaalsContact C-N 3.29Å; L1198-A1200 PolarHBondContact O-N 2.87Å; L1198-S1201 PolarHBondContact O-N 2.99Å; L1198-S1201 PolarHBondContact O-OG 3.11Å; L1198-K1202 HydrophobicContact CD2-CD 4.34Å; L1198-K1202 WeakPolarHBondContact O-CG 3.28Å; L1198-K1202 PolarHBondContact O-N 3.03Å
1199	F	86	Confident	81.6	Confident	0 Å²	0	48 Å²	48	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-68.7	-31.1	-178.7	-79.7	-71.9	0	0	0	112.6	W864 E1158 Y1180 Y1183 A1184 L1187 G1195 K1202 A1203	W864-F1199 HydrophobicContact CH2-CD2 4.16Å; W864-F1199 AromaticContact CH2-CE2 3.4Å; W864-F1199 HydrophobicContact CH2-CE2 3.4Å; W864-F1199 VanDerWaalsContact CH2-CE2 3.4Å; W864-F1199 HydrophobicContact CH2-CZ 4.21Å; W864-F1199 HydrophobicContact CZ2-CE2 4.4Å; W864-F1199 AromaticContact CZ3-CE2 3.68Å; W864-F1199 HydrophobicContact CZ3-CE2 3.68Å; W864-F1199 HydrophobicContact CZ3-CZ 4.08Å; E1158-F1199 HydrophobicContact CG-CE1 4.36Å; E1158-F1199 WeakPolarHBondContact OE1-CE1 3.27Å; E1158-F1199 WeakPolarHBondContact OE1-CZ 3.36Å; Y1180-F1199 AromaticContact CD1-CD1 3.62Å; Y1180-F1199 HydrophobicContact CD1-CD1 3.62Å; Y1180-F1199 AromaticContact CD1-CE1 3.89Å; Y1180-F1199 HydrophobicContact CD1-CE1 3.89Å; Y1180-F1199 HydrophobicContact CE1-CD1 4.08Å; Y1180-F1199 AromaticContact CE1-CE1 3.9Å; Y1180-F1199 HydrophobicContact CE1-CE1 3.9Å; Y1180-F1199 HydrophobicContact CG-CD1 4.07Å; Y1183-F1199 HydrophobicContact CD1-CD1 4.17Å; Y1183-F1199 AromaticContact CD1-CD2 3.7Å; Y1183-F1199 HydrophobicContact CD1-CD2 3.7Å; Y1183-F1199 HydrophobicContact CD1-CE1 4.18Å; Y1183-F1199 AromaticContact CD1-CE2 3.66Å; Y1183-F1199 HydrophobicContact CD1-CE2 3.66Å; Y1183-F1199 AromaticContact CD1-CG 3.94Å; Y1183-F1199 HydrophobicContact CD1-CG 3.94Å; Y1183-F1199 AromaticContact CD1-CZ 3.94Å; Y1183-F1199 HydrophobicContact CD1-CZ 3.94Å; Y1183-F1199 AromaticContact CE1-CD2 3.81Å; Y1183-F1199 HydrophobicContact CE1-CD2 3.81Å; Y1183-F1199 HydrophobicContact CE1-CE1 4.5Å; Y1183-F1199 AromaticContact CE1-CE2 3.39Å; Y1183-F1199 HydrophobicContact CE1-CE2 3.39Å; Y1183-F1199 HydrophobicContact CE1-CG 4.49Å; Y1183-F1199 AromaticContact CE1-CZ 3.81Å; Y1183-F1199 HydrophobicContact CE1-CZ 3.81Å; A1184-F1199 HydrophobicContact CB-CB 3.87Å; L1187-F1199 HydrophobicContact CD1-CD2 3.66Å; L1187-F1199 HydrophobicContact CD1-CE2 4.14Å; G1195-F1199 PolarHBondContact O-N 2.85Å; G1195-F1199 VanDerWaalsContact O-N 3.1Å; F1199-K1202 HydrophobicContact CD1-CD 4.29Å; F1199-K1202 HydrophobicContact CE1-CD 4.46Å; F1199-K1202 PolarHBondContact O-N 3.03Å; F1199-A1203 WeakPolarHBondContact O-CB 3.32Å; F1199-A1203 PolarHBondContact O-N 2.96Å
1200	A	86.6	Confident	81.6	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-66.5	-37.4	172.6	0	0	0	0	0	112.2	A1184 A1196 V1197 L1198 A1203 G1204 L1210 L1211	A1184-A1200 HydrophobicContact CB-CB 4.05Å; A1196-A1200 WeakPolarHBondContact O-CB 3.33Å; A1196-A1200 PolarHBondContact O-N 3.26Å; V1197-A1200 PolarHBondContact O-N 3.22Å; L1198-A1200 VanDerWaalsContact C-N 3.29Å; L1198-A1200 PolarHBondContact O-N 2.87Å; A1200-A1203 PolarHBondContact O-N 3.35Å; A1200-G1204 PolarHBondContact O-N 3.48Å; A1200-L1210 HydrophobicContact CB-CB 4.37Å; A1200-L1210 HydrophobicContact CB-CD2 3.88Å; A1200-L1211 HydrophobicContact CB-CD1 4.46Å; A1200-L1211 HydrophobicContact CB-CD2 3.79Å; A1200-L1211 HydrophobicContact CB-CG 3.72Å
1201	S	85.9	Confident	81.9	Confident	70 Å²	70	44.1 Å²	44.1	49%	0.49	26%	0.261	S	S	.	.	H	α-helix	trans	-68.5	-39	173.1	66.1	0	0	0	0	112.4	V1197 L1198 A1203 G1204	V1197-S1201 WeakPolarHBondContact O-CB 3.1Å; V1197-S1201 PolarHBondContact O-N 3.37Å; V1197-S1201 PolarHBondContact O-OG 3.01Å; L1198-S1201 PolarHBondContact O-N 2.99Å; L1198-S1201 PolarHBondContact O-OG 3.11Å; S1201-A1203 VanDerWaalsContact C-N 3.27Å; S1201-A1203 PolarHBondContact O-N 2.8Å; S1201-G1204 PolarHBondContact O-N 2.86Å
1202	K	85.3	Confident	82.3	Confident	94 Å²	94	47.3 Å²	47.3	41%	0.409	27%	0.274	S	S	.	.	H	α-helix	trans	-64	-28.5	171.5	-69.8	-175.4	-177.8	-173.2	0	113.4	E1158 Y1180 L1198 F1199 G1204	E1158-K1202 IonicContact OE1-NZ 2.69Å; E1158-K1202 PolarHBondContact OE1-NZ 3.47Å; Y1180-K1202 HydrophobicContact CD2-CB 3.77Å; Y1180-K1202 HydrophobicContact CE2-CB 4.08Å; Y1180-K1202 HydrophobicContact CE2-CD 4.47Å; Y1180-K1202 HydrophobicContact CG-CB 4.42Å; L1198-K1202 HydrophobicContact CD2-CD 4.34Å; L1198-K1202 WeakPolarHBondContact O-CG 3.28Å; L1198-K1202 PolarHBondContact O-N 3.03Å; F1199-K1202 HydrophobicContact CD1-CD 4.29Å; F1199-K1202 HydrophobicContact CE1-CD 4.46Å; F1199-K1202 PolarHBondContact O-N 3.03Å; K1202-G1204 VanDerWaalsContact C-N 3.25Å; K1202-G1204 PolarHBondContact O-N 3.38Å
1203	A	84.9	Confident	82.5	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-10.5	176.8	0	0	0	0	0	113.7	A1181 F1199 A1200 S1201 A1205 A1206	A1181-A1203 HydrophobicContact CB-CB 4Å; F1199-A1203 WeakPolarHBondContact O-CB 3.32Å; F1199-A1203 PolarHBondContact O-N 2.96Å; A1200-A1203 PolarHBondContact O-N 3.35Å; S1201-A1203 VanDerWaalsContact C-N 3.27Å; S1201-A1203 PolarHBondContact O-N 2.8Å; A1203-A1205 PolarHBondContact O-N 2.87Å; A1203-A1206 PolarHBondContact O-N 2.86Å
1204	G	85.9	Confident	82.5	Confident	41 Å²	41	48.9 Å²	48.9	42%	0.423	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	60.7	-124.9	177.4	0	0	0	0	0	112.8	A1200 S1201 K1202 A1206 G1207 K1208	A1200-G1204 PolarHBondContact O-N 3.48Å; S1201-G1204 PolarHBondContact O-N 2.86Å; K1202-G1204 VanDerWaalsContact C-N 3.25Å; K1202-G1204 PolarHBondContact O-N 3.38Å; G1204-A1206 VanDerWaalsContact C-N 3.31Å; G1204-A1206 PolarHBondContact O-N 2.63Å; G1204-G1207 PolarHBondContact O-N 3.14Å; G1204-G1207 VanDerWaalsContact O-N 3.16Å; G1204-K1208 PolarHBondContact O-N 3.03Å
1205	A	80.6	Confident	82.3	Confident	94 Å²	94	49.9 Å²	49.9	78%	0.777	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-60.7	-36.5	-177.3	0	0	0	0	0	113.3	A1203 G1207 K1208	A1203-A1205 PolarHBondContact O-N 2.87Å; A1205-G1207 PolarHBondContact O-N 3.31Å; A1205-K1208 WeakPolarHBondContact O-CB 3.48Å; A1205-K1208 PolarHBondContact O-N 2.87Å
1206	A	80.3	Confident	81.5	Confident	53 Å²	53	52.4 Å²	52.4	44%	0.438	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-70.1	-20.5	179.5	0	0	0	0	0	113.3	A1181 A1203 G1204	A1181-A1206 HydrophobicContact CB-CB 4.14Å; A1203-A1206 PolarHBondContact O-N 2.86Å; G1204-A1206 VanDerWaalsContact C-N 3.31Å; G1204-A1206 PolarHBondContact O-N 2.63Å
1207	G	80.9	Confident	80.1	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.01	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-97.5	-5.4	177.9	0	0	0	0	0	114.5	G1204 A1205 D1209 L1210 L1211	G1204-G1207 PolarHBondContact O-N 3.14Å; G1204-G1207 VanDerWaalsContact O-N 3.16Å; A1205-G1207 PolarHBondContact O-N 3.31Å; G1207-D1209 PolarHBondContact O-N 3.27Å; G1207-L1210 WeakPolarHBondContact O-CB 3.26Å; G1207-L1210 PolarHBondContact O-N 3.23Å; G1207-L1210 VanDerWaalsContact O-N 3.16Å; G1207-L1211 PolarHBondContact O-N 3.25Å
1208	K	83.8	Confident	78.5	Confident	132 Å²	132	58.5 Å²	58.5	57%	0.574	33%	0.33	S	S	*	.	H	α-helix	trans	-62.3	-41.9	-171.3	-166.6	177.4	-177.5	-179.4	0	113.1	G1204 A1205 L1210 L1211 N1212	G1204-K1208 PolarHBondContact O-N 3.03Å; A1205-K1208 WeakPolarHBondContact O-CB 3.48Å; A1205-K1208 PolarHBondContact O-N 2.87Å; K1208-L1210 VanDerWaalsContact C-N 3.32Å; K1208-L1210 PolarHBondContact O-N 2.96Å; K1208-L1211 PolarHBondContact O-N 3.33Å; K1208-N1212 VanDerWaalsContact O-CG 3.25Å; K1208-N1212 PolarHBondContact O-N 3.18Å; K1208-N1212 VanDerWaalsContact O-N 3.08Å; K1208-N1212 PolarHBondContact O-ND2 3.46Å
1209	D	81.3	Confident	76.4	Confident	120 Å²	120	63.7 Å²	63.7	64%	0.642	35%	0.353	S	S	*	.	H	α-helix	trans	-64.2	-40.1	177.3	-62.2	-23.4	0	0	0	111.1	G1207 N1212 E1213	G1207-D1209 PolarHBondContact O-N 3.27Å; D1209-N1212 PolarHBondContact O-N 2.69Å; D1209-E1213 WeakPolarHBondContact O-CG 3.3Å; D1209-E1213 PolarHBondContact O-N 3.42Å
1210	L	83	Confident	74.3	Confident	15 Å²	15	70.9 Å²	70.9	8%	0.079	39%	0.387	C	S	.	.	H	α-helix	trans	-66.4	-39	176.8	-159.8	88.2	0	0	0	112.3	A1184 R1185 K1188 A1200 G1207 K1208 E1213 L1214	A1184-L1210 HydrophobicContact CB-CD2 3.51Å; R1185-L1210 HydrophobicContact CB-CD1 4.5Å; R1185-L1210 HydrophobicContact CG-CD1 3.37Å; R1185-L1210 HydrophobicContact CG-CD2 4.45Å; K1188-L1210 HydrophobicContact CD-CD1 4.02Å; A1200-L1210 HydrophobicContact CB-CB 4.37Å; A1200-L1210 HydrophobicContact CB-CD2 3.88Å; G1207-L1210 WeakPolarHBondContact O-CB 3.26Å; G1207-L1210 PolarHBondContact O-N 3.23Å; G1207-L1210 VanDerWaalsContact O-N 3.16Å; K1208-L1210 VanDerWaalsContact C-N 3.32Å; K1208-L1210 PolarHBondContact O-N 2.96Å; L1210-E1213 PolarHBondContact O-N 2.99Å; L1210-L1214 HydrophobicContact CD2-CD1 3.9Å; L1210-L1214 HydrophobicContact CG-CD1 4.06Å; L1210-L1214 WeakPolarHBondContact O-CB 3.39Å; L1210-L1214 VanDerWaalsContact O-CG 3.24Å; L1210-L1214 WeakPolarHBondContact O-CG 3.41Å; L1210-L1214 PolarHBondContact O-N 2.97Å
1211	L	84.4	Confident	72.2	Confident	30 Å²	30	78.3 Å²	78.3	16%	0.157	42%	0.415	C	S	.	.	H	α-helix	trans	-60.7	-47.4	175.5	-75.3	168	0	0	0	110.6	V1197 A1200 G1207 K1208 E1213 L1214 E1215	V1197-L1211 HydrophobicContact CB-CD2 4.46Å; V1197-L1211 HydrophobicContact CG1-CD2 3.97Å; A1200-L1211 HydrophobicContact CB-CD1 4.46Å; A1200-L1211 HydrophobicContact CB-CD2 3.79Å; A1200-L1211 HydrophobicContact CB-CG 3.72Å; G1207-L1211 PolarHBondContact O-N 3.25Å; K1208-L1211 PolarHBondContact O-N 3.33Å; L1211-E1213 VanDerWaalsContact C-N 3.32Å; L1211-E1213 PolarHBondContact O-N 3.23Å; L1211-L1214 PolarHBondContact O-N 3.4Å; L1211-L1214 VanDerWaalsContact O-N 3.13Å; L1211-E1215 WeakPolarHBondContact O-CB 3.48Å; L1211-E1215 WeakPolarHBondContact O-CG 3.37Å; L1211-E1215 PolarHBondContact O-N 3.38Å
1212	N	81.9	Confident	70.1	Confident	83 Å²	83	81.8 Å²	81.8	44%	0.444	43%	0.427	S	S	.	.	H	α-helix	trans	-60.1	-40.3	176.9	-63	-22.1	0	0	0	112	K1208 D1209 S1216	K1208-N1212 VanDerWaalsContact O-CG 3.25Å; K1208-N1212 PolarHBondContact O-N 3.18Å; K1208-N1212 VanDerWaalsContact O-N 3.08Å; K1208-N1212 PolarHBondContact O-ND2 3.46Å; D1209-N1212 PolarHBondContact O-N 2.69Å; N1212-S1216 WeakPolarHBondContact O-CB 3.29Å; N1212-S1216 PolarHBondContact O-N 3.34Å; N1212-S1216 PolarHBondContact O-OG 3.06Å
1213	E	81.1	Confident	67.8	Low	101 Å²	101	86 Å²	86	47%	0.472	45%	0.448	S	S	.	.	H	α-helix	trans	-66.9	-35.5	175	-73.1	179.6	-177	0	0	113.3	K1188 D1209 L1210 L1211 S1216	K1188-E1213 IonicContact NZ-OE2 3.79Å; K1188-E1213 PolarHBondContact NZ-OE2 2.92Å; D1209-E1213 WeakPolarHBondContact O-CG 3.3Å; D1209-E1213 PolarHBondContact O-N 3.42Å; L1210-E1213 PolarHBondContact O-N 2.99Å; L1211-E1213 VanDerWaalsContact C-N 3.32Å; L1211-E1213 PolarHBondContact O-N 3.23Å; E1213-S1216 WeakPolarHBondContact CA-OG 3.37Å; E1213-S1216 PolarHBondContact O-OG 3.33Å; E1213-S1216 VanDerWaalsContact O-OG 3.13Å
1214	L	76.6	Confident	65.3	Low	10 Å²	10	96.8 Å²	96.8	5%	0.052	50%	0.498	C	S	.	.	H	α-helix	trans	-75.1	-34.7	179	-72.6	167.3	0	0	0	111.4	K1188 A1196 V1197 L1210 L1211 S1217	K1188-L1214 HydrophobicContact CB-CD2 4.45Å; K1188-L1214 HydrophobicContact CD-CD2 3.87Å; K1188-L1214 HydrophobicContact CD-CG 4.37Å; K1188-L1214 HydrophobicContact CG-CD2 3.92Å; A1196-L1214 HydrophobicContact CB-CD1 3.78Å; A1196-L1214 HydrophobicContact CB-CD2 4.47Å; V1197-L1214 HydrophobicContact CG2-CB 4.16Å; V1197-L1214 HydrophobicContact CG2-CD1 3.91Å; L1210-L1214 HydrophobicContact CD2-CD1 3.9Å; L1210-L1214 HydrophobicContact CG-CD1 4.06Å; L1210-L1214 WeakPolarHBondContact O-CB 3.39Å; L1210-L1214 VanDerWaalsContact O-CG 3.24Å; L1210-L1214 WeakPolarHBondContact O-CG 3.41Å; L1210-L1214 PolarHBondContact O-N 2.97Å; L1211-L1214 PolarHBondContact O-N 3.4Å; L1211-L1214 VanDerWaalsContact O-N 3.13Å; L1214-S1217 PolarHBondContact O-OG 3.14Å
1215	E	71.2	Confident	64.3	Low	109 Å²	109	99.6 Å²	99.6	51%	0.509	50%	0.502	S	S	.	.	H	α-helix	trans	-74.5	-42.8	177	-72	177.2	178.4	0	0	112.7	L1211 S1217 K1218	L1211-E1215 WeakPolarHBondContact O-CB 3.48Å; L1211-E1215 WeakPolarHBondContact O-CG 3.37Å; L1211-E1215 PolarHBondContact O-N 3.38Å; E1215-S1217 VanDerWaalsContact C-N 3.26Å; E1215-S1217 PolarHBondContact O-N 3.29Å; E1215-K1218 WeakPolarHBondContact O-CB 3.34Å; E1215-K1218 PolarHBondContact O-N 3.1Å
1216	S	61.3	Low	63.4	Low	57 Å²	57	99.9 Å²	99.9	40%	0.399	49%	0.488	S	S	.	.	H	α-helix	trans	-59.5	-33.9	175	47	0	0	0	0	113.2	N1212 E1213 K1218 E1219 E1220	N1212-S1216 WeakPolarHBondContact O-CB 3.29Å; N1212-S1216 PolarHBondContact O-N 3.34Å; N1212-S1216 PolarHBondContact O-OG 3.06Å; E1213-S1216 WeakPolarHBondContact CA-OG 3.37Å; E1213-S1216 PolarHBondContact O-OG 3.33Å; E1213-S1216 VanDerWaalsContact O-OG 3.13Å; S1216-K1218 PolarHBondContact O-N 2.8Å; S1216-K1218 VanDerWaalsContact O-N 3.12Å; S1216-E1219 PolarHBondContact O-N 2.98Å; S1216-E1220 PolarHBondContact O-N 3.24Å
1217	S	54	Low	62.5	Low	30 Å²	30	102.5 Å²	102.5	21%	0.21	49%	0.49	C	S	.	.	H	α-helix	trans	-65.7	-11.1	173.9	81.3	0	0	0	0	114.9	K1193 L1214 E1215	K1193-S1217 PolarHBondContact NZ-OG 3.22Å; L1214-S1217 PolarHBondContact O-OG 3.14Å; E1215-S1217 VanDerWaalsContact C-N 3.26Å; E1215-S1217 PolarHBondContact O-N 3.29Å
1218	K	49.7	Very low	61.4	Low	153 Å²	153	108.5 Å²	108.5	67%	0.665	52%	0.519	S	S	*	.	H	α-helix	trans	-85	-34.3	170.1	-81.4	-179.6	168.7	179	0	112.2	E1215 S1216 R1221 I1222	E1215-K1218 WeakPolarHBondContact O-CB 3.34Å; E1215-K1218 PolarHBondContact O-N 3.1Å; S1216-K1218 PolarHBondContact O-N 2.8Å; S1216-K1218 VanDerWaalsContact O-N 3.12Å; K1218-R1221 PolarHBondContact O-N 3.15Å; K1218-I1222 WeakPolarHBondContact O-CG1 3.27Å
1219	E	40.2	Very low	60	Low	144 Å²	144	107 Å²	107	67%	0.673	52%	0.515	S	S	*	.	H	α-helix	trans	-72.1	-40.5	-176.2	-69.1	-177.7	161.1	0	0	111.5	S1216 R1221 I1222	S1216-E1219 PolarHBondContact O-N 2.98Å; E1219-R1221 PolarHBondContact O-N 2.96Å; E1219-I1222 PolarHBondContact O-N 3.12Å; E1219-I1222 VanDerWaalsContact O-N 3.16Å
1220	E	42.1	Very low	58.6	Low	151 Å²	151	106.1 Å²	106.1	71%	0.706	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-22.5	176	-71.8	-179.4	160.7	0	0	114	S1216	S1216-E1220 PolarHBondContact O-N 3.24Å
1221	R	41.2	Very low	56.8	Low	157 Å²	157	112.6 Å²	112.6	59%	0.592	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-8.5	177.7	-83.9	-173.6	-178.8	-170.4	-2.3	114.7	K1218 E1219	K1218-R1221 PolarHBondContact O-N 3.15Å; E1219-R1221 PolarHBondContact O-N 2.96Å
1222	I	42.7	Very low	54.7	Low	142 Å²	142	119 Å²	119	73%	0.728	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.1	-15.9	174.8	-64.9	168.5	0	0	0	110	K1218 E1219	K1218-I1222 WeakPolarHBondContact O-CG1 3.27Å; E1219-I1222 PolarHBondContact O-N 3.12Å; E1219-I1222 VanDerWaalsContact O-N 3.16Å
1223	E	36.6	Very low	52.4	Low	182 Å²	182	122 Å²	122	85%	0.85	58%	0.577	S	S	*	*			trans	-97.5	-6.2	177.4	-68	-169.3	157.3	0	0	115
1224	E	32.8	Very low	49.8	Very low	228 Å²	228	123.9 Å²	123.9	100%	1.065	59%	0.586	S	S	*	*			trans	-103.2	0	165.9	-76.1	-171.4	160.7	0	0	111.4

Retrieved 1,224 of 1,224 residues in 364.2 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).