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Major vault protein

Structural component of the vault particle, which is a massive ribonucleoprotein complex that may play a role in cargo transport and signal transduction. Oligomerizes to form a cage-like vault complex, which can house several minor vault components including PARP4. Vaults may play a role in nucleo-cytoplasmic transport. Down-regulates IFNG-mediated STAT1 signaling and subsequent activation of JAK. Down-regulates SRC activity and signaling through MAP kinases.

AlphaFold DB , UniProt , Accession X5D7K9, Species HUMAN (Homo sapiens, Human), Gene MVP, Length 827 aa.

						>X5D7K9_HUMAN|X5D7K9|MVP
MATEEFIIRIPPYHYIHVLDQNSNVSRVEVGPKTYIRQDNERVLFAPMRMVTVPPRHYCTVANPVSRDAQGLVLFDVTGQVRLRHADLEIRLAQDPFPLYPGEVLEKDITPLQVVLPNTALHLKALLDFEDKDGDKVVAGDEWLFEGPGTYIPRKEVEVVEIIQATIIRQNQALRLRARKECWDRDGKERVTGEEWLVTTVGAYLPAVFEEVLDLVDAVILTEKTALHLRARRNFRDFRGVSRRTGEEWLVTVQDTEAHVPDVHEEVLGVVPITTLGPHNYCVILDPVGPDGKNQLGQKRVVKGEKSFFLQPGEQLEQGIQDVYVLSEQQGLLLRALQPLEEGEDEEKVSHQAGDHWLIRGPLEYVPSAKVEVVEERQAIPLDENEGIYVQDVKTGKVRAVIGSTYMLTQDEVLWEKELPPGVEELLNKGQDPLADRGEKDTAKSLQPLAPRNKTRVVSYRVPHNAAVQVYDYREKRARHFEVNDRKDPQETAKLFSVPDFVGDACKAIASRVRGAVASVTFDDFHKNSARIIRTAVFGFETSEAKGPDGMALSRPRDQAVFPQNGLVVSSVDVQSVEPVDQRTRDALQRSVQLAIEITTNSQEAAAKHEAQRLEQEARGRLERQKILDQSEAEKARKELLELEALSMAVESTGTAKAEAESRAEAARIEGEGSVLQAKLKAQALAIETEAELQRVQKVRELELVYARAQLELEVSKAQQLAEVEVKKFKQMTEAIGPSTIRDLAVAGPEMQVKLLQSLGLKSTLITDGSTPINLFNTAFGLLGMGPEGQPLGRRVASGPSPGEGISPQSAQAPQAPGDNHVVPVLR
					

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(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	49.5	Very low	73.9	Confident	210 Å²	210	93.8 Å²	93.8	100%	1.034	47%	0.468	S	S	*	.				0	140	0	-66	-150.5	-149	0	0	108	T3 A46	M1-T3 PolarHBondContact O-N 3.34Å; M1-A46 HydrophobicContact CB-CB 3.73Å; M1-A46 HydrophobicContact CG-CB 4.46Å; M1-A46 HydrophobicContact SD-CB 4.29Å
2	A	49.2	Very low	75.4	Confident	63 Å²	63	92.2 Å²	92.2	52%	0.521	47%	0.469	S	S	.	.			trans	-68	121.8	-173.1	0	0	0	0	0	111	E4 E5	A2-E4 VanDerWaalsContact C-N 3.35Å; A2-E5 HydrophobicContact CB-CG 4.12Å
3	T	57.7	Low	76.8	Confident	58 Å²	58	96.7 Å²	96.7	36%	0.356	48%	0.478	S	S	.	.	S	Bend	trans	-87.7	-6.3	176.7	45.8	0	0	0	0	112.8	M1	M1-T3 PolarHBondContact O-N 3.34Å
4	E	62	Low	78	Confident	168 Å²	168	92.8 Å²	92.8	79%	0.785	46%	0.458	S	S	*	.			trans	-101.8	31.2	-178.8	-62.7	-169.3	164.4	0	0	113.3	A2	A2-E4 VanDerWaalsContact C-N 3.35Å
5	E	70.6	Confident	79.1	Confident	103 Å²	103	87.1 Å²	87.1	48%	0.481	43%	0.43	S	S	.	.			trans	-84.3	135.8	173.3	-66.3	-173.8	176.8	0	0	110.9	A2 I7 I8	A2-E5 HydrophobicContact CB-CG 4.12Å; E5-I7 VanDerWaalsContact C-N 3.28Å; E5-I7 PolarHBondContact O-N 3.18Å; E5-I8 HydrophobicContact CB-CG1 4.26Å
6	F	75.8	Confident	80	Confident	121 Å²	121	81.7 Å²	81.7	53%	0.531	40%	0.403	S	S	.	.	S	Bend	trans	-69.7	-28.2	178.3	-166.4	-98	0	0	0	112.3	I36 R37	F6-I36 HydrophobicContact CD1-CG2 4.31Å; F6-I36 HydrophobicContact CE1-CG2 3.88Å; F6-I36 HydrophobicContact CZ-CG2 4.46Å; F6-R37 PolarHBondContact O-N 2.84Å; F6-R37 VanDerWaalsContact O-N 3.17Å
7	I	85.4	Confident	80.8	Confident	96 Å²	96	77.9 Å²	77.9	49%	0.492	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	118.2	-178.9	-55.6	178.9	0	0	0	108.2	E5 T34	E5-I7 VanDerWaalsContact C-N 3.28Å; E5-I7 PolarHBondContact O-N 3.18Å; I7-T34 HydrophobicContact CG2-CG2 3.36Å
8	I	88.3	Confident	81.4	Confident	10 Å²	10	73.6 Å²	73.6	5%	0.051	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	112.5	-179.2	-62.4	166.4	0	0	0	108.6	E5 I10 I16 Y35 V43 P47	E5-I8 HydrophobicContact CB-CG1 4.26Å; I8-I10 HydrophobicContact CG2-CG1 4.18Å; I8-I10 PolarHBondContact O-N 3.05Å; I8-I16 HydrophobicContact CD1-CD1 4.44Å; I8-I16 HydrophobicContact CG2-CD1 4.22Å; I8-I16 HydrophobicContact CG2-CG2 4.5Å; I8-Y35 PolarHBondContact N-O 3.26Å; I8-Y35 PolarHBondContact O-N 3.16Å; I8-V43 HydrophobicContact CD1-CB 3.81Å; I8-V43 HydrophobicContact CD1-CG1 3.87Å; I8-V43 HydrophobicContact CD1-CG2 3.27Å; I8-P47 HydrophobicContact CG2-CG 3.76Å
9	R	90.1	Very high	82	Confident	156 Å²	156	70.8 Å²	70.8	59%	0.589	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.4	110.7	173	-176.7	63.5	175.2	177.3	1.3	108.9	P11 T34	R9-P11 VanDerWaalsContact O-CD 3.32Å; R9-P11 WeakPolarHBondContact O-CD 3.5Å; R9-T34 VanDerWaalsContact CD-OG1 3.27Å; R9-T34 WeakPolarHBondContact CD-OG1 3.46Å; R9-T34 PolarHBondContact NH1-OG1 2.97Å
10	I	92.3	Very high	82.4	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	111.1	175.7	-49.8	171.2	0	0	0	107.9	I8 H14 I16 E29 P32 K33 P47	I8-I10 HydrophobicContact CG2-CG1 4.18Å; I8-I10 PolarHBondContact O-N 3.05Å; I10-H14 HydrophobicContact CG2-CB 4.07Å; I10-H14 WeakPolarHBondContact CG2-O 3.46Å; I10-I16 HydrophobicContact CD1-CD1 3.59Å; I10-I16 HydrophobicContact CD1-CG1 3.66Å; I10-I16 HydrophobicContact CG1-CD1 4.15Å; I10-I16 HydrophobicContact CG1-CG1 4.38Å; I10-I16 HydrophobicContact CG1-CG2 4.42Å; I10-E29 HydrophobicContact CD1-CB 4.17Å; I10-P32 WeakPolarHBondContact O-CA 3.49Å; I10-K33 HydrophobicContact CB-CG 4.27Å; I10-K33 WeakPolarHBondContact CB-O 3.43Å; I10-K33 HydrophobicContact CD1-CD 4.3Å; I10-K33 HydrophobicContact CD1-CG 3.83Å; I10-K33 HydrophobicContact CG1-CG 4.4Å; I10-K33 PolarHBondContact N-O 3.29Å; I10-K33 PolarHBondContact O-N 3.27Å; I10-K33 VanDerWaalsContact O-N 3.1Å; I10-P47 HydrophobicContact CG1-CG 4.39Å; I10-P47 HydrophobicContact CG2-CB 4.46Å
11	P	91.8	Very high	82.7	Confident	47 Å²	47	70.2 Å²	70.2	31%	0.305	35%	0.345	S	S	.	.			trans	-66	167.3	178.8	-18.8	32.6	0	0	0	112.7	R9 H14	R9-P11 VanDerWaalsContact O-CD 3.32Å; R9-P11 WeakPolarHBondContact O-CD 3.5Å; P11-H14 HydrophobicContact CB-CB 4.5Å; P11-H14 PolarHBondContact O-N 3.12Å
12	P	92.4	Very high	84.6	Confident	74 Å²	74	66.4 Å²	66.4	48%	0.481	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	143.7	167.9	-19.7	28.9	0	0	0	111.7	H14 P32	P12-H14 PolarHBondContact O-N 3.35Å; P12-H14 VanDerWaalsContact O-N 3.17Å; P12-H14 PolarHBondContact O-ND1 2.65Å; P12-P32 HydrophobicContact CG-CB 4.01Å
13	Y	92.9	Very high	86.3	Confident	151 Å²	151	66.2 Å²	66.2	59%	0.592	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	27.2	-178.7	-48.5	-68.2	0	0	0	114.8	M50 P96	Y13-M50 WeakPolarHBondContact O-CB 3.12Å; Y13-M50 WeakPolarHBondContact O-CG 3.2Å; Y13-M50 PolarHBondContact O-N 2.88Å; Y13-P96 HydrophobicContact CD1-CB 3.82Å; Y13-P96 HydrophobicContact CD1-CG 3.8Å; Y13-P96 HydrophobicContact CE1-CB 4.45Å; Y13-P96 HydrophobicContact CE1-CG 4.01Å
14	H	94.3	Very high	87.7	Confident	42 Å²	42	69.1 Å²	69.1	19%	0.194	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	157.7	170.7	-66.9	63.5	0	0	0	110.2	I10 P11 P12 G31 P47 M48 R49	I10-H14 HydrophobicContact CG2-CB 4.07Å; I10-H14 WeakPolarHBondContact CG2-O 3.46Å; P11-H14 HydrophobicContact CB-CB 4.5Å; P11-H14 PolarHBondContact O-N 3.12Å; P12-H14 PolarHBondContact O-N 3.35Å; P12-H14 VanDerWaalsContact O-N 3.17Å; P12-H14 PolarHBondContact O-ND1 2.65Å; H14-G31 PolarHBondContact O-N 2.71Å; H14-P47 HydrophobicContact CB-CB 4.17Å; H14-M48 CarbonylContact C-O 3.54Å; H14-M48 WeakPolarHBondContact CA-O 3.33Å; H14-M48 VanDerWaalsContact CB-O 3.31Å; H14-M48 WeakPolarHBondContact CB-O 3.49Å; H14-R49 WeakPolarHBondContact NE2-CG 3.35Å
15	Y	95.1	Very high	89	Confident	8 Å²	8	61.8 Å²	61.8	3%	0.031	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	157.8	177.1	70.6	-80.9	0	0	0	111.5	H17 V28 E29 F45 M48 R49 M50 P98 L99	Y15-H17 AromaticContact CD2-CD2 3.97Å; Y15-H17 AromaticContact CD2-NE2 3.86Å; Y15-H17 AromaticContact CE2-NE2 3.56Å; Y15-V28 HydrophobicContact CD2-CG2 3.8Å; Y15-V28 HydrophobicContact CG-CG2 4.21Å; Y15-E29 WeakPolarHBondContact CA-O 3.11Å; Y15-F45 HydrophobicContact CD2-CE2 4.2Å; Y15-F45 HydrophobicContact CD2-CZ 4.22Å; Y15-F45 HydrophobicContact CE2-CE2 4.02Å; Y15-F45 AromaticContact CE2-CZ 3.8Å; Y15-F45 HydrophobicContact CE2-CZ 3.8Å; Y15-M48 HydrophobicContact CE1-CB 4.26Å; Y15-M48 HydrophobicContact CE2-CE 4.26Å; Y15-M48 PolarHBondContact N-O 3.06Å; Y15-M48 PolarHBondContact O-N 3.41Å; Y15-R49 WeakPolarHBondContact CE1-O 3.24Å; Y15-M50 HydrophobicContact CD1-CG 3.92Å; Y15-P98 HydrophobicContact CD1-CB 3.59Å; Y15-P98 HydrophobicContact CD2-CB 3.89Å; Y15-P98 HydrophobicContact CE1-CB 4.14Å; Y15-P98 HydrophobicContact CE2-CB 4.4Å; Y15-P98 HydrophobicContact CG-CB 3.46Å; Y15-P98 VanDerWaalsContact CG-CB 3.46Å; Y15-L99 HydrophobicContact CE2-CB 4.42Å; Y15-L99 VanDerWaalsContact CE2-O 3.26Å; Y15-L99 WeakPolarHBondContact CE2-O 3.36Å; Y15-L99 WeakPolarHBondContact OH-CB 3.05Å
16	I	93.2	Very high	90	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	160.2	167.9	63.1	179.1	0	0	0	109.3	I8 I10 V18 E29 Y35 V43 P47	I8-I16 HydrophobicContact CD1-CD1 4.44Å; I8-I16 HydrophobicContact CG2-CD1 4.22Å; I8-I16 HydrophobicContact CG2-CG2 4.5Å; I10-I16 HydrophobicContact CD1-CD1 3.59Å; I10-I16 HydrophobicContact CD1-CG1 3.66Å; I10-I16 HydrophobicContact CG1-CD1 4.15Å; I10-I16 HydrophobicContact CG1-CG1 4.38Å; I10-I16 HydrophobicContact CG1-CG2 4.42Å; I16-V18 HydrophobicContact CD1-CG2 3.87Å; I16-V18 HydrophobicContact CG1-CG2 4.06Å; I16-E29 HydrophobicContact CD1-CB 4.34Å; I16-E29 HydrophobicContact CG1-CB 3.75Å; I16-E29 PolarHBondContact N-O 3.46Å; I16-E29 PolarHBondContact O-N 3.35Å; I16-Y35 HydrophobicContact CD1-CD1 4.11Å; I16-Y35 HydrophobicContact CD1-CG 4.3Å; I16-V43 HydrophobicContact CB-CG1 4.17Å; I16-V43 HydrophobicContact CD1-CG1 4.05Å; I16-V43 HydrophobicContact CD1-CG2 4.25Å; I16-V43 HydrophobicContact CG2-CG1 4.48Å; I16-P47 VanDerWaalsContact CG2-CA 3.49Å; I16-P47 HydrophobicContact CG2-CB 4.08Å; I16-P47 HydrophobicContact CG2-CG 3.74Å
17	H	93.9	Very high	90.7	Very high	17 Å²	17	55.3 Å²	55.3	8%	0.079	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	134	163.6	-66.1	169.4	0	0	0	110.1	Y15 R27 L44 F45 L99 P101	Y15-H17 AromaticContact CD2-CD2 3.97Å; Y15-H17 AromaticContact CD2-NE2 3.86Å; Y15-H17 AromaticContact CE2-NE2 3.56Å; H17-R27 WeakPolarHBondContact CA-O 3.2Å; H17-L44 HydrophobicContact CB-CB 4.17Å; H17-L44 HydrophobicContact CB-CD1 3.77Å; H17-L44 HydrophobicContact CB-CG 4.16Å; H17-L44 PolarHBondContact O-N 2.7Å; H17-F45 HydrophobicContact CB-CE1 3.69Å; H17-F45 HydrophobicContact CB-CZ 3.78Å; H17-F45 AromaticContact CD2-CZ 3.61Å; H17-F45 AromaticContact CE1-CE1 3.89Å; H17-F45 AromaticContact CE1-CZ 3.74Å; H17-F45 AromaticContact CG-CE1 3.47Å; H17-F45 VanDerWaalsContact CG-CE1 3.47Å; H17-F45 AromaticContact CG-CZ 3.34Å; H17-F45 AromaticContact ND1-CE1 3.28Å; H17-F45 VanDerWaalsContact ND1-CE1 3.28Å; H17-F45 WeakPolarHBondContact ND1-CE1 3.37Å; H17-F45 AromaticContact ND1-CZ 3.47Å; H17-F45 WeakPolarHBondContact ND1-CZ 3.36Å; H17-F45 AromaticContact NE2-CZ 3.84Å; H17-L99 PolarHBondContact CE1-O 3.31Å; H17-L99 PolarHBondContact NE2-O 3.12Å; H17-P101 HydrophobicContact CB-CG 4.42Å; H17-P101 VanDerWaalsContact CE1-CA 3.47Å; H17-P101 WeakPolarHBondContact CE1-CA 3.17Å
18	V	91.3	Very high	91.1	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	123.7	176.6	-175	0	0	0	0	108.4	I16 S26 R27 E29 Y35 E41 V43	I16-V18 HydrophobicContact CD1-CG2 3.87Å; I16-V18 HydrophobicContact CG1-CG2 4.06Å; V18-S26 WeakPolarHBondContact O-CA 3.33Å; V18-R27 PolarHBondContact N-O 3.46Å; V18-R27 PolarHBondContact O-N 3.3Å; V18-E29 HydrophobicContact CB-CG 4.34Å; V18-E29 HydrophobicContact CG2-CB 4.35Å; V18-E29 HydrophobicContact CG2-CG 3.68Å; V18-Y35 HydrophobicContact CG1-CE1 4.32Å; V18-Y35 HydrophobicContact CG2-CD1 4.45Å; V18-Y35 HydrophobicContact CG2-CE1 3.81Å; V18-E41 HydrophobicContact CG1-CB 3.76Å; V18-E41 HydrophobicContact CG1-CG 4.05Å; V18-V43 HydrophobicContact CG2-CG2 4.14Å
19	L	92.1	Very high	91.3	Very high	22 Å²	22	53 Å²	53	12%	0.115	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	117.5	173.5	172.4	68.4	0	0	0	108.9	S26 E41 R42 L44	L19-S26 VanDerWaalsContact CD1-OG 3.29Å; L19-S26 WeakPolarHBondContact CD1-OG 3.29Å; L19-E41 CarbonylContact O-C 3.51Å; L19-E41 WeakPolarHBondContact O-CA 3.45Å; L19-R42 PolarHBondContact N-O 3.25Å; L19-R42 PolarHBondContact O-N 2.78Å; L19-L44 HydrophobicContact CB-CD2 3.93Å; L19-L44 HydrophobicContact CB-CG 4.37Å; L19-L44 HydrophobicContact CD2-CD2 4.36Å
20	D	90.9	Very high	91.5	Very high	28 Å²	28	48.3 Å²	48.3	15%	0.15	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	118.5	165.9	174.6	6.2	0	0	0	109.1	N22 S23 N24 V25 N40	D20-N22 VanDerWaalsContact C-N 3.31Å; D20-N22 PolarHBondContact O-N 2.99Å; D20-N22 WeakPolarHBondContact OD1-CB 3.47Å; D20-N22 PolarHBondContact OD1-N 2.93Å; D20-S23 WeakPolarHBondContact CB-OG 3.5Å; D20-S23 PolarHBondContact OD2-OG 2.7Å; D20-N24 CarbonylContact O-C 3.49Å; D20-N24 WeakPolarHBondContact O-CA 3.16Å; D20-N24 PolarHBondContact O-N 3.03Å; D20-V25 PolarHBondContact N-O 2.8Å; D20-V25 PolarHBondContact O-N 3.32Å; D20-N40 PolarHBondContact OD1-ND2 3.42Å
21	Q	88.5	Confident	91.4	Very high	100 Å²	100	48.8 Å²	48.8	47%	0.467	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-19	-176.3	-62.8	-177.6	-25.9	0	0	113.2	N40	Q21-N40 WeakPolarHBondContact CB-O 3.22Å; Q21-N40 PolarHBondContact N-O 2.94Å
22	N	88.4	Confident	91.4	Very high	131 Å²	131	51 Å²	51	70%	0.701	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-43.9	178	-69.9	-17.6	0	0	0	111.1	D20 N40	D20-N22 VanDerWaalsContact C-N 3.31Å; D20-N22 PolarHBondContact O-N 2.99Å; D20-N22 WeakPolarHBondContact OD1-CB 3.47Å; D20-N22 PolarHBondContact OD1-N 2.93Å; N22-N40 VanDerWaalsContact ND2-CB 3.34Å; N22-N40 WeakPolarHBondContact ND2-CB 3.28Å; N22-N40 PolarHBondContact ND2-ND2 3.45Å
23	S	85.2	Confident	91.3	Very high	58 Å²	58	50.1 Å²	50.1	41%	0.406	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-11.5	-178.8	60.8	0	0	0	0	113.3	D20 V25	D20-S23 WeakPolarHBondContact CB-OG 3.5Å; D20-S23 PolarHBondContact OD2-OG 2.7Å; S23-V25 PolarHBondContact O-N 3.46Å; S23-V25 WeakPolarHBondContact OG-CB 3.34Å; S23-V25 WeakPolarHBondContact OG-CG2 3.26Å; S23-V25 PolarHBondContact OG-N 3.25Å
24	N	87.5	Confident	91.2	Very high	120 Å²	120	46.2 Å²	46.2	64%	0.642	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.3	24.1	-168	-78.9	-31.2	0	0	0	114.1	D20	D20-N24 CarbonylContact O-C 3.49Å; D20-N24 WeakPolarHBondContact O-CA 3.16Å; D20-N24 PolarHBondContact O-N 3.03Å
25	V	89.9	Confident	91	Very high	13 Å²	13	45.3 Å²	45.3	8%	0.079	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	122.8	-179.5	178.1	0	0	0	0	109.7	D20 S23 T78 Q80	D20-V25 PolarHBondContact N-O 2.8Å; D20-V25 PolarHBondContact O-N 3.32Å; S23-V25 PolarHBondContact O-N 3.46Å; S23-V25 WeakPolarHBondContact OG-CB 3.34Å; S23-V25 WeakPolarHBondContact OG-CG2 3.26Å; S23-V25 PolarHBondContact OG-N 3.25Å; V25-T78 WeakPolarHBondContact CG2-O 3.49Å; V25-Q80 HydrophobicContact CG1-CB 4.46Å
26	S	91.4	Very high	90.7	Very high	21 Å²	21	49.2 Å²	49.2	15%	0.147	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	126.1	170.6	-63.6	0	0	0	0	110.1	V18 L19 Q80 P101	V18-S26 WeakPolarHBondContact O-CA 3.33Å; L19-S26 VanDerWaalsContact CD1-OG 3.29Å; L19-S26 WeakPolarHBondContact CD1-OG 3.29Å; S26-Q80 PolarHBondContact O-NE2 3.02Å; S26-Q80 PolarHBondContact O-OE1 2.82Å; S26-Q80 VanDerWaalsContact O-OE1 3.1Å; S26-P101 WeakPolarHBondContact O-CG 3.46Å
27	R	90.1	Very high	90.4	Very high	68 Å²	68	51.8 Å²	51.8	26%	0.257	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	159.7	177.8	68.3	-174.9	-172.5	-89.5	-0.7	112.1	H17 V18 E29 Y35 E41	H17-R27 WeakPolarHBondContact CA-O 3.2Å; V18-R27 PolarHBondContact N-O 3.46Å; V18-R27 PolarHBondContact O-N 3.3Å; R27-E29 IonicContact CZ-OE1 3.73Å; R27-E29 IonicContact NE-OE1 2.72Å; R27-E29 PolarHBondContact NE-OE1 2.99Å; R27-E29 IonicContact NH2-OE1 3.2Å; R27-E29 PolarHBondContact NH2-OE1 3.21Å; R27-Y35 PolarHBondContact NH2-OH 3.07Å; R27-E41 IonicContact CZ-OE1 3.38Å; R27-E41 IonicContact NH1-OE1 2.51Å; R27-E41 PolarHBondContact NH1-OE1 3.32Å; R27-E41 IonicContact NH2-OE1 2.8Å; R27-E41 PolarHBondContact NH2-OE1 2.87Å
28	V	94	Very high	90.1	Very high	26 Å²	26	56 Å²	56	16%	0.158	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	136	176.5	70	0	0	0	0	110.6	Y15 V30 P98 Y100	Y15-V28 HydrophobicContact CD2-CG2 3.8Å; Y15-V28 HydrophobicContact CG-CG2 4.21Å; V28-V30 HydrophobicContact CG2-CG2 4.22Å; V28-P98 HydrophobicContact CG2-CB 3.87Å; V28-P98 HydrophobicContact CG2-CG 4.18Å; V28-Y100 HydrophobicContact CB-CD1 4.15Å; V28-Y100 HydrophobicContact CB-CE1 4.4Å; V28-Y100 HydrophobicContact CG1-CD1 3.53Å; V28-Y100 HydrophobicContact CG1-CE1 3.32Å
29	E	92.1	Very high	89.8	Confident	31 Å²	31	63 Å²	63	15%	0.145	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	111.1	174.4	-67	-66.9	173.5	0	0	108.6	I10 Y15 I16 V18 R27 K33 Y35	I10-E29 HydrophobicContact CD1-CB 4.17Å; Y15-E29 WeakPolarHBondContact CA-O 3.11Å; I16-E29 HydrophobicContact CD1-CB 4.34Å; I16-E29 HydrophobicContact CG1-CB 3.75Å; I16-E29 PolarHBondContact N-O 3.46Å; I16-E29 PolarHBondContact O-N 3.35Å; V18-E29 HydrophobicContact CB-CG 4.34Å; V18-E29 HydrophobicContact CG2-CB 4.35Å; V18-E29 HydrophobicContact CG2-CG 3.68Å; R27-E29 IonicContact CZ-OE1 3.73Å; R27-E29 IonicContact NE-OE1 2.72Å; R27-E29 PolarHBondContact NE-OE1 2.99Å; R27-E29 IonicContact NH2-OE1 3.2Å; R27-E29 PolarHBondContact NH2-OE1 3.21Å; E29-K33 WeakPolarHBondContact OE2-CE 3.48Å; E29-K33 IonicContact OE2-NZ 2.86Å; E29-K33 PolarHBondContact OE2-NZ 3.41Å; E29-Y35 HydrophobicContact CB-CD2 4.42Å; E29-Y35 HydrophobicContact CG-CD2 4.13Å; E29-Y35 HydrophobicContact CG-CE2 3.76Å
30	V	93.9	Very high	89.6	Confident	57 Å²	57	64.2 Å²	64.2	35%	0.345	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	142.4	-175.8	166.4	0	0	0	0	112.3	V28 K33 M50 P98	V28-V30 HydrophobicContact CG2-CG2 4.22Å; V30-K33 WeakPolarHBondContact O-CD 3.32Å; V30-K33 WeakPolarHBondContact O-CE 2.96Å; V30-K33 WeakPolarHBondContact O-CG 3.43Å; V30-K33 PolarHBondContact O-NZ 3.32Å; V30-K33 VanDerWaalsContact O-NZ 3.08Å; V30-M50 HydrophobicContact CB-CE 3.97Å; V30-M50 HydrophobicContact CG1-CE 3.24Å; V30-M50 HydrophobicContact CG2-CE 3.62Å; V30-P98 HydrophobicContact CG2-CB 4.24Å; V30-P98 HydrophobicContact CG2-CG 3.84Å
31	G	90.3	Very high	89.5	Confident	11 Å²	11	63.7 Å²	63.7	11%	0.113	34%	0.338	C	S	.	.	S	Bend	trans	-89.2	168.8	172.4	0	0	0	0	0	114.4	H14	H14-G31 PolarHBondContact O-N 2.71Å
32	P	91.3	Very high	89.5	Confident	92 Å²	92	64.9 Å²	64.9	60%	0.597	34%	0.338	S	S	*	.	S	Bend	cis	-83.7	116.2	10.8	30.3	-32.7	0	0	0	113.2	I10 P12	I10-P32 WeakPolarHBondContact O-CA 3.49Å; P12-P32 HydrophobicContact CG-CB 4.01Å
33	K	90.8	Very high	89.6	Confident	57 Å²	57	58.8 Å²	58.8	25%	0.248	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	149.7	173.7	68.8	-175.3	174.2	-154.9	0	111.9	I10 E29 V30	I10-K33 HydrophobicContact CB-CG 4.27Å; I10-K33 WeakPolarHBondContact CB-O 3.43Å; I10-K33 HydrophobicContact CD1-CD 4.3Å; I10-K33 HydrophobicContact CD1-CG 3.83Å; I10-K33 HydrophobicContact CG1-CG 4.4Å; I10-K33 PolarHBondContact N-O 3.29Å; I10-K33 PolarHBondContact O-N 3.27Å; I10-K33 VanDerWaalsContact O-N 3.1Å; E29-K33 WeakPolarHBondContact OE2-CE 3.48Å; E29-K33 IonicContact OE2-NZ 2.86Å; E29-K33 PolarHBondContact OE2-NZ 3.41Å; V30-K33 WeakPolarHBondContact O-CD 3.32Å; V30-K33 WeakPolarHBondContact O-CE 2.96Å; V30-K33 WeakPolarHBondContact O-CG 3.43Å; V30-K33 PolarHBondContact O-NZ 3.32Å; V30-K33 VanDerWaalsContact O-NZ 3.08Å
34	T	90.4	Very high	89.8	Confident	69 Å²	69	59.3 Å²	59.3	42%	0.423	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	104.5	164.4	-56.3	0	0	0	0	107	I7 R9	I7-T34 HydrophobicContact CG2-CG2 3.36Å; R9-T34 VanDerWaalsContact CD-OG1 3.27Å; R9-T34 WeakPolarHBondContact CD-OG1 3.46Å; R9-T34 PolarHBondContact NH1-OG1 2.97Å
35	Y	90.1	Very high	89.9	Confident	23 Å²	23	55.7 Å²	55.7	9%	0.09	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	128.7	179.3	-173.2	-98.5	0	0	0	109.8	I8 I16 V18 R27 E29 R37 E41	I8-Y35 PolarHBondContact N-O 3.26Å; I8-Y35 PolarHBondContact O-N 3.16Å; I16-Y35 HydrophobicContact CD1-CD1 4.11Å; I16-Y35 HydrophobicContact CD1-CG 4.3Å; V18-Y35 HydrophobicContact CG1-CE1 4.32Å; V18-Y35 HydrophobicContact CG2-CD1 4.45Å; V18-Y35 HydrophobicContact CG2-CE1 3.81Å; R27-Y35 PolarHBondContact NH2-OH 3.07Å; E29-Y35 HydrophobicContact CB-CD2 4.42Å; E29-Y35 HydrophobicContact CG-CD2 4.13Å; E29-Y35 HydrophobicContact CG-CE2 3.76Å; Y35-R37 HydrophobicContact CE1-CB 4.25Å; Y35-E41 PolarHBondContact OH-OE1 3.45Å; Y35-E41 PolarHBondContact OH-OE2 3.4Å
36	I	89.3	Confident	89.9	Confident	89 Å²	89	56.3 Å²	56.3	46%	0.456	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	115.4	175	-57.1	172.8	0	0	0	106.7	F6 Q38	F6-I36 HydrophobicContact CD1-CG2 4.31Å; F6-I36 HydrophobicContact CE1-CG2 3.88Å; F6-I36 HydrophobicContact CZ-CG2 4.46Å; I36-Q38 PolarHBondContact O-NE2 3.39Å
37	R	87.9	Confident	90	Very high	55 Å²	55	57.2 Å²	57.2	21%	0.208	29%	0.294	C	S	.	.			trans	-73.1	131.1	-176.2	-169.3	-171	79.5	-180	1.7	110	F6 Y35 E41 V43	F6-R37 PolarHBondContact O-N 2.84Å; F6-R37 VanDerWaalsContact O-N 3.17Å; Y35-R37 HydrophobicContact CE1-CB 4.25Å; R37-E41 WeakPolarHBondContact CD-O 3.37Å; R37-E41 HydrophobicContact CG-CB 3.8Å; R37-E41 WeakPolarHBondContact CG-O 3.22Å; R37-E41 PolarHBondContact NE-O 3.46Å; R37-V43 HydrophobicContact CG-CG2 4.33Å
38	Q	87.9	Confident	90.1	Very high	104 Å²	104	57.9 Å²	57.9	49%	0.486	30%	0.301	S	S	.	.			trans	-78.4	165.3	172.9	-53.8	-56.1	-53.5	0	0	111.3	I36 N40 E41	I36-Q38 PolarHBondContact O-NE2 3.39Å; Q38-N40 VanDerWaalsContact C-N 3.27Å; Q38-N40 PolarHBondContact O-N 3.12Å; Q38-E41 HydrophobicContact CB-CB 4.5Å; Q38-E41 HydrophobicContact CB-CG 4.01Å; Q38-E41 PolarHBondContact N-OE2 3.24Å; Q38-E41 PolarHBondContact O-N 2.81Å; Q38-E41 VanDerWaalsContact O-N 3.09Å
39	D	84	Confident	90.1	Very high	149 Å²	149	66.1 Å²	66.1	80%	0.797	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-34.2	-175.8	-67.5	-25.6	0	0	0	113.1	E41	D39-E41 VanDerWaalsContact C-N 3.31Å
40	N	88.6	Confident	90.2	Very high	47 Å²	47	65.5 Å²	65.5	25%	0.251	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	9.4	178.3	62.2	-54	0	0	0	113.8	D20 Q21 N22 Q38	D20-N40 PolarHBondContact OD1-ND2 3.42Å; Q21-N40 WeakPolarHBondContact CB-O 3.22Å; Q21-N40 PolarHBondContact N-O 2.94Å; N22-N40 VanDerWaalsContact ND2-CB 3.34Å; N22-N40 WeakPolarHBondContact ND2-CB 3.28Å; N22-N40 PolarHBondContact ND2-ND2 3.45Å; Q38-N40 VanDerWaalsContact C-N 3.27Å; Q38-N40 PolarHBondContact O-N 3.12Å
41	E	88.9	Confident	90.2	Very high	16 Å²	16	63.5 Å²	63.5	8%	0.075	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	142	-175.5	-68.6	178.9	158.9	0	0	112.5	V18 L19 R27 Y35 R37 Q38 D39	V18-E41 HydrophobicContact CG1-CB 3.76Å; V18-E41 HydrophobicContact CG1-CG 4.05Å; L19-E41 CarbonylContact O-C 3.51Å; L19-E41 WeakPolarHBondContact O-CA 3.45Å; R27-E41 IonicContact CZ-OE1 3.38Å; R27-E41 IonicContact NH1-OE1 2.51Å; R27-E41 PolarHBondContact NH1-OE1 3.32Å; R27-E41 IonicContact NH2-OE1 2.8Å; R27-E41 PolarHBondContact NH2-OE1 2.87Å; Y35-E41 PolarHBondContact OH-OE1 3.45Å; Y35-E41 PolarHBondContact OH-OE2 3.4Å; R37-E41 WeakPolarHBondContact CD-O 3.37Å; R37-E41 HydrophobicContact CG-CB 3.8Å; R37-E41 WeakPolarHBondContact CG-O 3.22Å; R37-E41 PolarHBondContact NE-O 3.46Å; Q38-E41 HydrophobicContact CB-CB 4.5Å; Q38-E41 HydrophobicContact CB-CG 4.01Å; Q38-E41 PolarHBondContact N-OE2 3.24Å; Q38-E41 PolarHBondContact O-N 2.81Å; Q38-E41 VanDerWaalsContact O-N 3.09Å; D39-E41 VanDerWaalsContact C-N 3.31Å
42	R	88.5	Confident	90.4	Very high	125 Å²	125	66.2 Å²	66.2	47%	0.472	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	124.7	174.3	-173.3	177.3	70.2	-178.8	2.3	110.3	L19	L19-R42 PolarHBondContact N-O 3.25Å; L19-R42 PolarHBondContact O-N 2.78Å
43	V	89.9	Confident	90.5	Very high	4 Å²	4	62.1 Å²	62.1	2%	0.024	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	126.9	172.6	-179.3	0	0	0	0	109.4	I8 I16 V18 R37 F45	I8-V43 HydrophobicContact CD1-CB 3.81Å; I8-V43 HydrophobicContact CD1-CG1 3.87Å; I8-V43 HydrophobicContact CD1-CG2 3.27Å; I16-V43 HydrophobicContact CB-CG1 4.17Å; I16-V43 HydrophobicContact CD1-CG1 4.05Å; I16-V43 HydrophobicContact CD1-CG2 4.25Å; I16-V43 HydrophobicContact CG2-CG1 4.48Å; V18-V43 HydrophobicContact CG2-CG2 4.14Å; R37-V43 HydrophobicContact CG-CG2 4.33Å; V43-F45 WeakPolarHBondContact CG1-O 3.5Å
44	L	89.4	Confident	90.6	Very high	69 Å²	69	61.8 Å²	61.8	36%	0.361	31%	0.306	S	S	.	.			trans	-78.2	-34.9	-174.1	-60.4	-176.2	0	0	0	112.5	H17 L19	H17-L44 HydrophobicContact CB-CB 4.17Å; H17-L44 HydrophobicContact CB-CD1 3.77Å; H17-L44 HydrophobicContact CB-CG 4.16Å; H17-L44 PolarHBondContact O-N 2.7Å; L19-L44 HydrophobicContact CB-CD2 3.93Å; L19-L44 HydrophobicContact CB-CG 4.37Å; L19-L44 HydrophobicContact CD2-CD2 4.36Å
45	F	90.3	Very high	90.8	Very high	44 Å²	44	63.4 Å²	63.4	19%	0.193	32%	0.318	C	S	.	.	S	Bend	trans	-153.6	156.7	178.6	49.4	-101.3	0	0	0	111.6	Y15 H17 V43 M48	Y15-F45 HydrophobicContact CD2-CE2 4.2Å; Y15-F45 HydrophobicContact CD2-CZ 4.22Å; Y15-F45 HydrophobicContact CE2-CE2 4.02Å; Y15-F45 AromaticContact CE2-CZ 3.8Å; Y15-F45 HydrophobicContact CE2-CZ 3.8Å; H17-F45 HydrophobicContact CB-CE1 3.69Å; H17-F45 HydrophobicContact CB-CZ 3.78Å; H17-F45 AromaticContact CD2-CZ 3.61Å; H17-F45 AromaticContact CE1-CE1 3.89Å; H17-F45 AromaticContact CE1-CZ 3.74Å; H17-F45 AromaticContact CG-CE1 3.47Å; H17-F45 VanDerWaalsContact CG-CE1 3.47Å; H17-F45 AromaticContact CG-CZ 3.34Å; H17-F45 AromaticContact ND1-CE1 3.28Å; H17-F45 VanDerWaalsContact ND1-CE1 3.28Å; H17-F45 WeakPolarHBondContact ND1-CE1 3.37Å; H17-F45 AromaticContact ND1-CZ 3.47Å; H17-F45 WeakPolarHBondContact ND1-CZ 3.36Å; H17-F45 AromaticContact NE2-CZ 3.84Å; V43-F45 WeakPolarHBondContact CG1-O 3.5Å; F45-M48 HydrophobicContact CD1-CE 4.03Å; F45-M48 HydrophobicContact CD2-CB 4.4Å; F45-M48 HydrophobicContact CD2-CE 3.53Å; F45-M48 HydrophobicContact CD2-CG 3.68Å; F45-M48 HydrophobicContact CD2-SD 4.13Å; F45-M48 HydrophobicContact CE1-CE 3.74Å; F45-M48 HydrophobicContact CE2-CB 4.22Å; F45-M48 HydrophobicContact CE2-CE 3.2Å; F45-M48 HydrophobicContact CE2-CG 3.94Å; F45-M48 HydrophobicContact CE2-SD 4.29Å; F45-M48 HydrophobicContact CG-CE 3.93Å; F45-M48 HydrophobicContact CG-CG 4.49Å; F45-M48 HydrophobicContact CZ-CE 3.32Å
46	A	89.3	Confident	90.8	Very high	25 Å²	25	72 Å²	72	21%	0.207	35%	0.35	C	S	.	.	S	Bend	trans	-65.2	156.2	174.6	0	0	0	0	0	111.6	M1 M48	M1-A46 HydrophobicContact CB-CB 3.73Å; M1-A46 HydrophobicContact CG-CB 4.46Å; M1-A46 HydrophobicContact SD-CB 4.29Å; A46-M48 PolarHBondContact O-N 3.25Å
47	P	92.4	Very high	91.1	Very high	41 Å²	41	70.4 Å²	70.4	27%	0.266	34%	0.34	S	S	.	.			trans	-46	112.2	-175.5	-29.8	35.1	0	0	0	114	I8 I10 H14 I16	I8-P47 HydrophobicContact CG2-CG 3.76Å; I10-P47 HydrophobicContact CG1-CG 4.39Å; I10-P47 HydrophobicContact CG2-CB 4.46Å; H14-P47 HydrophobicContact CB-CB 4.17Å; I16-P47 VanDerWaalsContact CG2-CA 3.49Å; I16-P47 HydrophobicContact CG2-CB 4.08Å; I16-P47 HydrophobicContact CG2-CG 3.74Å
48	M	92.6	Very high	91.5	Very high	81 Å²	81	68.8 Å²	68.8	40%	0.399	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	150.3	177.2	-71	-159	-65.8	0	0	110.7	H14 Y15 F45 A46	H14-M48 CarbonylContact C-O 3.54Å; H14-M48 WeakPolarHBondContact CA-O 3.33Å; H14-M48 VanDerWaalsContact CB-O 3.31Å; H14-M48 WeakPolarHBondContact CB-O 3.49Å; Y15-M48 HydrophobicContact CE1-CB 4.26Å; Y15-M48 HydrophobicContact CE2-CE 4.26Å; Y15-M48 PolarHBondContact N-O 3.06Å; Y15-M48 PolarHBondContact O-N 3.41Å; F45-M48 HydrophobicContact CD1-CE 4.03Å; F45-M48 HydrophobicContact CD2-CB 4.4Å; F45-M48 HydrophobicContact CD2-CE 3.53Å; F45-M48 HydrophobicContact CD2-CG 3.68Å; F45-M48 HydrophobicContact CD2-SD 4.13Å; F45-M48 HydrophobicContact CE1-CE 3.74Å; F45-M48 HydrophobicContact CE2-CB 4.22Å; F45-M48 HydrophobicContact CE2-CE 3.2Å; F45-M48 HydrophobicContact CE2-CG 3.94Å; F45-M48 HydrophobicContact CE2-SD 4.29Å; F45-M48 HydrophobicContact CG-CE 3.93Å; F45-M48 HydrophobicContact CG-CG 4.49Å; F45-M48 HydrophobicContact CZ-CE 3.32Å; A46-M48 PolarHBondContact O-N 3.25Å
49	R	93.5	Very high	91.8	Very high	199 Å²	199	63.8 Å²	63.8	75%	0.751	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.3	138.6	176.4	-65.8	-177.2	76.4	156.4	3.2	110.3	H14 Y15	H14-R49 WeakPolarHBondContact NE2-CG 3.35Å; Y15-R49 WeakPolarHBondContact CE1-O 3.24Å
50	M	94.6	Very high	92.3	Very high	19 Å²	19	57.4 Å²	57.4	9%	0.094	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-62	152.7	166.5	-72.7	-179	174.6	0	0	110.9	Y13 Y15 V30 T52 P96 F97 P98	Y13-M50 WeakPolarHBondContact O-CB 3.12Å; Y13-M50 WeakPolarHBondContact O-CG 3.2Å; Y13-M50 PolarHBondContact O-N 2.88Å; Y15-M50 HydrophobicContact CD1-CG 3.92Å; V30-M50 HydrophobicContact CB-CE 3.97Å; V30-M50 HydrophobicContact CG1-CE 3.24Å; V30-M50 HydrophobicContact CG2-CE 3.62Å; M50-T52 PolarHBondContact O-N 2.76Å; M50-P96 HydrophobicContact CB-CB 3.96Å; M50-P96 HydrophobicContact SD-CB 4.26Å; M50-P96 VanDerWaalsContact SD-O 3.41Å; M50-F97 WeakPolarHBondContact CA-O 3.39Å; M50-F97 WeakPolarHBondContact CB-O 3.24Å; M50-P98 HydrophobicContact CE-CB 4.16Å; M50-P98 HydrophobicContact CE-CG 4.22Å; M50-P98 HydrophobicContact CG-CB 4.33Å
51	V	94.2	Very high	92.6	Very high	14 Å²	14	55.2 Å²	55.2	9%	0.085	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	118.4	174.3	-177	0	0	0	0	107.8	V53 P96 F97 L99 L105	V51-V53 HydrophobicContact CG1-CG2 4.21Å; V51-P96 WeakPolarHBondContact O-CA 3.43Å; V51-F97 HydrophobicContact CB-CD2 4.2Å; V51-F97 HydrophobicContact CB-CE1 4.2Å; V51-F97 HydrophobicContact CB-CE2 3.66Å; V51-F97 HydrophobicContact CB-CZ 3.67Å; V51-F97 HydrophobicContact CG1-CE1 4.17Å; V51-F97 HydrophobicContact CG1-CE2 4.06Å; V51-F97 HydrophobicContact CG1-CZ 3.61Å; V51-F97 HydrophobicContact CG2-CE2 4.16Å; V51-F97 PolarHBondContact N-O 3.41Å; V51-F97 WeakPolarHBondContact O-CD1 3.49Å; V51-F97 PolarHBondContact O-N 3.01Å; V51-F97 VanDerWaalsContact O-N 3.08Å; V51-L99 HydrophobicContact CG2-CD1 4.41Å; V51-L99 HydrophobicContact CG2-CD2 4.17Å; V51-L99 HydrophobicContact CG2-CG 4.14Å; V51-L105 HydrophobicContact CG1-CD1 4.42Å; V51-L105 HydrophobicContact CG2-CD2 4.31Å
52	T	93.7	Very high	92.8	Very high	69 Å²	69	54.9 Å²	54.9	42%	0.423	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	110.8	175.9	-58.1	0	0	0	0	108.3	M50 P54 P96 I109	M50-T52 PolarHBondContact O-N 2.76Å; T52-P54 VanDerWaalsContact O-CD 3.3Å; T52-P54 WeakPolarHBondContact O-CD 3.48Å; T52-P96 HydrophobicContact CG2-CG 4.15Å; T52-I109 WeakPolarHBondContact O-CD1 3.38Å
53	V	94.3	Very high	93.1	Very high	5 Å²	5	50.9 Å²	50.9	3%	0.03	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	111.4	177.5	-177	0	0	0	0	108.9	V51 H57 C59 A93 F97	V51-V53 HydrophobicContact CG1-CG2 4.21Å; V53-H57 HydrophobicContact CG1-CB 4.2Å; V53-H57 VanDerWaalsContact CG1-O 3.28Å; V53-H57 WeakPolarHBondContact CG1-O 3.33Å; V53-C59 HydrophobicContact CG2-CB 4.31Å; V53-C59 VanDerWaalsContact CG2-SG 3.58Å; V53-A93 WeakPolarHBondContact O-CA 3.48Å; V53-F97 HydrophobicContact CG2-CE1 3.85Å; V53-F97 HydrophobicContact CG2-CZ 4.2Å
54	P	93.6	Very high	93.3	Very high	50 Å²	50	50.7 Å²	50.7	33%	0.325	25%	0.253	S	S	.	.			trans	-66.6	162.3	178.9	-19.3	33.2	0	0	0	112.4	T52 R56 H57 I109	T52-P54 VanDerWaalsContact O-CD 3.3Å; T52-P54 WeakPolarHBondContact O-CD 3.48Å; P54-R56 PolarHBondContact O-N 3.48Å; P54-H57 WeakPolarHBondContact O-CB 3.42Å; P54-H57 PolarHBondContact O-N 2.67Å; P54-H57 VanDerWaalsContact O-N 3.14Å; P54-I109 VanDerWaalsContact CD-CG2 3.5Å; P54-I109 HydrophobicContact CG-CG2 4.24Å
55	P	93	Very high	93.5	Very high	104 Å²	104	47.5 Å²	47.5	68%	0.675	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51	142.1	168.7	-26.1	35.2	0	0	0	111.9	H57	P55-H57 PolarHBondContact O-N 3.4Å; P55-H57 PolarHBondContact O-ND1 2.82Å
56	R	91.4	Very high	93.6	Very high	202 Å²	202	46.1 Å²	46.1	76%	0.762	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.5	19.8	-177.2	-52.8	179	179.4	162.7	-1	115	P54 L112	P54-R56 PolarHBondContact O-N 3.48Å; R56-L112 WeakPolarHBondContact O-CB 3.27Å; R56-L112 PolarHBondContact O-N 3.5Å
57	H	95	Very high	93.6	Very high	57 Å²	57	49.4 Å²	49.4	26%	0.264	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	165.2	171.6	-64.1	66	0	0	0	109.9	V53 P54 P55 I109 T110	V53-H57 HydrophobicContact CG1-CB 4.2Å; V53-H57 VanDerWaalsContact CG1-O 3.28Å; V53-H57 WeakPolarHBondContact CG1-O 3.33Å; P54-H57 WeakPolarHBondContact O-CB 3.42Å; P54-H57 PolarHBondContact O-N 2.67Å; P54-H57 VanDerWaalsContact O-N 3.14Å; P55-H57 PolarHBondContact O-N 3.4Å; P55-H57 PolarHBondContact O-ND1 2.82Å; H57-I109 HydrophobicContact CB-CG2 3.88Å; H57-T110 CarbonylContact C-O 3.5Å; H57-T110 WeakPolarHBondContact CA-O 3.31Å; H57-T110 WeakPolarHBondContact CB-O 3.48Å
58	Y	96.1	Very high	93.4	Very high	20 Å²	20	50 Å²	50	8%	0.078	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	162.2	171.7	74.8	-75.7	0	0	0	110	I90 R91 K107 T110 L112 P153	Y58-I90 HydrophobicContact CD2-CG2 3.85Å; Y58-I90 HydrophobicContact CG-CG2 4.33Å; Y58-R91 CarbonylContact C-O 3.45Å; Y58-R91 WeakPolarHBondContact CA-O 3.47Å; Y58-K107 HydrophobicContact CE2-CD 4.23Å; Y58-K107 PolarHBondContact OH-NZ 3.43Å; Y58-T110 VanDerWaalsContact CD1-O 3.24Å; Y58-T110 WeakPolarHBondContact CD1-O 3.32Å; Y58-T110 HydrophobicContact CE1-CG2 3.76Å; Y58-T110 PolarHBondContact N-O 3.35Å; Y58-T110 PolarHBondContact O-N 3.17Å; Y58-L112 HydrophobicContact CD1-CD2 3.66Å; Y58-L112 HydrophobicContact CD1-CG 4.35Å; Y58-L112 HydrophobicContact CE1-CD2 4.47Å; Y58-L112 HydrophobicContact CG-CD2 4.14Å; Y58-P153 HydrophobicContact CD1-CG 4.16Å; Y58-P153 HydrophobicContact CD2-CG 4.38Å; Y58-P153 HydrophobicContact CE1-CG 3.72Å; Y58-P153 HydrophobicContact CE2-CB 4.16Å; Y58-P153 HydrophobicContact CE2-CG 3.96Å; Y58-P153 HydrophobicContact CG-CG 4.46Å
59	C	94.2	Very high	93.2	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	161	163.9	68.7	0	0	0	0	109.2	V53 R91 L105 K107	V53-C59 HydrophobicContact CG2-CB 4.31Å; V53-C59 VanDerWaalsContact CG2-SG 3.58Å; C59-R91 PolarHBondContact N-O 2.89Å; C59-R91 PolarHBondContact O-N 3.23Å; C59-L105 HydrophobicContact CB-CD1 3.87Å; C59-K107 WeakPolarHBondContact CA-O 3.39Å; C59-K107 WeakPolarHBondContact CB-O 3.37Å
60	T	94.6	Very high	92.8	Very high	15 Å²	15	48.6 Å²	48.6	9%	0.092	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	125.9	176.2	-50.2	0	0	0	0	109.1	L88 E89 I90 E106 K107	T60-L88 HydrophobicContact CG2-CB 4.07Å; T60-L88 HydrophobicContact CG2-CD1 4.34Å; T60-L88 HydrophobicContact CG2-CD2 4.19Å; T60-L88 HydrophobicContact CG2-CG 4.43Å; T60-E89 WeakPolarHBondContact CA-O 3.29Å; T60-I90 HydrophobicContact CG2-CG1 4.44Å; T60-E106 HydrophobicContact CG2-CB 4.44Å; T60-E106 PolarHBondContact O-N 3.44Å; T60-K107 PolarHBondContact N-O 3.13Å; T60-K107 PolarHBondContact O-N 3.15Å; T60-K107 VanDerWaalsContact O-N 3.09Å
61	V	94.8	Very high	92.1	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	123.8	177.6	179.5	0	0	0	0	108.5	L88 E89 R91 F97 L99 E103 V104 L105	V61-L88 CarbonylContact O-C 3.5Å; V61-L88 WeakPolarHBondContact O-CA 3.26Å; V61-E89 PolarHBondContact N-O 3.08Å; V61-E89 PolarHBondContact O-N 3.32Å; V61-R91 HydrophobicContact CG2-CG 4.49Å; V61-F97 HydrophobicContact CG2-CE2 4.43Å; V61-L99 HydrophobicContact CG1-CD2 4.32Å; V61-L99 HydrophobicContact CG2-CD2 4.26Å; V61-E103 HydrophobicContact CG1-CB 3.95Å; V61-E103 HydrophobicContact CG1-CG 4.11Å; V61-V104 CarbonylContact C-O 3.54Å; V61-V104 WeakPolarHBondContact CA-O 3.28Å; V61-L105 HydrophobicContact CG2-CD1 4.23Å
62	A	94.4	Very high	91.7	Very high	10 Å²	10	54.6 Å²	54.6	8%	0.083	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	145	170.6	0	0	0	0	0	110.9	L88 E103 V104 E106	A62-L88 HydrophobicContact CB-CD2 3.81Å; A62-E103 WeakPolarHBondContact O-CA 3.37Å; A62-V104 HydrophobicContact CB-CB 4.48Å; A62-V104 PolarHBondContact N-O 2.89Å; A62-V104 PolarHBondContact O-N 2.9Å; A62-E106 HydrophobicContact CB-CB 4.05Å
63	N	94.1	Very high	91.6	Very high	41 Å²	41	52.6 Å²	52.6	22%	0.219	29%	0.288	C	S	.	.	S	Bend	trans	55.5	52.1	-175	-51.3	-55.6	0	0	0	113.5	L83 R84 A86 D87 E103	N63-L83 HydrophobicContact CB-CD1 4.18Å; N63-R84 WeakPolarHBondContact CA-O 3.47Å; N63-A86 PolarHBondContact OD1-N 3.44Å; N63-D87 PolarHBondContact N-O 3.28Å; N63-E103 WeakPolarHBondContact O-CG 3.48Å
64	P	94.6	Very high	91.4	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-63.4	149.1	-172.8	30.2	-38.3	0	0	0	112.3	R84 D87 E89 E103	P64-R84 HydrophobicContact CG-CB 4.19Å; P64-R84 PolarHBondContact O-N 3.49Å; P64-D87 WeakPolarHBondContact CD-O 3.16Å; P64-E89 HydrophobicContact CB-CB 3.44Å; P64-E89 VanDerWaalsContact CB-CB 3.44Å; P64-E89 HydrophobicContact CB-CG 4.29Å; P64-E89 HydrophobicContact CG-CB 3.67Å; P64-E103 WeakPolarHBondContact CA-OE1 3.2Å
65	V	93.4	Very high	91.2	Very high	1 Å²	1	58.9 Å²	58.9	1%	0.006	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-56.9	141.6	173.4	-67.1	0	0	0	0	112.2	R67 V73 V81 L83 Y100 E103	V65-R67 HydrophobicContact CG2-CG 4.34Å; V65-V73 HydrophobicContact CB-CG1 4.2Å; V65-V73 HydrophobicContact CG1-CG1 4.28Å; V65-V73 HydrophobicContact CG2-CG2 4.12Å; V65-V81 HydrophobicContact CB-CG1 4.19Å; V65-V81 HydrophobicContact CG1-CG1 3.44Å; V65-V81 VanDerWaalsContact CG1-CG1 3.44Å; V65-L83 HydrophobicContact CB-CD2 4.36Å; V65-L83 HydrophobicContact CG1-CD2 3.68Å; V65-Y100 HydrophobicContact CB-CD2 4.46Å; V65-Y100 HydrophobicContact CG1-CD1 4.38Å; V65-Y100 HydrophobicContact CG1-CD2 3.37Å; V65-Y100 HydrophobicContact CG1-CE2 4.15Å; V65-Y100 HydrophobicContact CG1-CG 3.5Å; V65-Y100 VanDerWaalsContact CG1-CG 3.5Å; V65-Y100 HydrophobicContact CG2-CD2 4.3Å; V65-Y100 HydrophobicContact CG2-CE2 4.46Å; V65-E103 HydrophobicContact CG1-CG 4.17Å; V65-E103 WeakPolarHBondContact CG1-OE1 3.41Å; V65-E103 PolarHBondContact N-OE1 3.29Å
66	S	91.5	Very high	90.9	Very high	16 Å²	16	58.1 Å²	58.1	11%	0.112	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-77.5	129.9	170.1	-56.2	0	0	0	0	108.8	L74 R82	S66-L74 PolarHBondContact O-N 3.07Å; S66-R82 WeakPolarHBondContact CB-O 3.45Å; S66-R82 PolarHBondContact N-O 3.1Å; S66-R82 PolarHBondContact OG-O 3.4Å
67	R	89.9	Confident	90.7	Very high	93 Å²	93	55.3 Å²	55.3	35%	0.351	31%	0.308	S	S	.	.	B	Isolated β-bridge	trans	-114.7	150.7	178.1	-63.1	-178.5	178.6	96.2	4.4	110.6	V65 L72 E89	V65-R67 HydrophobicContact CG2-CG 4.34Å; R67-L72 CarbonylContact C-O 3.54Å; R67-L72 WeakPolarHBondContact CA-O 3.48Å; R67-E89 IonicContact CZ-OE2 2.87Å; R67-E89 VanDerWaalsContact NH1-CD 3.31Å; R67-E89 IonicContact NH1-OE1 2.7Å; R67-E89 PolarHBondContact NH1-OE1 3.27Å; R67-E89 IonicContact NH1-OE2 2.8Å; R67-E89 PolarHBondContact NH1-OE2 2.7Å; R67-E89 IonicContact NH2-OE2 3.09Å
68	D	88.6	Confident	90.2	Very high	53 Å²	53	56.6 Å²	56.6	28%	0.283	32%	0.32	S	S	.	.			trans	-78.7	-179.3	170.1	67.9	11.3	0	0	0	112	Q70 G71 L72 L74	D68-Q70 PolarHBondContact O-N 3.4Å; D68-Q70 VanDerWaalsContact O-N 3.16Å; D68-Q70 VanDerWaalsContact OD1-C 3.29Å; D68-Q70 WeakPolarHBondContact OD1-CA 3.42Å; D68-Q70 WeakPolarHBondContact OD1-CB 2.98Å; D68-Q70 PolarHBondContact OD1-N 3.01Å; D68-G71 PolarHBondContact O-N 3.18Å; D68-G71 PolarHBondContact OD1-N 2.83Å; D68-L72 PolarHBondContact N-O 3.38Å; D68-L72 PolarHBondContact OD1-N 3Å; D68-L74 HydrophobicContact CB-CD2 4.02Å; D68-L74 HydrophobicContact CB-CG 4.44Å
69	A	87.3	Confident	89.6	Confident	104 Å²	104	57.2 Å²	57.2	86%	0.86	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-17.5	179.1	0	0	0	0	0	113.3
70	Q	85.4	Confident	89.3	Confident	148 Å²	148	59.3 Å²	59.3	69%	0.692	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-0.5	177.8	-64	80	3.8	0	0	112.3	D68 L72	D68-Q70 PolarHBondContact O-N 3.4Å; D68-Q70 VanDerWaalsContact O-N 3.16Å; D68-Q70 VanDerWaalsContact OD1-C 3.29Å; D68-Q70 WeakPolarHBondContact OD1-CA 3.42Å; D68-Q70 WeakPolarHBondContact OD1-CB 2.98Å; D68-Q70 PolarHBondContact OD1-N 3.01Å; Q70-L72 VanDerWaalsContact C-N 3.35Å
71	G	80.6	Confident	89.1	Confident	44 Å²	44	59 Å²	59	45%	0.454	34%	0.341	S	S	.	.	S	Bend	trans	80.9	9.6	179.6	0	0	0	0	0	114.6	D68	D68-G71 PolarHBondContact O-N 3.18Å; D68-G71 PolarHBondContact OD1-N 2.83Å
72	L	86	Confident	89	Confident	115 Å²	115	66.4 Å²	66.4	60%	0.602	37%	0.369	S	S	*	.	P	Polyproline II helix	trans	-83.2	147.2	176.5	-62.2	172.7	0	0	0	111	R67 D68 Q70	R67-L72 CarbonylContact C-O 3.54Å; R67-L72 WeakPolarHBondContact CA-O 3.48Å; D68-L72 PolarHBondContact N-O 3.38Å; D68-L72 PolarHBondContact OD1-N 3Å; Q70-L72 VanDerWaalsContact C-N 3.35Å
73	V	90.3	Very high	88.9	Confident	27 Å²	27	66.8 Å²	66.8	16%	0.164	37%	0.369	C	S	.	.	B	Isolated β-bridge	trans	-72.9	130.8	-178	177.2	0	0	0	0	110.6	V65 F75 V81 Y100	V65-V73 HydrophobicContact CB-CG1 4.2Å; V65-V73 HydrophobicContact CG1-CG1 4.28Å; V65-V73 HydrophobicContact CG2-CG2 4.12Å; V73-F75 HydrophobicContact CG1-CZ 4.49Å; V73-F75 WeakPolarHBondContact O-CD2 3.45Å; V73-F75 WeakPolarHBondContact O-CE2 3.28Å; V73-V81 HydrophobicContact CG1-CB 4.49Å; V73-V81 HydrophobicContact CG1-CG1 3.49Å; V73-V81 VanDerWaalsContact CG1-CG1 3.49Å; V73-V81 HydrophobicContact CG1-CG2 4.32Å; V73-Y100 HydrophobicContact CG1-CE1 4.3Å; V73-Y100 HydrophobicContact CG2-CE1 4.43Å; V73-Y100 HydrophobicContact CG2-CE2 3.99Å
74	L	90.8	Very high	88.8	Confident	66 Å²	66	69 Å²	69	35%	0.346	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-84.1	140.2	177.5	-67.8	173.8	0	0	0	111.3	S66 D68 R82	S66-L74 PolarHBondContact O-N 3.07Å; D68-L74 HydrophobicContact CB-CD2 4.02Å; D68-L74 HydrophobicContact CB-CG 4.44Å; L74-R82 HydrophobicContact CB-CB 4.37Å; L74-R82 PolarHBondContact O-N 3.29Å
75	F	89.3	Confident	88.5	Confident	121 Å²	121	76 Å²	76	53%	0.531	41%	0.407	S	S	.	.	B	Isolated β-bridge	trans	-114.6	147.8	174.7	-60.8	-92.3	0	0	0	110	V73 G79 Q80 V81	V73-F75 HydrophobicContact CG1-CZ 4.49Å; V73-F75 WeakPolarHBondContact O-CD2 3.45Å; V73-F75 WeakPolarHBondContact O-CE2 3.28Å; F75-G79 WeakPolarHBondContact CD1-O 3.28Å; F75-Q80 CarbonylContact C-O 3.59Å; F75-Q80 VanDerWaalsContact CA-O 3.3Å; F75-Q80 WeakPolarHBondContact CA-O 3.39Å; F75-V81 HydrophobicContact CD1-CG2 3.74Å; F75-V81 HydrophobicContact CE1-CG2 3.38Å; F75-V81 HydrophobicContact CZ-CG2 4.23Å
76	D	86.9	Confident	88.3	Confident	87 Å²	87	80.8 Å²	80.8	47%	0.465	45%	0.447	S	S	.	.			trans	-78.3	173.7	173	-164.5	15	0	0	0	111.2	T78 G79 Q80	D76-T78 PolarHBondContact O-N 3.48Å; D76-G79 PolarHBondContact O-N 3.17Å; D76-Q80 PolarHBondContact N-O 3.08Å
77	V	87.3	Confident	88.3	Confident	144 Å²	144	81.9 Å²	81.9	87%	0.873	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-23	-179.1	-62.8	0	0	0	0	113.9
78	T	84.9	Confident	88.4	Confident	83 Å²	83	80.4 Å²	80.4	51%	0.509	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-10.9	176.3	56.5	0	0	0	0	113.2	V25 D76 Q80	V25-T78 WeakPolarHBondContact CG2-O 3.49Å; D76-T78 PolarHBondContact O-N 3.48Å; T78-Q80 PolarHBondContact OG1-N 3.46Å
79	G	81.8	Confident	88.6	Confident	34 Å²	34	79.5 Å²	79.5	35%	0.351	44%	0.444	S	S	.	.	S	Bend	trans	87	5.9	-171.3	0	0	0	0	0	114.2	F75 D76	F75-G79 WeakPolarHBondContact CD1-O 3.28Å; D76-G79 PolarHBondContact O-N 3.17Å
80	Q	88.6	Confident	88.9	Confident	44 Å²	44	76.4 Å²	76.4	21%	0.206	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-74.2	142.5	171.2	-172.5	61.4	40.7	0	0	110.7	V25 S26 F75 D76 T78 R82	V25-Q80 HydrophobicContact CG1-CB 4.46Å; S26-Q80 PolarHBondContact O-NE2 3.02Å; S26-Q80 PolarHBondContact O-OE1 2.82Å; S26-Q80 VanDerWaalsContact O-OE1 3.1Å; F75-Q80 CarbonylContact C-O 3.59Å; F75-Q80 VanDerWaalsContact CA-O 3.3Å; F75-Q80 WeakPolarHBondContact CA-O 3.39Å; D76-Q80 PolarHBondContact N-O 3.08Å; T78-Q80 PolarHBondContact OG1-N 3.46Å; Q80-R82 PolarHBondContact O-N 2.88Å
81	V	91	Very high	89.3	Confident	9 Å²	9	69.7 Å²	69.7	6%	0.055	38%	0.381	C	S	.	.	B	Isolated β-bridge	trans	-66.6	131.5	176.2	176.8	0	0	0	0	110.5	V65 V73 F75 L83 Y100	V65-V81 HydrophobicContact CB-CG1 4.19Å; V65-V81 HydrophobicContact CG1-CG1 3.44Å; V65-V81 VanDerWaalsContact CG1-CG1 3.44Å; V73-V81 HydrophobicContact CG1-CB 4.49Å; V73-V81 HydrophobicContact CG1-CG1 3.49Å; V73-V81 VanDerWaalsContact CG1-CG1 3.49Å; V73-V81 HydrophobicContact CG1-CG2 4.32Å; F75-V81 HydrophobicContact CD1-CG2 3.74Å; F75-V81 HydrophobicContact CE1-CG2 3.38Å; F75-V81 HydrophobicContact CZ-CG2 4.23Å; V81-L83 HydrophobicContact CG1-CD2 4.14Å; V81-Y100 HydrophobicContact CB-CD1 4.42Å; V81-Y100 HydrophobicContact CG1-CD1 4.14Å; V81-Y100 HydrophobicContact CG1-CG 4.26Å; V81-Y100 HydrophobicContact CG2-CD1 3.73Å; V81-Y100 HydrophobicContact CG2-CE1 4.24Å
82	R	91.9	Very high	89.9	Confident	155 Å²	155	70.9 Å²	70.9	59%	0.585	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-83.9	123.3	-179.6	-168	175.8	-176.7	175.7	1.2	110.5	S66 L74 Q80	S66-R82 WeakPolarHBondContact CB-O 3.45Å; S66-R82 PolarHBondContact N-O 3.1Å; S66-R82 PolarHBondContact OG-O 3.4Å; L74-R82 HydrophobicContact CB-CB 4.37Å; L74-R82 PolarHBondContact O-N 3.29Å; Q80-R82 PolarHBondContact O-N 2.88Å
83	L	92.6	Very high	90.3	Very high	17 Å²	17	68 Å²	68	9%	0.089	37%	0.369	C	S	.	.	B	Isolated β-bridge	trans	-105	152.7	178.5	-53.4	-177.2	0	0	0	111.6	N63 V65 V81 H85 E103	N63-L83 HydrophobicContact CB-CD1 4.18Å; V65-L83 HydrophobicContact CB-CD2 4.36Å; V65-L83 HydrophobicContact CG1-CD2 3.68Å; V81-L83 HydrophobicContact CG1-CD2 4.14Å; L83-H85 PolarHBondContact O-N 3.12Å; L83-E103 HydrophobicContact CD2-CG 4.1Å
84	R	91.6	Very high	90.4	Very high	87 Å²	87	70.9 Å²	70.9	33%	0.328	38%	0.381	S	S	.	.			trans	-85.1	87.4	162.9	-66.4	-175.3	-75.2	157.2	-12.9	108.2	N63 P64 D87 E89	N63-R84 WeakPolarHBondContact CA-O 3.47Å; P64-R84 HydrophobicContact CG-CB 4.19Å; P64-R84 PolarHBondContact O-N 3.49Å; R84-D87 HydrophobicContact CB-CB 3.83Å; R84-D87 IonicContact CZ-OD2 2.97Å; R84-D87 IonicContact NE-OD2 3.89Å; R84-D87 IonicContact NH1-OD2 3.9Å; R84-D87 PolarHBondContact NH1-OD2 3.23Å; R84-D87 WeakPolarHBondContact O-CB 3.46Å; R84-D87 PolarHBondContact O-N 3.06Å; R84-E89 IonicContact NH2-OE1 3.63Å; R84-E89 PolarHBondContact NH2-OE1 3.12Å; R84-E89 VanDerWaalsContact NH2-OE1 3.09Å
85	H	89.4	Confident	90.3	Very high	147 Å²	147	74.5 Å²	74.5	68%	0.681	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	140.4	-177.6	-67.1	-70.6	0	0	0	112.1	L83 D87	L83-H85 PolarHBondContact O-N 3.12Å; H85-D87 PolarHBondContact O-N 3.04Å
86	A	88.6	Confident	90.6	Very high	102 Å²	102	70.5 Å²	70.5	84%	0.843	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	19.3	-177	0	0	0	0	0	114.7	N63	N63-A86 PolarHBondContact OD1-N 3.44Å
87	D	91.5	Very high	90.9	Very high	39 Å²	39	67.3 Å²	67.3	21%	0.209	37%	0.368	C	S	.	.			trans	-107	160	173.9	-162.3	11.1	0	0	0	110.9	N63 P64 R84 H85 K155	N63-D87 PolarHBondContact N-O 3.28Å; P64-D87 WeakPolarHBondContact CD-O 3.16Å; R84-D87 HydrophobicContact CB-CB 3.83Å; R84-D87 IonicContact CZ-OD2 2.97Å; R84-D87 IonicContact NE-OD2 3.89Å; R84-D87 IonicContact NH1-OD2 3.9Å; R84-D87 PolarHBondContact NH1-OD2 3.23Å; R84-D87 WeakPolarHBondContact O-CB 3.46Å; R84-D87 PolarHBondContact O-N 3.06Å; H85-D87 PolarHBondContact O-N 3.04Å; D87-K155 IonicContact OD1-NZ 2.86Å; D87-K155 PolarHBondContact OD1-NZ 3.15Å; D87-K155 IonicContact OD2-NZ 3.29Å; D87-K155 PolarHBondContact OD2-NZ 3.27Å
88	L	92.1	Very high	91.2	Very high	62 Å²	62	61.1 Å²	61.1	33%	0.325	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	148.5	174.4	-61.2	177.8	0	0	0	110	T60 V61 A62 E106 K155	T60-L88 HydrophobicContact CG2-CB 4.07Å; T60-L88 HydrophobicContact CG2-CD1 4.34Å; T60-L88 HydrophobicContact CG2-CD2 4.19Å; T60-L88 HydrophobicContact CG2-CG 4.43Å; V61-L88 CarbonylContact O-C 3.5Å; V61-L88 WeakPolarHBondContact O-CA 3.26Å; A62-L88 HydrophobicContact CB-CD2 3.81Å; L88-E106 HydrophobicContact CD2-CG 4.33Å; L88-K155 HydrophobicContact CB-CB 3.98Å; L88-K155 HydrophobicContact CB-CD 4.22Å; L88-K155 WeakPolarHBondContact O-CD 3.42Å; L88-K155 PolarHBondContact O-NZ 3.07Å
89	E	92.8	Very high	91.7	Very high	34 Å²	34	58.1 Å²	58.1	16%	0.159	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	127.1	170.3	-178.2	173.7	-114	0	0	109.9	T60 V61 P64 R67 R84 R91	T60-E89 WeakPolarHBondContact CA-O 3.29Å; V61-E89 PolarHBondContact N-O 3.08Å; V61-E89 PolarHBondContact O-N 3.32Å; P64-E89 HydrophobicContact CB-CB 3.44Å; P64-E89 VanDerWaalsContact CB-CB 3.44Å; P64-E89 HydrophobicContact CB-CG 4.29Å; P64-E89 HydrophobicContact CG-CB 3.67Å; R67-E89 IonicContact CZ-OE2 2.87Å; R67-E89 VanDerWaalsContact NH1-CD 3.31Å; R67-E89 IonicContact NH1-OE1 2.7Å; R67-E89 PolarHBondContact NH1-OE1 3.27Å; R67-E89 IonicContact NH1-OE2 2.8Å; R67-E89 PolarHBondContact NH1-OE2 2.7Å; R67-E89 IonicContact NH2-OE2 3.09Å; R84-E89 IonicContact NH2-OE1 3.63Å; R84-E89 PolarHBondContact NH2-OE1 3.12Å; R84-E89 VanDerWaalsContact NH2-OE1 3.09Å; E89-R91 HydrophobicContact CG-CG 4.17Å; E89-R91 IonicContact OE2-CZ 2.9Å; E89-R91 VanDerWaalsContact OE2-CZ 3.29Å; E89-R91 IonicContact OE2-NE 3.69Å; E89-R91 PolarHBondContact OE2-NE 3.02Å; E89-R91 IonicContact OE2-NH2 3.88Å; E89-R91 PolarHBondContact OE2-NH2 2.67Å
90	I	93.7	Very high	92.2	Very high	40 Å²	40	58.7 Å²	58.7	21%	0.205	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	115.9	175.2	-66.6	166.4	0	0	0	107.4	Y58 T60 L92 P153 R154 K155	Y58-I90 HydrophobicContact CD2-CG2 3.85Å; Y58-I90 HydrophobicContact CG-CG2 4.33Å; T60-I90 HydrophobicContact CG2-CG1 4.44Å; I90-L92 HydrophobicContact CG2-CD2 4.47Å; I90-P153 VanDerWaalsContact CD1-C 3.41Å; I90-P153 HydrophobicContact CD1-CB 4.09Å; I90-P153 WeakPolarHBondContact CD1-O 3.23Å; I90-R154 VanDerWaalsContact CD1-CA 3.48Å; I90-K155 HydrophobicContact CD1-CB 4.46Å
91	R	93.4	Very high	92.4	Very high	7 Å²	7	57.2 Å²	57.2	3%	0.026	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	121.7	179.4	-67.3	-178.5	177.3	171.2	8.4	109.3	Y58 C59 V61 E89 F97 E103	Y58-R91 CarbonylContact C-O 3.45Å; Y58-R91 WeakPolarHBondContact CA-O 3.47Å; C59-R91 PolarHBondContact N-O 2.89Å; C59-R91 PolarHBondContact O-N 3.23Å; V61-R91 HydrophobicContact CG2-CG 4.49Å; E89-R91 HydrophobicContact CG-CG 4.17Å; E89-R91 IonicContact OE2-CZ 2.9Å; E89-R91 VanDerWaalsContact OE2-CZ 3.29Å; E89-R91 IonicContact OE2-NE 3.69Å; E89-R91 PolarHBondContact OE2-NE 3.02Å; E89-R91 IonicContact OE2-NH2 3.88Å; E89-R91 PolarHBondContact OE2-NH2 2.67Å; R91-F97 HydrophobicContact CB-CE1 4.4Å; R91-F97 HydrophobicContact CB-CZ 4.2Å; R91-F97 HydrophobicContact CG-CZ 4.4Å; R91-E103 IonicContact CZ-OE1 2.68Å; R91-E103 IonicContact NH1-OE1 3.53Å; R91-E103 IonicContact NH1-OE2 3.48Å; R91-E103 IonicContact NH2-OE1 3.39Å; R91-E103 PolarHBondContact NH2-OE1 3.16Å; R91-E103 IonicContact NH2-OE2 3.79Å
92	L	94.4	Very high	92.4	Very high	69 Å²	69	58.9 Å²	58.9	36%	0.361	32%	0.318	S	S	.	.			trans	-84.8	-172.3	175	-58.5	179.9	0	0	0	110.5	I90 Q94 L112 I152	I90-L92 HydrophobicContact CG2-CD2 4.47Å; L92-Q94 PolarHBondContact O-N 3.24Å; L92-L112 HydrophobicContact CD2-CD1 4.47Å; L92-L112 HydrophobicContact CD2-CD2 4.07Å; L92-I152 HydrophobicContact CD1-CG2 4.42Å; L92-I152 HydrophobicContact CD2-CG2 4.23Å
93	A	93.1	Very high	92.5	Very high	53 Å²	53	52.1 Å²	52.1	44%	0.438	29%	0.292	S	S	.	.	S	Bend	trans	-57.8	119.3	176.2	0	0	0	0	0	111.6	V53	V53-A93 WeakPolarHBondContact O-CA 3.48Å
94	Q	92	Very high	92.5	Very high	89 Å²	89	55 Å²	55	42%	0.416	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	173.8	179.7	64.3	-176.6	0.1	0	0	109.8	L92 F97	L92-Q94 PolarHBondContact O-N 3.24Å; Q94-F97 HydrophobicContact CG-CD1 3.85Å; Q94-F97 HydrophobicContact CG-CE1 4.01Å
95	D	90.5	Very high	92.5	Very high	142 Å²	142	53.2 Å²	53.2	76%	0.759	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.7	146.9	176.1	-69.8	-26.8	0	0	0	111.4	F97	D95-F97 PolarHBondContact O-N 2.92Å
96	P	94.2	Very high	92.7	Very high	36 Å²	36	52.3 Å²	52.3	23%	0.234	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.1	125.8	179.7	-25.2	33.2	0	0	0	111.5	Y13 M50 V51 T52	Y13-P96 HydrophobicContact CD1-CB 3.82Å; Y13-P96 HydrophobicContact CD1-CG 3.8Å; Y13-P96 HydrophobicContact CE1-CB 4.45Å; Y13-P96 HydrophobicContact CE1-CG 4.01Å; M50-P96 HydrophobicContact CB-CB 3.96Å; M50-P96 HydrophobicContact SD-CB 4.26Å; M50-P96 VanDerWaalsContact SD-O 3.41Å; V51-P96 WeakPolarHBondContact O-CA 3.43Å; T52-P96 HydrophobicContact CG2-CG 4.15Å
97	F	94	Very high	92.8	Very high	20 Å²	20	51.8 Å²	51.8	9%	0.088	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	144.7	-175.4	58.8	-90.8	0	0	0	111.4	M50 V51 V53 V61 R91 Q94 D95 L99	M50-F97 WeakPolarHBondContact CA-O 3.39Å; M50-F97 WeakPolarHBondContact CB-O 3.24Å; V51-F97 HydrophobicContact CB-CD2 4.2Å; V51-F97 HydrophobicContact CB-CE1 4.2Å; V51-F97 HydrophobicContact CB-CE2 3.66Å; V51-F97 HydrophobicContact CB-CZ 3.67Å; V51-F97 HydrophobicContact CG1-CE1 4.17Å; V51-F97 HydrophobicContact CG1-CE2 4.06Å; V51-F97 HydrophobicContact CG1-CZ 3.61Å; V51-F97 HydrophobicContact CG2-CE2 4.16Å; V51-F97 PolarHBondContact N-O 3.41Å; V51-F97 WeakPolarHBondContact O-CD1 3.49Å; V51-F97 PolarHBondContact O-N 3.01Å; V51-F97 VanDerWaalsContact O-N 3.08Å; V53-F97 HydrophobicContact CG2-CE1 3.85Å; V53-F97 HydrophobicContact CG2-CZ 4.2Å; V61-F97 HydrophobicContact CG2-CE2 4.43Å; R91-F97 HydrophobicContact CB-CE1 4.4Å; R91-F97 HydrophobicContact CB-CZ 4.2Å; R91-F97 HydrophobicContact CG-CZ 4.4Å; Q94-F97 HydrophobicContact CG-CD1 3.85Å; Q94-F97 HydrophobicContact CG-CE1 4.01Å; D95-F97 PolarHBondContact O-N 2.92Å; F97-L99 HydrophobicContact CE2-CD2 4.19Å
98	P	93.9	Very high	92.9	Very high	15 Å²	15	54.9 Å²	54.9	10%	0.097	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-77	157.3	169.8	35.3	-35.7	0	0	0	110.4	Y15 V28 V30 M50	Y15-P98 HydrophobicContact CD1-CB 3.59Å; Y15-P98 HydrophobicContact CD2-CB 3.89Å; Y15-P98 HydrophobicContact CE1-CB 4.14Å; Y15-P98 HydrophobicContact CE2-CB 4.4Å; Y15-P98 HydrophobicContact CG-CB 3.46Å; Y15-P98 VanDerWaalsContact CG-CB 3.46Å; V28-P98 HydrophobicContact CG2-CB 3.87Å; V28-P98 HydrophobicContact CG2-CG 4.18Å; V30-P98 HydrophobicContact CG2-CB 4.24Å; V30-P98 HydrophobicContact CG2-CG 3.84Å; M50-P98 HydrophobicContact CE-CB 4.16Å; M50-P98 HydrophobicContact CE-CG 4.22Å; M50-P98 HydrophobicContact CG-CB 4.33Å
99	L	94	Very high	93	Very high	19 Å²	19	55.2 Å²	55.2	10%	0.099	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-85.1	132.7	163.3	-59.2	174.7	0	0	0	108.1	Y15 H17 V51 V61 F97 E103 L105	Y15-L99 HydrophobicContact CE2-CB 4.42Å; Y15-L99 VanDerWaalsContact CE2-O 3.26Å; Y15-L99 WeakPolarHBondContact CE2-O 3.36Å; Y15-L99 WeakPolarHBondContact OH-CB 3.05Å; H17-L99 PolarHBondContact CE1-O 3.31Å; H17-L99 PolarHBondContact NE2-O 3.12Å; V51-L99 HydrophobicContact CG2-CD1 4.41Å; V51-L99 HydrophobicContact CG2-CD2 4.17Å; V51-L99 HydrophobicContact CG2-CG 4.14Å; V61-L99 HydrophobicContact CG1-CD2 4.32Å; V61-L99 HydrophobicContact CG2-CD2 4.26Å; F97-L99 HydrophobicContact CE2-CD2 4.19Å; L99-E103 WeakPolarHBondContact CA-OE2 3.22Å; L99-E103 HydrophobicContact CB-CB 4.19Å; L99-E103 HydrophobicContact CD2-CB 4.41Å; L99-L105 HydrophobicContact CD1-CB 4.03Å
100	Y	93.8	Very high	93	Very high	47 Å²	47	55.3 Å²	55.3	18%	0.184	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-78.2	160.4	175.5	-73.6	-90.8	0	0	0	111.4	V28 V65 V73 V81 G102 E103	V28-Y100 HydrophobicContact CB-CD1 4.15Å; V28-Y100 HydrophobicContact CB-CE1 4.4Å; V28-Y100 HydrophobicContact CG1-CD1 3.53Å; V28-Y100 HydrophobicContact CG1-CE1 3.32Å; V65-Y100 HydrophobicContact CB-CD2 4.46Å; V65-Y100 HydrophobicContact CG1-CD1 4.38Å; V65-Y100 HydrophobicContact CG1-CD2 3.37Å; V65-Y100 HydrophobicContact CG1-CE2 4.15Å; V65-Y100 HydrophobicContact CG1-CG 3.5Å; V65-Y100 VanDerWaalsContact CG1-CG 3.5Å; V65-Y100 HydrophobicContact CG2-CD2 4.3Å; V65-Y100 HydrophobicContact CG2-CE2 4.46Å; V73-Y100 HydrophobicContact CG1-CE1 4.3Å; V73-Y100 HydrophobicContact CG2-CE1 4.43Å; V73-Y100 HydrophobicContact CG2-CE2 3.99Å; V81-Y100 HydrophobicContact CB-CD1 4.42Å; V81-Y100 HydrophobicContact CG1-CD1 4.14Å; V81-Y100 HydrophobicContact CG1-CG 4.26Å; V81-Y100 HydrophobicContact CG2-CD1 3.73Å; V81-Y100 HydrophobicContact CG2-CE1 4.24Å; Y100-G102 PolarHBondContact O-N 3.4Å; Y100-E103 PolarHBondContact N-OE2 2.73Å; Y100-E103 WeakPolarHBondContact O-CB 3.26Å; Y100-E103 PolarHBondContact O-N 3.37Å
101	P	92.1	Very high	93	Very high	12 Å²	12	57.2 Å²	57.2	8%	0.078	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	115.4	177	-26.9	36.2	0	0	0	111.7	H17 S26	H17-P101 HydrophobicContact CB-CG 4.42Å; H17-P101 VanDerWaalsContact CE1-CA 3.47Å; H17-P101 WeakPolarHBondContact CE1-CA 3.17Å; S26-P101 WeakPolarHBondContact O-CG 3.46Å
102	G	90	Very high	93	Very high	45 Å²	45	58.2 Å²	58.2	46%	0.464	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.6	-14.3	-177.8	0	0	0	0	0	115.3	Y100	Y100-G102 PolarHBondContact O-N 3.4Å
103	E	94.4	Very high	93	Very high	12 Å²	12	58 Å²	58	6%	0.056	32%	0.321	C	S	.	.			trans	-70.6	138.6	165	-72.5	-169.6	140.5	0	0	109.9	V61 A62 N63 P64 V65 L83 R91 L99 Y100	V61-E103 HydrophobicContact CG1-CB 3.95Å; V61-E103 HydrophobicContact CG1-CG 4.11Å; A62-E103 WeakPolarHBondContact O-CA 3.37Å; N63-E103 WeakPolarHBondContact O-CG 3.48Å; P64-E103 WeakPolarHBondContact CA-OE1 3.2Å; V65-E103 HydrophobicContact CG1-CG 4.17Å; V65-E103 WeakPolarHBondContact CG1-OE1 3.41Å; V65-E103 PolarHBondContact N-OE1 3.29Å; L83-E103 HydrophobicContact CD2-CG 4.1Å; R91-E103 IonicContact CZ-OE1 2.68Å; R91-E103 IonicContact NH1-OE1 3.53Å; R91-E103 IonicContact NH1-OE2 3.48Å; R91-E103 IonicContact NH2-OE1 3.39Å; R91-E103 PolarHBondContact NH2-OE1 3.16Å; R91-E103 IonicContact NH2-OE2 3.79Å; L99-E103 WeakPolarHBondContact CA-OE2 3.22Å; L99-E103 HydrophobicContact CB-CB 4.19Å; L99-E103 HydrophobicContact CD2-CB 4.41Å; Y100-E103 PolarHBondContact N-OE2 2.73Å; Y100-E103 WeakPolarHBondContact O-CB 3.26Å; Y100-E103 PolarHBondContact O-N 3.37Å
104	V	92.8	Very high	93	Very high	77 Å²	77	60 Å²	60	47%	0.467	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	136.6	175.8	-178	0	0	0	0	108.7	V61 A62 E106	V61-V104 CarbonylContact C-O 3.54Å; V61-V104 WeakPolarHBondContact CA-O 3.28Å; A62-V104 HydrophobicContact CB-CB 4.48Å; A62-V104 PolarHBondContact N-O 2.89Å; A62-V104 PolarHBondContact O-N 2.9Å; V104-E106 PolarHBondContact O-N 3.35Å; V104-E106 VanDerWaalsContact O-N 3.12Å
105	L	92.8	Very high	93.1	Very high	50 Å²	50	56 Å²	56	26%	0.262	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	97.4	171.6	-171.2	66.1	0	0	0	108.5	V51 C59 V61 L99	V51-L105 HydrophobicContact CG1-CD1 4.42Å; V51-L105 HydrophobicContact CG2-CD2 4.31Å; C59-L105 HydrophobicContact CB-CD1 3.87Å; V61-L105 HydrophobicContact CG2-CD1 4.23Å; L99-L105 HydrophobicContact CD1-CB 4.03Å
106	E	92.3	Very high	93.3	Very high	128 Å²	128	54.3 Å²	54.3	60%	0.598	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.7	-47.8	-177.3	-173.7	66.4	-163.5	0	0	111.1	T60 A62 L88 V104	T60-E106 HydrophobicContact CG2-CB 4.44Å; T60-E106 PolarHBondContact O-N 3.44Å; A62-E106 HydrophobicContact CB-CB 4.05Å; L88-E106 HydrophobicContact CD2-CG 4.33Å; V104-E106 PolarHBondContact O-N 3.35Å; V104-E106 VanDerWaalsContact O-N 3.12Å
107	K	91.2	Very high	93.2	Very high	91 Å²	91	56.3 Å²	56.3	40%	0.396	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	121.8	176.6	-165.5	174.9	-175.2	174	0	109.2	Y58 C59 T60 T110	Y58-K107 HydrophobicContact CE2-CD 4.23Å; Y58-K107 PolarHBondContact OH-NZ 3.43Å; C59-K107 WeakPolarHBondContact CA-O 3.39Å; C59-K107 WeakPolarHBondContact CB-O 3.37Å; T60-K107 PolarHBondContact N-O 3.13Å; T60-K107 PolarHBondContact O-N 3.15Å; T60-K107 VanDerWaalsContact O-N 3.09Å; K107-T110 WeakPolarHBondContact CE-OG1 3.32Å
108	D	93.4	Very high	93.2	Very high	104 Å²	104	60 Å²	60	56%	0.556	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.7	173.6	177.3	-156	-1.3	0	0	0	111.4	T110	D108-T110 PolarHBondContact O-N 3.46Å; D108-T110 PolarHBondContact O-OG1 3.12Å
109	I	93.7	Very high	93.2	Very high	70 Å²	70	60.3 Å²	60.3	36%	0.359	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.2	112	-175.9	-59.4	161.4	0	0	0	110.3	T52 P54 H57	T52-I109 WeakPolarHBondContact O-CD1 3.38Å; P54-I109 VanDerWaalsContact CD-CG2 3.5Å; P54-I109 HydrophobicContact CG-CG2 4.24Å; H57-I109 HydrophobicContact CB-CG2 3.88Å
110	T	93.1	Very high	93.3	Very high	36 Å²	36	59.4 Å²	59.4	22%	0.221	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	136.2	-176.3	-56.2	0	0	0	0	109.3	H57 Y58 K107 D108	H57-T110 CarbonylContact C-O 3.5Å; H57-T110 WeakPolarHBondContact CA-O 3.31Å; H57-T110 WeakPolarHBondContact CB-O 3.48Å; Y58-T110 VanDerWaalsContact CD1-O 3.24Å; Y58-T110 WeakPolarHBondContact CD1-O 3.32Å; Y58-T110 HydrophobicContact CE1-CG2 3.76Å; Y58-T110 PolarHBondContact N-O 3.35Å; Y58-T110 PolarHBondContact O-N 3.17Å; K107-T110 WeakPolarHBondContact CE-OG1 3.32Å; D108-T110 PolarHBondContact O-N 3.46Å; D108-T110 PolarHBondContact O-OG1 3.12Å
111	P	94.3	Very high	93.4	Very high	79 Å²	79	57.2 Å²	57.2	51%	0.513	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	143.5	174.3	26.7	-34.2	0	0	0	111.2
112	L	93.8	Very high	93.5	Very high	28 Å²	28	57 Å²	57	15%	0.147	32%	0.319	C	S	.	.			trans	-65.3	141.1	170.8	-69.1	173.5	0	0	0	109.7	R56 Y58 L92 V114 T150 P153	R56-L112 WeakPolarHBondContact O-CB 3.27Å; R56-L112 PolarHBondContact O-N 3.5Å; Y58-L112 HydrophobicContact CD1-CD2 3.66Å; Y58-L112 HydrophobicContact CD1-CG 4.35Å; Y58-L112 HydrophobicContact CE1-CD2 4.47Å; Y58-L112 HydrophobicContact CG-CD2 4.14Å; L92-L112 HydrophobicContact CD2-CD1 4.47Å; L92-L112 HydrophobicContact CD2-CD2 4.07Å; L112-V114 PolarHBondContact O-N 3.22Å; L112-T150 HydrophobicContact CB-CG2 3.45Å; L112-T150 VanDerWaalsContact CB-CG2 3.45Å; L112-T150 HydrophobicContact CD1-CG2 3.91Å; L112-T150 HydrophobicContact CG-CG2 4.29Å; L112-P153 HydrophobicContact CD2-CG 4.44Å
113	Q	93.1	Very high	93.8	Very high	66 Å²	66	55.1 Å²	55.1	31%	0.308	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	115.5	-176.5	-173.1	164.9	-2.3	0	0	110.3	L121 Y151	Q113-L121 HydrophobicContact CG-CD1 4.31Å; Q113-L121 HydrophobicContact CG-CD2 4.5Å; Q113-Y151 PolarHBondContact O-N 3.44Å
114	V	93.8	Very high	93.7	Very high	93 Å²	93	58.1 Å²	58.1	56%	0.564	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87	121.8	173.9	-178	0	0	0	0	108.5	L112	L112-V114 PolarHBondContact O-N 3.22Å
115	V	95.1	Very high	93.8	Very high	5 Å²	5	54.5 Å²	54.5	3%	0.03	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	120.9	179.3	-171.1	0	0	0	0	107.6	T119 L121 F145 P148 G149	V115-T119 WeakPolarHBondContact CG1-O 3.12Å; V115-L121 HydrophobicContact CG1-CG 4.41Å; V115-L121 HydrophobicContact CG2-CD1 3.57Å; V115-L121 HydrophobicContact CG2-CD2 4.03Å; V115-L121 HydrophobicContact CG2-CG 3.56Å; V115-F145 HydrophobicContact CB-CD1 4.21Å; V115-F145 HydrophobicContact CB-CE1 4.13Å; V115-F145 HydrophobicContact CG1-CD1 4.48Å; V115-F145 HydrophobicContact CG2-CD1 3.74Å; V115-F145 HydrophobicContact CG2-CE1 3.8Å; V115-P148 WeakPolarHBondContact O-CA 3.41Å; V115-G149 PolarHBondContact N-O 3.31Å; V115-G149 PolarHBondContact O-N 3.4Å; V115-G149 VanDerWaalsContact O-N 3.09Å
116	L	93.6	Very high	93.8	Very high	108 Å²	108	56.8 Å²	56.8	57%	0.565	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-79.3	160.4	-174.5	-61.4	177.2	0	0	0	110.8	T119	L116-T119 HydrophobicContact CB-CG2 4.38Å; L116-T119 PolarHBondContact N-OG1 3.29Å; L116-T119 VanDerWaalsContact N-OG1 3.09Å; L116-T119 PolarHBondContact O-N 2.99Å; L116-T119 PolarHBondContact O-OG1 3.31Å
117	P	92.6	Very high	93.7	Very high	78 Å²	78	54.8 Å²	54.8	51%	0.506	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	148.2	166.9	-20	30.2	0	0	0	111.1	T119 P148	P117-T119 PolarHBondContact O-N 2.77Å; P117-P148 HydrophobicContact CG-CB 4.03Å; P117-P148 HydrophobicContact CG-CG 4.4Å
118	N	93.5	Very high	93.7	Very high	97 Å²	97	55.8 Å²	55.8	52%	0.519	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.9	20.8	-177.4	-57.4	-27.1	0	0	0	114.2	A165 A203	N118-A165 HydrophobicContact CB-CB 3.85Å; N118-A165 WeakPolarHBondContact O-CB 3.46Å; N118-A165 PolarHBondContact O-N 3.15Å; N118-A203 HydrophobicContact CB-CB 4.43Å
119	T	94.9	Very high	93.7	Very high	21 Å²	21	51.9 Å²	51.9	13%	0.129	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	151.6	170.1	67.8	0	0	0	0	110	V115 L116 P117 G147 I163 Q164	V115-T119 WeakPolarHBondContact CG1-O 3.12Å; L116-T119 HydrophobicContact CB-CG2 4.38Å; L116-T119 PolarHBondContact N-OG1 3.29Å; L116-T119 VanDerWaalsContact N-OG1 3.09Å; L116-T119 PolarHBondContact O-N 2.99Å; L116-T119 PolarHBondContact O-OG1 3.31Å; P117-T119 PolarHBondContact O-N 2.77Å; T119-G147 PolarHBondContact O-N 3.04Å; T119-I163 CarbonylContact C-O 3.54Å; T119-I163 WeakPolarHBondContact CA-O 3.35Å; T119-Q164 HydrophobicContact CG2-CG 4.28Å
120	A	95.3	Very high	93.6	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	154.6	172.5	0	0	0	0	0	111	L144 F145 E146 I162 I163 L205	A120-L144 HydrophobicContact CB-CB 4.13Å; A120-L144 HydrophobicContact CB-CD1 4.3Å; A120-L144 HydrophobicContact CB-CD2 4.24Å; A120-L144 HydrophobicContact CB-CG 4.43Å; A120-F145 CarbonylContact C-O 3.59Å; A120-F145 VanDerWaalsContact CA-O 3.23Å; A120-F145 WeakPolarHBondContact CA-O 3.37Å; A120-E146 HydrophobicContact CB-CG 4.4Å; A120-I162 CarbonylContact O-C 3.58Å; A120-I162 WeakPolarHBondContact O-CA 3.49Å; A120-I163 PolarHBondContact N-O 3.3Å; A120-I163 PolarHBondContact O-N 3.35Å; A120-L205 HydrophobicContact CB-CD1 4.25Å; A120-L205 HydrophobicContact CB-CD2 3.91Å; A120-L205 HydrophobicContact CB-CG 4.42Å
121	L	95.2	Very high	93.2	Very high	1 Å²	1	55 Å²	55	1%	0.005	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	126.5	165	-55.1	-178.5	0	0	0	108.9	Q113 V115 L123 L144 F145 Y151 V159 I162	Q113-L121 HydrophobicContact CG-CD1 4.31Å; Q113-L121 HydrophobicContact CG-CD2 4.5Å; V115-L121 HydrophobicContact CG1-CG 4.41Å; V115-L121 HydrophobicContact CG2-CD1 3.57Å; V115-L121 HydrophobicContact CG2-CD2 4.03Å; V115-L121 HydrophobicContact CG2-CG 3.56Å; L121-L123 HydrophobicContact CB-CD2 3.94Å; L121-L123 HydrophobicContact CB-CG 4.28Å; L121-L123 PolarHBondContact O-N 2.95Å; L121-L144 WeakPolarHBondContact O-CA 3.34Å; L121-F145 HydrophobicContact CB-CB 4.29Å; L121-F145 PolarHBondContact N-O 2.71Å; L121-F145 PolarHBondContact O-N 2.82Å; L121-Y151 HydrophobicContact CD1-CD1 3.71Å; L121-Y151 HydrophobicContact CD1-CD2 4.21Å; L121-Y151 HydrophobicContact CD1-CE1 4.49Å; L121-Y151 HydrophobicContact CD1-CG 3.55Å; L121-V159 HydrophobicContact CB-CG1 4.28Å; L121-V159 HydrophobicContact CD1-CG1 4.47Å; L121-V159 HydrophobicContact CD2-CG1 4.22Å; L121-I162 HydrophobicContact CD2-CB 4.44Å; L121-I162 HydrophobicContact CD2-CD1 4.38Å; L121-I162 HydrophobicContact CD2-CG1 3.75Å; L121-I162 HydrophobicContact CD2-CG2 4.42Å
122	H	95.5	Very high	92.7	Very high	9 Å²	9	58.9 Å²	58.9	4%	0.042	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	111	165.6	-179.6	-156.9	0	0	0	108.3	E142 L144 V160 E161 I163	H122-E142 IonicContact CE1-OE2 2.64Å; H122-E142 PolarHBondContact CE1-OE2 2.81Å; H122-E142 VanDerWaalsContact CE1-OE2 3.3Å; H122-E142 IonicContact NE2-OE2 2.99Å; H122-E142 PolarHBondContact NE2-OE2 3.24Å; H122-L144 HydrophobicContact CB-CD2 4.34Å; H122-V160 HydrophobicContact CB-CB 4.33Å; H122-V160 PolarHBondContact O-N 3.12Å; H122-E161 HydrophobicContact CB-CG 3.87Å; H122-E161 PolarHBondContact N-O 3.42Å; H122-I163 HydrophobicContact CB-CD1 4Å; H122-I163 HydrophobicContact CB-CG1 4.29Å
123	L	94.7	Very high	92.2	Very high	4 Å²	4	64.1 Å²	64.1	2%	0.021	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	142.7	-177.6	-61.3	-178	0	0	0	109.7	L121 E142 W143 F145 Y151 V157 E158 V159	L121-L123 HydrophobicContact CB-CD2 3.94Å; L121-L123 HydrophobicContact CB-CG 4.28Å; L121-L123 PolarHBondContact O-N 2.95Å; L123-E142 CarbonylContact O-C 3.58Å; L123-E142 VanDerWaalsContact O-CA 3.24Å; L123-E142 WeakPolarHBondContact O-CA 3.27Å; L123-W143 HydrophobicContact CB-CD2 4.1Å; L123-W143 HydrophobicContact CB-CG 4.37Å; L123-W143 HydrophobicContact CB-CZ2 4.1Å; L123-W143 HydrophobicContact CD1-CZ2 4.43Å; L123-W143 PolarHBondContact N-O 3.2Å; L123-W143 PolarHBondContact O-N 3.43Å; L123-F145 HydrophobicContact CD1-CB 3.77Å; L123-F145 HydrophobicContact CG-CB 4.42Å; L123-Y151 HydrophobicContact CD1-CD2 4.25Å; L123-Y151 HydrophobicContact CD1-CE2 3.53Å; L123-Y151 HydrophobicContact CD2-CE1 4.24Å; L123-Y151 HydrophobicContact CD2-CE2 3.92Å; L123-Y151 HydrophobicContact CG-CE2 4.4Å; L123-V157 HydrophobicContact CB-CG1 3.78Å; L123-V157 HydrophobicContact CD1-CG1 4.37Å; L123-V157 HydrophobicContact CD2-CG1 4.11Å; L123-V157 HydrophobicContact CG-CG1 4.3Å; L123-E158 WeakPolarHBondContact CA-O 3.26Å; L123-V159 HydrophobicContact CD2-CB 4.36Å; L123-V159 HydrophobicContact CD2-CG2 3.75Å
124	K	94.2	Very high	91.8	Very high	75 Å²	75	63.2 Å²	63.2	33%	0.326	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	131.6	176.4	-176.8	173.4	-179.1	172.2	0	111	D141 E142 V157 E158 V160	K124-D141 CarbonylContact C-O 3.6Å; K124-D141 WeakPolarHBondContact CA-O 3.32Å; K124-E142 HydrophobicContact CB-CG 4.19Å; K124-E142 HydrophobicContact CD-CG 4.29Å; K124-E142 HydrophobicContact CG-CG 4Å; K124-V157 WeakPolarHBondContact O-CA 3.35Å; K124-E158 PolarHBondContact N-O 3.39Å; K124-E158 PolarHBondContact O-N 3.34Å; K124-V160 HydrophobicContact CB-CG2 3.61Å; K124-V160 HydrophobicContact CD-CG2 4.33Å
125	A	94.3	Very high	91.5	Very high	2 Å²	2	64 Å²	64	2%	0.017	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	127.6	173.2	0	0	0	0	0	110.9	F129 V137 V138 G140 D141 W143	A125-F129 HydrophobicContact CB-CE1 4.12Å; A125-V137 HydrophobicContact CB-CG1 3.76Å; A125-V138 WeakPolarHBondContact CB-O 3.27Å; A125-G140 PolarHBondContact O-N 2.89Å; A125-D141 PolarHBondContact N-O 3.44Å; A125-W143 HydrophobicContact CB-CH2 3.98Å; A125-W143 HydrophobicContact CB-CZ3 3.8Å
126	L	91.6	Very high	91.3	Very high	97 Å²	97	71.6 Å²	71.6	51%	0.508	37%	0.373	S	S	.	.	S	Bend	trans	-83	-30.1	174.3	-67.1	177	0	0	0	112.3	E156 E158	L126-E156 PolarHBondContact N-O 3.36Å; L126-E158 HydrophobicContact CD1-CB 4.24Å; L126-E158 HydrophobicContact CD2-CB 3.96Å; L126-E158 WeakPolarHBondContact CD2-OE2 3.37Å; L126-E158 HydrophobicContact CG-CB 4.04Å
127	L	90.8	Very high	91.2	Very high	87 Å²	87	67.5 Å²	67.5	46%	0.455	35%	0.353	S	S	.	.	S	Bend	trans	-151.3	163.1	-175.4	58.2	91.2	0	0	0	110.3	F129 E156	L127-F129 HydrophobicContact CD1-CB 4.43Å; L127-F129 WeakPolarHBondContact O-CD1 3.21Å; L127-F129 PolarHBondContact O-N 3.37Å; L127-E156 HydrophobicContact CD1-CB 3.92Å; L127-E156 HydrophobicContact CD1-CG 3.62Å; L127-E156 HydrophobicContact CG-CB 4.13Å; L127-E156 HydrophobicContact CG-CG 4.27Å
128	D	92	Very high	91.2	Very high	111 Å²	111	67.4 Å²	67.4	59%	0.594	35%	0.351	S	S	*	.			trans	-68.4	128.3	179.3	-59.9	-6.8	0	0	0	110.6	V137 A139	D128-V137 WeakPolarHBondContact CA-O 3.39Å; D128-A139 WeakPolarHBondContact OD1-CB 3.21Å; D128-A139 PolarHBondContact OD1-N 3.1Å
129	F	92.6	Very high	91.1	Very high	22 Å²	22	65.1 Å²	65.1	10%	0.096	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	164.5	176.8	75.2	-81.7	0	0	0	112.3	A125 L127 D131 V137 W143 E156 V157	A125-F129 HydrophobicContact CB-CE1 4.12Å; L127-F129 HydrophobicContact CD1-CB 4.43Å; L127-F129 WeakPolarHBondContact O-CD1 3.21Å; L127-F129 PolarHBondContact O-N 3.37Å; F129-D131 HydrophobicContact CE2-CB 4.36Å; F129-V137 HydrophobicContact CD1-CB 4.08Å; F129-V137 HydrophobicContact CD1-CG1 4.38Å; F129-V137 HydrophobicContact CE1-CB 3.71Å; F129-V137 HydrophobicContact CE1-CG1 3.71Å; F129-V137 HydrophobicContact CE1-CG2 4.24Å; F129-V137 HydrophobicContact CE2-CB 4.49Å; F129-V137 HydrophobicContact CE2-CG2 4.27Å; F129-V137 HydrophobicContact CZ-CB 3.93Å; F129-V137 HydrophobicContact CZ-CG1 4.11Å; F129-V137 HydrophobicContact CZ-CG2 3.92Å; F129-V137 PolarHBondContact N-O 3.38Å; F129-V137 PolarHBondContact O-N 3.36Å; F129-W143 HydrophobicContact CE1-CH2 4.09Å; F129-W143 HydrophobicContact CZ-CH2 4.04Å; F129-W143 HydrophobicContact CZ-CZ2 4.31Å; F129-E156 HydrophobicContact CB-CB 4.16Å; F129-E156 HydrophobicContact CB-CG 3.86Å; F129-E156 HydrophobicContact CD1-CB 3.51Å; F129-E156 HydrophobicContact CD1-CG 4.18Å; F129-E156 HydrophobicContact CD2-CB 4.48Å; F129-E156 HydrophobicContact CE1-CB 4Å; F129-E156 HydrophobicContact CG-CB 3.79Å; F129-E156 HydrophobicContact CG-CG 3.96Å; F129-V157 HydrophobicContact CE1-CG2 3.82Å; F129-V157 HydrophobicContact CZ-CG2 3.7Å
130	E	90.9	Very high	90.8	Very high	128 Å²	128	65.5 Å²	65.5	60%	0.598	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.9	125.5	173.7	-69.9	-179.9	174	0	0	109.5	D135 K136	E130-D135 WeakPolarHBondContact CA-O 3.48Å; E130-K136 HydrophobicContact CG-CG 4.09Å; E130-K136 WeakPolarHBondContact OE1-CE 3.46Å
131	D	86.5	Confident	90.7	Very high	44 Å²	44	68.9 Å²	68.9	24%	0.235	37%	0.371	C	S	.	.			trans	-72.7	170.7	175.6	-157.3	-3.7	0	0	0	111.2	F129 D133 G134 D135 V137 R154	F129-D131 HydrophobicContact CE2-CB 4.36Å; D131-D133 PolarHBondContact O-N 3.09Å; D131-G134 WeakPolarHBondContact O-CA 3.48Å; D131-G134 PolarHBondContact O-N 3.23Å; D131-D135 PolarHBondContact N-O 3.08Å; D131-V137 HydrophobicContact CB-CG2 4.37Å; D131-R154 IonicContact OD1-CZ 3.57Å; D131-R154 IonicContact OD1-NH1 2.6Å; D131-R154 PolarHBondContact OD1-NH1 2.83Å; D131-R154 IonicContact OD1-NH2 2.69Å; D131-R154 PolarHBondContact OD1-NH2 3.39Å
132	K	82.9	Confident	90.5	Very high	161 Å²	161	71 Å²	71	70%	0.7	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-28.7	179.5	-67	178.8	-179	179.3	0	112.8	G134	K132-G134 VanDerWaalsContact C-N 3.28Å
133	D	83.1	Confident	90.4	Very high	138 Å²	138	73.9 Å²	73.9	74%	0.738	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-3	177.9	-59.8	-44.7	0	0	0	112.6	D131	D131-D133 PolarHBondContact O-N 3.09Å
134	G	84.3	Confident	90.4	Very high	47 Å²	47	75.2 Å²	75.2	49%	0.485	40%	0.399	S	S	.	.	S	Bend	trans	88.2	3.5	179.6	0	0	0	0	0	114.3	D131 K132	D131-G134 WeakPolarHBondContact O-CA 3.48Å; D131-G134 PolarHBondContact O-N 3.23Å; K132-G134 VanDerWaalsContact C-N 3.28Å
135	D	88.1	Confident	90.4	Very high	109 Å²	109	74.7 Å²	74.7	58%	0.583	40%	0.396	S	S	*	.			trans	-74.4	136.9	177.6	-68.5	-35.6	0	0	0	111.3	E130 D131 V137	E130-D135 WeakPolarHBondContact CA-O 3.48Å; D131-D135 PolarHBondContact N-O 3.08Å; D135-V137 PolarHBondContact O-N 2.84Å
136	K	90.6	Very high	90.4	Very high	164 Å²	164	79.7 Å²	79.7	71%	0.713	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.5	114	177.5	-67.6	-174.2	177.4	-170.2	0	109.7	E130	E130-K136 HydrophobicContact CG-CG 4.09Å; E130-K136 WeakPolarHBondContact OE1-CE 3.46Å
137	V	92	Very high	90.4	Very high	22 Å²	22	76 Å²	76	13%	0.133	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	130.6	174.1	-175.8	0	0	0	0	108.6	A125 D128 F129 D131 D135 D141 W143	A125-V137 HydrophobicContact CB-CG1 3.76Å; D128-V137 WeakPolarHBondContact CA-O 3.39Å; F129-V137 HydrophobicContact CD1-CB 4.08Å; F129-V137 HydrophobicContact CD1-CG1 4.38Å; F129-V137 HydrophobicContact CE1-CB 3.71Å; F129-V137 HydrophobicContact CE1-CG1 3.71Å; F129-V137 HydrophobicContact CE1-CG2 4.24Å; F129-V137 HydrophobicContact CE2-CB 4.49Å; F129-V137 HydrophobicContact CE2-CG2 4.27Å; F129-V137 HydrophobicContact CZ-CB 3.93Å; F129-V137 HydrophobicContact CZ-CG1 4.11Å; F129-V137 HydrophobicContact CZ-CG2 3.92Å; F129-V137 PolarHBondContact N-O 3.38Å; F129-V137 PolarHBondContact O-N 3.36Å; D131-V137 HydrophobicContact CB-CG2 4.37Å; D135-V137 PolarHBondContact O-N 2.84Å; V137-D141 HydrophobicContact CG1-CB 3.97Å; V137-W143 HydrophobicContact CG1-CE3 4.49Å; V137-W143 HydrophobicContact CG1-CH2 3.94Å; V137-W143 HydrophobicContact CG1-CZ3 3.66Å
138	V	92.4	Very high	90.5	Very high	77 Å²	77	77 Å²	77	47%	0.467	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-95.3	147.8	-178.4	-177.7	0	0	0	0	110.2	A125 G140 D141	A125-V138 WeakPolarHBondContact CB-O 3.27Å; V138-G140 PolarHBondContact O-N 2.8Å; V138-D141 PolarHBondContact N-OD2 3.31Å; V138-D141 VanDerWaalsContact O-CB 3.27Å; V138-D141 WeakPolarHBondContact O-CB 3.48Å; V138-D141 VanDerWaalsContact O-CG 3.28Å; V138-D141 PolarHBondContact O-N 2.9Å
139	A	91.6	Very high	90.6	Very high	49 Å²	49	72.8 Å²	72.8	41%	0.405	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	126.1	174.6	0	0	0	0	0	111.4	D128	D128-A139 WeakPolarHBondContact OD1-CB 3.21Å; D128-A139 PolarHBondContact OD1-N 3.1Å
140	G	89.5	Confident	90.6	Very high	29 Å²	29	74.8 Å²	74.8	30%	0.299	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	91	-4.3	-176.7	0	0	0	0	0	115.1	A125 V138	A125-G140 PolarHBondContact O-N 2.89Å; V138-G140 PolarHBondContact O-N 2.8Å
141	D	91.3	Very high	90.8	Very high	71 Å²	71	69.2 Å²	69.2	38%	0.38	39%	0.387	S	S	.	.			trans	-62.2	142.8	169	-73.2	-14.8	0	0	0	110.2	K124 A125 V137 V138 W143	K124-D141 CarbonylContact C-O 3.6Å; K124-D141 WeakPolarHBondContact CA-O 3.32Å; A125-D141 PolarHBondContact N-O 3.44Å; V137-D141 HydrophobicContact CG1-CB 3.97Å; V138-D141 PolarHBondContact N-OD2 3.31Å; V138-D141 VanDerWaalsContact O-CB 3.27Å; V138-D141 WeakPolarHBondContact O-CB 3.48Å; V138-D141 VanDerWaalsContact O-CG 3.28Å; V138-D141 PolarHBondContact O-N 2.9Å; D141-W143 HydrophobicContact CB-CE3 4.47Å; D141-W143 HydrophobicContact CB-CZ3 4.3Å; D141-W143 WeakPolarHBondContact O-CZ3 3.35Å
142	E	92.5	Very high	91	Very high	45 Å²	45	70.6 Å²	70.6	21%	0.21	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	133.7	-176.4	-66.1	175.9	-160.7	0	0	110.1	H122 L123 K124 V208 F209	H122-E142 IonicContact CE1-OE2 2.64Å; H122-E142 PolarHBondContact CE1-OE2 2.81Å; H122-E142 VanDerWaalsContact CE1-OE2 3.3Å; H122-E142 IonicContact NE2-OE2 2.99Å; H122-E142 PolarHBondContact NE2-OE2 3.24Å; L123-E142 CarbonylContact O-C 3.58Å; L123-E142 VanDerWaalsContact O-CA 3.24Å; L123-E142 WeakPolarHBondContact O-CA 3.27Å; K124-E142 HydrophobicContact CB-CG 4.19Å; K124-E142 HydrophobicContact CD-CG 4.29Å; K124-E142 HydrophobicContact CG-CG 4Å; E142-V208 HydrophobicContact CB-CG1 3.44Å; E142-V208 VanDerWaalsContact CB-CG1 3.44Å; E142-F209 HydrophobicContact CB-CE1 4.18Å; E142-F209 HydrophobicContact CB-CZ 4.36Å
143	W	92.9	Very high	91.5	Very high	70 Å²	70	63.9 Å²	63.9	27%	0.265	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	171.1	179.6	66.4	99.2	0	0	0	111.5	L123 A125 F129 V137 D141 V157 V208	L123-W143 HydrophobicContact CB-CD2 4.1Å; L123-W143 HydrophobicContact CB-CG 4.37Å; L123-W143 HydrophobicContact CB-CZ2 4.1Å; L123-W143 HydrophobicContact CD1-CZ2 4.43Å; L123-W143 PolarHBondContact N-O 3.2Å; L123-W143 PolarHBondContact O-N 3.43Å; A125-W143 HydrophobicContact CB-CH2 3.98Å; A125-W143 HydrophobicContact CB-CZ3 3.8Å; F129-W143 HydrophobicContact CE1-CH2 4.09Å; F129-W143 HydrophobicContact CZ-CH2 4.04Å; F129-W143 HydrophobicContact CZ-CZ2 4.31Å; V137-W143 HydrophobicContact CG1-CE3 4.49Å; V137-W143 HydrophobicContact CG1-CH2 3.94Å; V137-W143 HydrophobicContact CG1-CZ3 3.66Å; D141-W143 HydrophobicContact CB-CE3 4.47Å; D141-W143 HydrophobicContact CB-CZ3 4.3Å; D141-W143 WeakPolarHBondContact O-CZ3 3.35Å; W143-V157 HydrophobicContact CH2-CG1 3.94Å; W143-V157 HydrophobicContact CH2-CG2 3.8Å; W143-V157 HydrophobicContact CZ2-CB 4.44Å; W143-V157 HydrophobicContact CZ2-CG1 3.72Å; W143-V157 HydrophobicContact CZ2-CG2 3.77Å; W143-V208 VanDerWaalsContact CA-CG2 3.45Å
144	L	93.9	Very high	91.9	Very high	32 Å²	32	60.4 Å²	60.4	17%	0.168	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	140.5	176.9	-61.5	-178.5	0	0	0	111.3	A120 L121 H122 E146 I163 P206 V208	A120-L144 HydrophobicContact CB-CB 4.13Å; A120-L144 HydrophobicContact CB-CD1 4.3Å; A120-L144 HydrophobicContact CB-CD2 4.24Å; A120-L144 HydrophobicContact CB-CG 4.43Å; L121-L144 WeakPolarHBondContact O-CA 3.34Å; H122-L144 HydrophobicContact CB-CD2 4.34Å; L144-E146 HydrophobicContact CB-CG 4.29Å; L144-I163 HydrophobicContact CD2-CD1 3.74Å; L144-P206 VanDerWaalsContact CD1-O 3.26Å; L144-P206 WeakPolarHBondContact CD1-O 3.43Å; L144-V208 HydrophobicContact CD1-CG2 4.47Å; L144-V208 HydrophobicContact CD2-CG2 4.05Å; L144-V208 HydrophobicContact CG-CG2 3.68Å
145	F	94.6	Very high	92.2	Very high	63 Å²	63	61.2 Å²	61.2	28%	0.276	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	100.1	158	-179.2	-88.2	0	0	0	108.3	V115 A120 L121 L123 Y151	V115-F145 HydrophobicContact CB-CD1 4.21Å; V115-F145 HydrophobicContact CB-CE1 4.13Å; V115-F145 HydrophobicContact CG1-CD1 4.48Å; V115-F145 HydrophobicContact CG2-CD1 3.74Å; V115-F145 HydrophobicContact CG2-CE1 3.8Å; A120-F145 CarbonylContact C-O 3.59Å; A120-F145 VanDerWaalsContact CA-O 3.23Å; A120-F145 WeakPolarHBondContact CA-O 3.37Å; L121-F145 HydrophobicContact CB-CB 4.29Å; L121-F145 PolarHBondContact N-O 2.71Å; L121-F145 PolarHBondContact O-N 2.82Å; L123-F145 HydrophobicContact CD1-CB 3.77Å; L123-F145 HydrophobicContact CG-CB 4.42Å; F145-Y151 HydrophobicContact CB-CD2 4.4Å; F145-Y151 HydrophobicContact CD1-CD2 4.36Å; F145-Y151 HydrophobicContact CD2-CD2 4.07Å; F145-Y151 HydrophobicContact CE2-CD2 4.43Å; F145-Y151 HydrophobicContact CG-CD2 4.02Å
146	E	93.9	Very high	92.4	Very high	107 Å²	107	57.8 Å²	57.8	50%	0.5	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	134.5	-178.6	-60.1	-171.4	166.2	0	0	111.5	A120 L144 R185 L205	A120-E146 HydrophobicContact CB-CG 4.4Å; L144-E146 HydrophobicContact CB-CG 4.29Å; E146-R185 IonicContact OE1-NH2 3.69Å; E146-L205 HydrophobicContact CB-CD2 4.44Å; E146-L205 HydrophobicContact CG-CD2 3.98Å
147	G	92.1	Very high	92.6	Very high	20 Å²	20	50.5 Å²	50.5	21%	0.206	28%	0.283	C	S	.	.	S	Bend	trans	-78.4	166.6	173.2	0	0	0	0	0	113.2	T119	T119-G147 PolarHBondContact O-N 3.04Å
148	P	93.3	Very high	92.6	Very high	107 Å²	107	54.2 Å²	54.2	70%	0.695	30%	0.299	S	S	*	.	S	Bend	cis	-84	130.5	5.2	30.5	-32.1	0	0	0	113.2	V115 P117	V115-P148 WeakPolarHBondContact O-CA 3.41Å; P117-P148 HydrophobicContact CG-CB 4.03Å; P117-P148 HydrophobicContact CG-CG 4.4Å
149	G	93	Very high	92.7	Very high	23 Å²	23	52.8 Å²	52.8	24%	0.237	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.2	162.2	179.3	0	0	0	0	0	112.8	V115	V115-G149 PolarHBondContact N-O 3.31Å; V115-G149 PolarHBondContact O-N 3.4Å; V115-G149 VanDerWaalsContact O-N 3.09Å
150	T	92.9	Very high	92.9	Very high	64 Å²	64	53.8 Å²	53.8	39%	0.393	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	115.1	169.4	-57.9	0	0	0	0	108.2	L112 I152	L112-T150 HydrophobicContact CB-CG2 3.45Å; L112-T150 VanDerWaalsContact CB-CG2 3.45Å; L112-T150 HydrophobicContact CD1-CG2 3.91Å; L112-T150 HydrophobicContact CG-CG2 4.29Å; T150-I152 PolarHBondContact O-N 3.37Å
151	Y	94.4	Very high	93	Very high	12 Å²	12	57 Å²	57	5%	0.047	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	126.4	176.8	176.5	-112.3	0	0	0	109.5	Q113 L121 L123 F145 P153 V159	Q113-Y151 PolarHBondContact O-N 3.44Å; L121-Y151 HydrophobicContact CD1-CD1 3.71Å; L121-Y151 HydrophobicContact CD1-CD2 4.21Å; L121-Y151 HydrophobicContact CD1-CE1 4.49Å; L121-Y151 HydrophobicContact CD1-CG 3.55Å; L123-Y151 HydrophobicContact CD1-CD2 4.25Å; L123-Y151 HydrophobicContact CD1-CE2 3.53Å; L123-Y151 HydrophobicContact CD2-CE1 4.24Å; L123-Y151 HydrophobicContact CD2-CE2 3.92Å; L123-Y151 HydrophobicContact CG-CE2 4.4Å; F145-Y151 HydrophobicContact CB-CD2 4.4Å; F145-Y151 HydrophobicContact CD1-CD2 4.36Å; F145-Y151 HydrophobicContact CD2-CD2 4.07Å; F145-Y151 HydrophobicContact CE2-CD2 4.43Å; F145-Y151 HydrophobicContact CG-CD2 4.02Å; Y151-P153 HydrophobicContact CD1-CG 4.38Å; Y151-P153 HydrophobicContact CE1-CB 4.29Å; Y151-P153 HydrophobicContact CE1-CG 4.34Å; Y151-P153 WeakPolarHBondContact O-CD 3.49Å; Y151-V159 HydrophobicContact CD1-CG2 4.21Å; Y151-V159 HydrophobicContact CE1-CG2 3.63Å
152	I	92.7	Very high	93.2	Very high	73 Å²	73	58 Å²	58	37%	0.374	30%	0.303	S	S	.	.			trans	-93.5	113	171.9	-62.9	173	0	0	0	106.7	L92 T150	L92-I152 HydrophobicContact CD1-CG2 4.42Å; L92-I152 HydrophobicContact CD2-CG2 4.23Å; T150-I152 PolarHBondContact O-N 3.37Å
153	P	92.8	Very high	93.2	Very high	19 Å²	19	57 Å²	57	12%	0.123	30%	0.299	C	S	.	.			trans	-58.6	147.4	179.8	-25.4	36.8	0	0	0	111.5	Y58 I90 L112 Y151	Y58-P153 HydrophobicContact CD1-CG 4.16Å; Y58-P153 HydrophobicContact CD2-CG 4.38Å; Y58-P153 HydrophobicContact CE1-CG 3.72Å; Y58-P153 HydrophobicContact CE2-CB 4.16Å; Y58-P153 HydrophobicContact CE2-CG 3.96Å; Y58-P153 HydrophobicContact CG-CG 4.46Å; I90-P153 VanDerWaalsContact CD1-C 3.41Å; I90-P153 HydrophobicContact CD1-CB 4.09Å; I90-P153 WeakPolarHBondContact CD1-O 3.23Å; L112-P153 HydrophobicContact CD2-CG 4.44Å; Y151-P153 HydrophobicContact CD1-CG 4.38Å; Y151-P153 HydrophobicContact CE1-CB 4.29Å; Y151-P153 HydrophobicContact CE1-CG 4.34Å; Y151-P153 WeakPolarHBondContact O-CD 3.49Å
154	R	91.4	Very high	93.2	Very high	66 Å²	66	60.4 Å²	60.4	25%	0.249	32%	0.318	C	S	.	.			trans	-120.2	153.2	172.5	-64.9	-165.9	-172.5	-162.2	11.6	109.1	I90 D131 E156 V157	I90-R154 VanDerWaalsContact CD1-CA 3.48Å; D131-R154 IonicContact OD1-CZ 3.57Å; D131-R154 IonicContact OD1-NH1 2.6Å; D131-R154 PolarHBondContact OD1-NH1 2.83Å; D131-R154 IonicContact OD1-NH2 2.69Å; D131-R154 PolarHBondContact OD1-NH2 3.39Å; R154-E156 VanDerWaalsContact C-N 3.29Å; R154-E156 WeakPolarHBondContact CB-OE2 3.19Å; R154-V157 HydrophobicContact CB-CB 4.1Å; R154-V157 HydrophobicContact CB-CG2 3.89Å
155	K	90.2	Very high	93.2	Very high	63 Å²	63	59.8 Å²	59.8	27%	0.274	32%	0.317	S	S	.	.	S	Bend	trans	-77.4	-23.6	-180	62.7	-175.7	-178.8	174.1	0	111.7	D87 L88 I90	D87-K155 IonicContact OD1-NZ 2.86Å; D87-K155 PolarHBondContact OD1-NZ 3.15Å; D87-K155 IonicContact OD2-NZ 3.29Å; D87-K155 PolarHBondContact OD2-NZ 3.27Å; L88-K155 HydrophobicContact CB-CB 3.98Å; L88-K155 HydrophobicContact CB-CD 4.22Å; L88-K155 WeakPolarHBondContact O-CD 3.42Å; L88-K155 PolarHBondContact O-NZ 3.07Å; I90-K155 HydrophobicContact CD1-CB 4.46Å
156	E	92.2	Very high	93.2	Very high	37 Å²	37	58.7 Å²	58.7	17%	0.173	32%	0.315	C	S	.	.	S	Bend	trans	-87.8	-7.8	-178.7	-49.6	85.9	175.7	0	0	112.6	L126 L127 F129 R154	L126-E156 PolarHBondContact N-O 3.36Å; L127-E156 HydrophobicContact CD1-CB 3.92Å; L127-E156 HydrophobicContact CD1-CG 3.62Å; L127-E156 HydrophobicContact CG-CB 4.13Å; L127-E156 HydrophobicContact CG-CG 4.27Å; F129-E156 HydrophobicContact CB-CB 4.16Å; F129-E156 HydrophobicContact CB-CG 3.86Å; F129-E156 HydrophobicContact CD1-CB 3.51Å; F129-E156 HydrophobicContact CD1-CG 4.18Å; F129-E156 HydrophobicContact CD2-CB 4.48Å; F129-E156 HydrophobicContact CE1-CB 4Å; F129-E156 HydrophobicContact CG-CB 3.79Å; F129-E156 HydrophobicContact CG-CG 3.96Å; R154-E156 VanDerWaalsContact C-N 3.29Å; R154-E156 WeakPolarHBondContact CB-OE2 3.19Å
157	V	94.3	Very high	93.2	Very high	12 Å²	12	59.1 Å²	59.1	7%	0.073	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	129.3	-170.2	-173.3	0	0	0	0	110.4	L123 K124 F129 W143 R154	L123-V157 HydrophobicContact CB-CG1 3.78Å; L123-V157 HydrophobicContact CD1-CG1 4.37Å; L123-V157 HydrophobicContact CD2-CG1 4.11Å; L123-V157 HydrophobicContact CG-CG1 4.3Å; K124-V157 WeakPolarHBondContact O-CA 3.35Å; F129-V157 HydrophobicContact CE1-CG2 3.82Å; F129-V157 HydrophobicContact CZ-CG2 3.7Å; W143-V157 HydrophobicContact CH2-CG1 3.94Å; W143-V157 HydrophobicContact CH2-CG2 3.8Å; W143-V157 HydrophobicContact CZ2-CB 4.44Å; W143-V157 HydrophobicContact CZ2-CG1 3.72Å; W143-V157 HydrophobicContact CZ2-CG2 3.77Å; R154-V157 HydrophobicContact CB-CB 4.1Å; R154-V157 HydrophobicContact CB-CG2 3.89Å
158	E	93.7	Very high	93.4	Very high	99 Å²	99	58.2 Å²	58.2	46%	0.463	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	142.4	171.9	-177	174.9	-161.7	0	0	110.4	L123 K124 L126	L123-E158 WeakPolarHBondContact CA-O 3.26Å; K124-E158 PolarHBondContact N-O 3.39Å; K124-E158 PolarHBondContact O-N 3.34Å; L126-E158 HydrophobicContact CD1-CB 4.24Å; L126-E158 HydrophobicContact CD2-CB 3.96Å; L126-E158 WeakPolarHBondContact CD2-OE2 3.37Å; L126-E158 HydrophobicContact CG-CB 4.04Å
159	V	94.4	Very high	93.4	Very high	48 Å²	48	61.4 Å²	61.4	29%	0.291	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	108.7	169.1	-177.8	0	0	0	0	107.4	L121 L123 Y151	L121-V159 HydrophobicContact CB-CG1 4.28Å; L121-V159 HydrophobicContact CD1-CG1 4.47Å; L121-V159 HydrophobicContact CD2-CG1 4.22Å; L123-V159 HydrophobicContact CD2-CB 4.36Å; L123-V159 HydrophobicContact CD2-CG2 3.75Å; Y151-V159 HydrophobicContact CD1-CG2 4.21Å; Y151-V159 HydrophobicContact CE1-CG2 3.63Å
160	V	94.2	Very high	93.3	Very high	70 Å²	70	66.8 Å²	66.8	42%	0.424	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	-54.8	-177.6	-177	0	0	0	0	110.1	H122 K124	H122-V160 HydrophobicContact CB-CB 4.33Å; H122-V160 PolarHBondContact O-N 3.12Å; K124-V160 HydrophobicContact CB-CG2 3.61Å; K124-V160 HydrophobicContact CD-CG2 4.33Å
161	E	93.2	Very high	93.3	Very high	96 Å²	96	67.4 Å²	67.4	45%	0.449	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	169.1	-179.6	62.6	-178.7	-176.4	0	0	112.8	H122 I163	H122-E161 HydrophobicContact CB-CG 3.87Å; H122-E161 PolarHBondContact N-O 3.42Å; E161-I163 HydrophobicContact CG-CG1 4.24Å
162	I	93.9	Very high	93.3	Very high	93 Å²	93	68.4 Å²	68.4	48%	0.477	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	113.8	171.5	-51.8	-179.3	0	0	0	107.7	A120 L121	A120-I162 CarbonylContact O-C 3.58Å; A120-I162 WeakPolarHBondContact O-CA 3.49Å; L121-I162 HydrophobicContact CD2-CB 4.44Å; L121-I162 HydrophobicContact CD2-CD1 4.38Å; L121-I162 HydrophobicContact CD2-CG1 3.75Å; L121-I162 HydrophobicContact CD2-CG2 4.42Å
163	I	93.7	Very high	93.4	Very high	22 Å²	22	65 Å²	65	11%	0.113	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	132.4	177.2	-63.7	-179.6	0	0	0	108.9	T119 A120 H122 L144 E161 L205 P206	T119-I163 CarbonylContact C-O 3.54Å; T119-I163 WeakPolarHBondContact CA-O 3.35Å; A120-I163 PolarHBondContact N-O 3.3Å; A120-I163 PolarHBondContact O-N 3.35Å; H122-I163 HydrophobicContact CB-CD1 4Å; H122-I163 HydrophobicContact CB-CG1 4.29Å; L144-I163 HydrophobicContact CD2-CD1 3.74Å; E161-I163 HydrophobicContact CG-CG1 4.24Å; I163-L205 HydrophobicContact CG2-CD1 4.03Å; I163-P206 HydrophobicContact CG2-CG 3.6Å
164	Q	92.9	Very high	93.5	Very high	143 Å²	143	64.1 Å²	64.1	67%	0.668	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.6	143.7	175	-62	-173.5	-12.1	0	0	110.2	T119	T119-Q164 HydrophobicContact CG2-CG 4.28Å
165	A	94	Very high	93.8	Very high	19 Å²	19	63.5 Å²	63.5	16%	0.157	31%	0.308	C	S	.	.			trans	-69.2	139.1	173.6	0	0	0	0	0	111.2	N118 A203 Y204 L205	N118-A165 HydrophobicContact CB-CB 3.85Å; N118-A165 WeakPolarHBondContact O-CB 3.46Å; N118-A165 PolarHBondContact O-N 3.15Å; A165-A203 HydrophobicContact CB-CB 3.89Å; A165-Y204 CarbonylContact C-O 3.51Å; A165-Y204 VanDerWaalsContact CA-O 3.23Å; A165-Y204 WeakPolarHBondContact CA-O 3.24Å; A165-L205 HydrophobicContact CB-CB 4.08Å; A165-L205 HydrophobicContact CB-CD1 4.15Å
166	T	94.4	Very high	94	Very high	39 Å²	39	60.5 Å²	60.5	24%	0.239	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	130.7	174	-58.7	0	0	0	0	109.7	I168 L174 Y204 L215	T166-I168 PolarHBondContact O-N 3.42Å; T166-L174 HydrophobicContact CG2-CD1 3.72Å; T166-L174 HydrophobicContact CG2-CD2 4.41Å; T166-Y204 PolarHBondContact N-O 3.22Å; T166-Y204 PolarHBondContact O-N 3.44Å; T166-L215 HydrophobicContact CG2-CD1 4.35Å; T166-L215 HydrophobicContact CG2-CD2 4.34Å; T166-L215 HydrophobicContact CG2-CG 4.41Å
167	I	94.1	Very high	94.2	Very high	116 Å²	116	62.5 Å²	62.5	60%	0.595	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.6	115.2	-178.6	-58.4	172.5	0	0	0	109.5
168	I	95.2	Very high	94.2	Very high	2 Å²	2	62 Å²	62	1%	0.01	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	119.5	174.3	-51.5	176.2	0	0	0	108	T166 Q172 L174 V198 V201 G202 Y204 L215	T166-I168 PolarHBondContact O-N 3.42Å; I168-Q172 HydrophobicContact CG2-CB 4.21Å; I168-Q172 VanDerWaalsContact CG2-O 3.31Å; I168-Q172 WeakPolarHBondContact CG2-O 3.37Å; I168-L174 HydrophobicContact CD1-CB 3.49Å; I168-L174 VanDerWaalsContact CD1-CB 3.49Å; I168-L174 HydrophobicContact CD1-CD2 4.32Å; I168-L174 HydrophobicContact CG1-CB 3.92Å; I168-V198 HydrophobicContact CD1-CB 4.34Å; I168-V198 HydrophobicContact CD1-CG1 4.05Å; I168-V201 WeakPolarHBondContact O-CG1 3.3Å; I168-G202 PolarHBondContact N-O 3.21Å; I168-G202 PolarHBondContact O-N 3.28Å; I168-Y204 HydrophobicContact CD1-CG 4.37Å; I168-L215 HydrophobicContact CG1-CD2 4.29Å
169	R	93.5	Very high	94.1	Very high	173 Å²	173	63.1 Å²	63.1	65%	0.653	30%	0.298	S	S	*	.	P	Polyproline II helix	trans	-87.1	172.7	176.8	-58	179.8	179.2	176.9	1.4	111.2	Q172	R169-Q172 HydrophobicContact CB-CG 4.25Å; R169-Q172 VanDerWaalsContact CB-OE1 3.29Å; R169-Q172 PolarHBondContact O-N 2.77Å
170	Q	91.7	Very high	93.9	Very high	137 Å²	137	65.7 Å²	65.7	64%	0.64	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	140.4	167	-166.6	65.6	32.8	0	0	109.8	Q172	Q170-Q172 PolarHBondContact O-N 3.36Å
171	N	93.1	Very high	93.8	Very high	76 Å²	76	69.4 Å²	69.4	41%	0.406	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.7	27.1	-177.6	-56.8	-17.7	0	0	0	113.8	A218	N171-A218 HydrophobicContact CB-CB 3.84Å; N171-A218 WeakPolarHBondContact O-CB 3.41Å; N171-A218 PolarHBondContact O-N 3.09Å
172	Q	94.2	Very high	93.6	Very high	34 Å²	34	65.5 Å²	65.5	16%	0.159	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	155.8	170.3	-62.7	-170.5	-43.4	0	0	109.9	I168 R169 Q170 V216 D217	I168-Q172 HydrophobicContact CG2-CB 4.21Å; I168-Q172 VanDerWaalsContact CG2-O 3.31Å; I168-Q172 WeakPolarHBondContact CG2-O 3.37Å; R169-Q172 HydrophobicContact CB-CG 4.25Å; R169-Q172 VanDerWaalsContact CB-OE1 3.29Å; R169-Q172 PolarHBondContact O-N 2.77Å; Q170-Q172 PolarHBondContact O-N 3.36Å; Q172-V216 CarbonylContact C-O 3.58Å; Q172-V216 WeakPolarHBondContact CA-O 3.12Å; Q172-D217 VanDerWaalsContact CG-OD1 3.32Å; Q172-D217 WeakPolarHBondContact CG-OD1 3.31Å; Q172-D217 PolarHBondContact NE2-OD1 3.45Å
173	A	94.6	Very high	93.4	Very high	0 Å²	0	69.3 Å²	69.3	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	152.6	166.8	0	0	0	0	0	110.7	L197 V198 T199 L215 V216 V260	A173-L197 HydrophobicContact CB-CB 4.09Å; A173-L197 HydrophobicContact CB-CD1 4.12Å; A173-L197 HydrophobicContact CB-CD2 4.39Å; A173-L197 HydrophobicContact CB-CG 4.43Å; A173-V198 CarbonylContact C-O 3.59Å; A173-V198 VanDerWaalsContact CA-O 3.23Å; A173-V198 WeakPolarHBondContact CA-O 3.29Å; A173-V198 WeakPolarHBondContact CB-O 3.28Å; A173-T199 HydrophobicContact CB-CG2 3.95Å; A173-L215 CarbonylContact O-C 3.49Å; A173-L215 WeakPolarHBondContact O-CA 3.48Å; A173-V216 PolarHBondContact N-O 3.43Å; A173-V216 PolarHBondContact O-N 3Å; A173-V260 HydrophobicContact CB-CG1 3.77Å
174	L	95.7	Very high	93.2	Very high	1 Å²	1	68.7 Å²	68.7	1%	0.005	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	124.4	174.4	-172.3	65.9	0	0	0	110	T166 I168 L176 L197 V198 Y204 V212 L215	T166-L174 HydrophobicContact CG2-CD1 3.72Å; T166-L174 HydrophobicContact CG2-CD2 4.41Å; I168-L174 HydrophobicContact CD1-CB 3.49Å; I168-L174 VanDerWaalsContact CD1-CB 3.49Å; I168-L174 HydrophobicContact CD1-CD2 4.32Å; I168-L174 HydrophobicContact CG1-CB 3.92Å; L174-L176 HydrophobicContact CD2-CD2 3.82Å; L174-L176 HydrophobicContact CG-CD2 3.98Å; L174-L197 CarbonylContact O-C 3.6Å; L174-L197 WeakPolarHBondContact O-CA 3.49Å; L174-V198 HydrophobicContact CB-CB 4.42Å; L174-V198 PolarHBondContact N-O 3.31Å; L174-V198 PolarHBondContact O-N 3.34Å; L174-Y204 HydrophobicContact CD2-CD1 3.61Å; L174-Y204 HydrophobicContact CD2-CE1 4.35Å; L174-Y204 HydrophobicContact CD2-CG 4.2Å; L174-V212 HydrophobicContact CD1-CG1 3.66Å; L174-V212 HydrophobicContact CD2-CG1 4.3Å; L174-V212 HydrophobicContact CD2-CG2 4.41Å; L174-V212 HydrophobicContact CG-CG1 4.25Å; L174-L215 HydrophobicContact CB-CD2 4.25Å; L174-L215 HydrophobicContact CD1-CD2 3.73Å; L174-L215 HydrophobicContact CD1-CG 4.11Å
175	R	96.1	Very high	92.9	Very high	53 Å²	53	67.6 Å²	67.6	20%	0.2	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	128.3	173.3	-166.5	-174.9	-173	158.2	-0.9	110.5	E195 W196 L197 L213 D214 V216 V263	R175-E195 IonicContact CZ-OE2 3.52Å; R175-E195 IonicContact NE-OE2 2.8Å; R175-E195 PolarHBondContact NE-OE2 3.46Å; R175-E195 IonicContact NH2-OE2 3.98Å; R175-E195 PolarHBondContact NH2-OE2 2.86Å; R175-W196 WeakPolarHBondContact CA-O 3.43Å; R175-L197 HydrophobicContact CB-CD2 3.64Å; R175-L197 HydrophobicContact CG-CD2 3.9Å; R175-L213 HydrophobicContact CB-CB 4.35Å; R175-L213 HydrophobicContact CG-CB 4.46Å; R175-L213 HydrophobicContact CG-CD1 4.15Å; R175-L213 PolarHBondContact O-N 3.02Å; R175-D214 WeakPolarHBondContact CB-O 3.23Å; R175-D214 WeakPolarHBondContact CB-OD1 3.43Å; R175-D214 WeakPolarHBondContact CD-OD1 3.49Å; R175-D214 PolarHBondContact N-O 3.3Å; R175-V216 HydrophobicContact CB-CG2 4.38Å; R175-V263 HydrophobicContact CG-CG2 4.34Å
176	L	95.1	Very high	92.5	Very high	0 Å²	0	73 Å²	73	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	154.8	178.7	-59	178.9	0	0	0	110.3	L174 E195 W196 V198 Y204 E210 E211 V212	L174-L176 HydrophobicContact CD2-CD2 3.82Å; L174-L176 HydrophobicContact CG-CD2 3.98Å; L176-E195 WeakPolarHBondContact O-CA 3.33Å; L176-W196 HydrophobicContact CB-CD2 4.22Å; L176-W196 HydrophobicContact CB-CH2 4.28Å; L176-W196 HydrophobicContact CB-CZ2 3.85Å; L176-W196 HydrophobicContact CD1-CZ2 4.01Å; L176-W196 PolarHBondContact N-O 2.83Å; L176-W196 PolarHBondContact O-N 3.43Å; L176-W196 VanDerWaalsContact O-N 3.09Å; L176-V198 HydrophobicContact CD1-CG2 3.56Å; L176-V198 HydrophobicContact CG-CG2 4.28Å; L176-Y204 HydrophobicContact CD1-CE1 3.56Å; L176-Y204 WeakPolarHBondContact CD1-OH 3.23Å; L176-Y204 HydrophobicContact CD2-CE1 4.35Å; L176-E210 HydrophobicContact CD1-CB 4.39Å; L176-E210 HydrophobicContact CD1-CG 4.4Å; L176-E211 CarbonylContact C-O 3.51Å; L176-E211 WeakPolarHBondContact CA-O 3.31Å; L176-V212 HydrophobicContact CD2-CB 4.35Å; L176-V212 HydrophobicContact CD2-CG2 3.84Å
177	R	95.5	Very high	92.1	Very high	80 Å²	80	73.5 Å²	73.5	30%	0.302	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	134.3	170	-177.7	169.3	64.9	-163.5	1.6	110.7	R179 E194 E195 E211 L213	R177-R179 PolarHBondContact O-N 3.28Å; R177-E194 CarbonylContact C-O 3.41Å; R177-E194 VanDerWaalsContact CA-O 3.32Å; R177-E194 WeakPolarHBondContact CA-O 3.35Å; R177-E195 HydrophobicContact CB-CG 3.94Å; R177-E195 HydrophobicContact CG-CG 3.98Å; R177-E211 HydrophobicContact CB-CB 4.32Å; R177-E211 IonicContact CZ-OE1 3.38Å; R177-E211 IonicContact CZ-OE2 3.78Å; R177-E211 PolarHBondContact N-O 3.21Å; R177-E211 IonicContact NE-OE2 2.78Å; R177-E211 PolarHBondContact NE-OE2 3.21Å; R177-E211 IonicContact NH2-OE1 3.09Å; R177-E211 PolarHBondContact NH2-OE1 3.37Å; R177-E211 IonicContact NH2-OE2 2.69Å; R177-E211 PolarHBondContact NH2-OE2 3.28Å; R177-E211 WeakPolarHBondContact O-CB 3.24Å; R177-E211 PolarHBondContact O-N 2.8Å; R177-L213 HydrophobicContact CB-CD1 3.94Å; R177-L213 HydrophobicContact CB-CD2 4.4Å; R177-L213 HydrophobicContact CB-CG 4.15Å
178	A	95.1	Very high	91.9	Very high	1 Å²	1	73.7 Å²	73.7	1%	0.008	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	120	175.5	0	0	0	0	0	110.9	R190 V191 G193 E194 W196	A178-R190 HydrophobicContact CB-CB 4.16Å; A178-V191 VanDerWaalsContact CB-O 3.29Å; A178-V191 WeakPolarHBondContact CB-O 3.36Å; A178-G193 PolarHBondContact O-N 3.1Å; A178-E194 PolarHBondContact N-O 2.76Å; A178-W196 HydrophobicContact CB-CH2 3.95Å; A178-W196 HydrophobicContact CB-CZ3 3.66Å
179	R	91.8	Very high	91.8	Very high	122 Å²	122	79.5 Å²	79.5	46%	0.46	36%	0.359	S	S	.	.	S	Bend	trans	-74.6	-29.5	173.1	-68.1	-174.8	171.3	175.7	1.4	112.7	R177 F209 E211	R177-R179 PolarHBondContact O-N 3.28Å; R179-F209 PolarHBondContact N-O 3.29Å; R179-E211 HydrophobicContact CG-CB 3.97Å
180	K	90.1	Very high	91.8	Very high	103 Å²	103	72.2 Å²	72.2	45%	0.448	33%	0.332	S	S	.	.	S	Bend	trans	-144.5	170.4	178	-68.4	-175.6	-177.8	171.6	0	108.6	C182 T192 F209	K180-C182 PolarHBondContact O-N 2.82Å; K180-T192 WeakPolarHBondContact CA-OG1 3.3Å; K180-F209 HydrophobicContact CB-CB 4.49Å; K180-F209 HydrophobicContact CB-CD1 4.37Å; K180-F209 HydrophobicContact CB-CG 4.29Å; K180-F209 HydrophobicContact CD-CD1 4.07Å; K180-F209 HydrophobicContact CD-CE1 3.97Å; K180-F209 HydrophobicContact CD-CZ 4.5Å; K180-F209 HydrophobicContact CG-CD1 4.38Å
181	E	91.6	Very high	91.9	Very high	147 Å²	147	69.5 Å²	69.5	69%	0.687	32%	0.324	S	S	*	.	S	Bend	trans	-57.7	120.2	168	-68.7	174.3	-178.3	0	0	109.4	R190 T192	E181-R190 WeakPolarHBondContact CA-O 3.4Å; E181-T192 PolarHBondContact N-OG1 3.22Å
182	C	90.3	Very high	91.9	Very high	15 Å²	15	70.1 Å²	70.1	10%	0.101	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	167.8	-175.4	66.8	0	0	0	0	111.3	K180 R190 F209	K180-C182 PolarHBondContact O-N 2.82Å; C182-R190 PolarHBondContact N-O 3.04Å; C182-R190 VanDerWaalsContact N-O 3.08Å; C182-R190 PolarHBondContact O-N 3.14Å; C182-F209 HydrophobicContact CB-CB 4.06Å; C182-F209 HydrophobicContact CB-CD2 4.17Å
183	W	89.7	Confident	91.8	Very high	173 Å²	173	70.6 Å²	70.6	66%	0.655	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.9	127.6	170.8	-63.2	82.2	0	0	0	107.5	G187 E189	W183-G187 WeakPolarHBondContact CZ3-O 3.33Å; W183-E189 HydrophobicContact CE3-CB 4.35Å; W183-E189 HydrophobicContact CH2-CB 4.25Å; W183-E189 HydrophobicContact CZ3-CB 4.12Å
184	D	89.4	Confident	91.7	Very high	9 Å²	9	72.6 Å²	72.6	5%	0.048	35%	0.354	C	S	.	.			trans	-71.3	172.4	172.4	72.5	16.4	0	0	0	111.1	D186 G187 K188 R190 W196	D184-D186 PolarHBondContact O-N 3.31Å; D184-D186 WeakPolarHBondContact OD1-CA 3.28Å; D184-D186 PolarHBondContact OD1-N 3.24Å; D184-G187 PolarHBondContact O-N 3.35Å; D184-G187 PolarHBondContact OD1-N 2.95Å; D184-K188 PolarHBondContact N-O 3.26Å; D184-K188 PolarHBondContact OD1-N 3.07Å; D184-K188 WeakPolarHBondContact OD2-CB 3.09Å; D184-R190 HydrophobicContact CB-CG 4.02Å; D184-R190 IonicContact OD2-CZ 3.47Å; D184-R190 IonicContact OD2-NE 2.92Å; D184-R190 PolarHBondContact OD2-NE 3.22Å; D184-R190 IonicContact OD2-NH2 3.51Å; D184-R190 PolarHBondContact OD2-NH2 3.49Å; D184-W196 HydrophobicContact CB-CZ2 4.11Å
185	R	86.1	Confident	91.7	Very high	120 Å²	120	74.9 Å²	74.9	45%	0.453	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-17.8	-178.6	-169	166.1	-93.2	156.6	-4.2	114.1	E146 G187 Y204 L205	E146-R185 IonicContact OE1-NH2 3.69Å; R185-G187 VanDerWaalsContact C-N 3.32Å; R185-Y204 HydrophobicContact CB-CE2 4.47Å; R185-L205 VanDerWaalsContact CZ-O 3.23Å; R185-L205 PolarHBondContact NH1-O 3.21Å; R185-L205 PolarHBondContact NH2-O 2.88Å
186	D	84.8	Confident	91.6	Very high	133 Å²	133	72.9 Å²	72.9	71%	0.711	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	1	174.4	-63.2	-38.9	0	0	0	112.3	D184	D184-D186 PolarHBondContact O-N 3.31Å; D184-D186 WeakPolarHBondContact OD1-CA 3.28Å; D184-D186 PolarHBondContact OD1-N 3.24Å
187	G	87.3	Confident	91.5	Very high	49 Å²	49	74.2 Å²	74.2	51%	0.505	36%	0.364	S	S	.	.	S	Bend	trans	80.6	19.8	178.4	0	0	0	0	0	114.1	W183 D184 R185	W183-G187 WeakPolarHBondContact CZ3-O 3.33Å; D184-G187 PolarHBondContact O-N 3.35Å; D184-G187 PolarHBondContact OD1-N 2.95Å; R185-G187 VanDerWaalsContact C-N 3.32Å
188	K	89.7	Confident	91.4	Very high	119 Å²	119	70.7 Å²	70.7	52%	0.517	35%	0.352	S	S	.	.			trans	-92.7	135.7	174.8	-167.1	179.5	173.1	-163.4	0	110.3	D184	D184-K188 PolarHBondContact N-O 3.26Å; D184-K188 PolarHBondContact OD1-N 3.07Å; D184-K188 WeakPolarHBondContact OD2-CB 3.09Å
189	E	92.8	Very high	91.2	Very high	125 Å²	125	75.1 Å²	75.1	58%	0.584	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.2	131.6	175.6	-171.5	175.6	-158.8	0	0	110.4	W183	W183-E189 HydrophobicContact CE3-CB 4.35Å; W183-E189 HydrophobicContact CH2-CB 4.25Å; W183-E189 HydrophobicContact CZ3-CB 4.12Å
190	R	93.6	Very high	91.2	Very high	19 Å²	19	73.7 Å²	73.7	7%	0.072	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	129.7	179.7	-58.2	-58.9	-179.9	159.9	11.5	110.2	A178 E181 C182 D184 E194 W196	A178-R190 HydrophobicContact CB-CB 4.16Å; E181-R190 WeakPolarHBondContact CA-O 3.4Å; C182-R190 PolarHBondContact N-O 3.04Å; C182-R190 VanDerWaalsContact N-O 3.08Å; C182-R190 PolarHBondContact O-N 3.14Å; D184-R190 HydrophobicContact CB-CG 4.02Å; D184-R190 IonicContact OD2-CZ 3.47Å; D184-R190 IonicContact OD2-NE 2.92Å; D184-R190 PolarHBondContact OD2-NE 3.22Å; D184-R190 IonicContact OD2-NH2 3.51Å; D184-R190 PolarHBondContact OD2-NH2 3.49Å; R190-E194 WeakPolarHBondContact CA-OE2 3.48Å; R190-E194 WeakPolarHBondContact CD-OE1 3.4Å; R190-E194 IonicContact CZ-OE1 3.19Å; R190-E194 IonicContact NE-OE1 2.83Å; R190-E194 IonicContact NH1-OE1 2.7Å; R190-E194 PolarHBondContact NH1-OE1 3.5Å; R190-W196 HydrophobicContact CB-CH2 4.17Å; R190-W196 HydrophobicContact CB-CZ3 3.96Å; R190-W196 HydrophobicContact CG-CD2 4.35Å; R190-W196 HydrophobicContact CG-CE3 4.05Å; R190-W196 HydrophobicContact CG-CH2 3.88Å; R190-W196 HydrophobicContact CG-CZ2 4.16Å; R190-W196 HydrophobicContact CG-CZ3 3.81Å
191	V	93.8	Very high	91.3	Very high	81 Å²	81	72.5 Å²	72.5	49%	0.491	39%	0.385	S	S	.	.			trans	-86.9	157.5	177	-59.7	0	0	0	0	111.5	A178 G193 E194	A178-V191 VanDerWaalsContact CB-O 3.29Å; A178-V191 WeakPolarHBondContact CB-O 3.36Å; V191-G193 PolarHBondContact O-N 3.25Å; V191-E194 HydrophobicContact CG2-CB 3.87Å; V191-E194 PolarHBondContact N-OE2 3.37Å; V191-E194 WeakPolarHBondContact O-CB 3.28Å; V191-E194 PolarHBondContact O-N 3.36Å
192	T	93.3	Very high	91.4	Very high	88 Å²	88	67 Å²	67	54%	0.54	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	127	179.8	-57.2	0	0	0	0	111.5	K180 E181 E194	K180-T192 WeakPolarHBondContact CA-OG1 3.3Å; E181-T192 PolarHBondContact N-OG1 3.22Å; T192-E194 VanDerWaalsContact C-N 3.27Å; T192-E194 PolarHBondContact O-N 3.42Å
193	G	91.2	Very high	91.5	Very high	44 Å²	44	68.5 Å²	68.5	45%	0.454	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.2	0.3	-177.7	0	0	0	0	0	114.9	A178 V191	A178-G193 PolarHBondContact O-N 3.1Å; V191-G193 PolarHBondContact O-N 3.25Å
194	E	93.4	Very high	91.7	Very high	42 Å²	42	61 Å²	61	20%	0.196	35%	0.353	C	S	.	.			trans	-64.8	142.5	170	-170.1	-179.6	155.8	0	0	110.3	R177 A178 R190 V191 T192 W196	R177-E194 CarbonylContact C-O 3.41Å; R177-E194 VanDerWaalsContact CA-O 3.32Å; R177-E194 WeakPolarHBondContact CA-O 3.35Å; A178-E194 PolarHBondContact N-O 2.76Å; R190-E194 WeakPolarHBondContact CA-OE2 3.48Å; R190-E194 WeakPolarHBondContact CD-OE1 3.4Å; R190-E194 IonicContact CZ-OE1 3.19Å; R190-E194 IonicContact NE-OE1 2.83Å; R190-E194 IonicContact NH1-OE1 2.7Å; R190-E194 PolarHBondContact NH1-OE1 3.5Å; V191-E194 HydrophobicContact CG2-CB 3.87Å; V191-E194 PolarHBondContact N-OE2 3.37Å; V191-E194 WeakPolarHBondContact O-CB 3.28Å; V191-E194 PolarHBondContact O-N 3.36Å; T192-E194 VanDerWaalsContact C-N 3.27Å; T192-E194 PolarHBondContact O-N 3.42Å; E194-W196 WeakPolarHBondContact O-CZ3 3.17Å
195	E	94.3	Very high	91.9	Very high	49 Å²	49	61.2 Å²	61.2	23%	0.229	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	141.6	177.5	-70.8	174.9	-171.6	0	0	110	R175 L176 R177 L213 V263	R175-E195 IonicContact CZ-OE2 3.52Å; R175-E195 IonicContact NE-OE2 2.8Å; R175-E195 PolarHBondContact NE-OE2 3.46Å; R175-E195 IonicContact NH2-OE2 3.98Å; R175-E195 PolarHBondContact NH2-OE2 2.86Å; L176-E195 WeakPolarHBondContact O-CA 3.33Å; R177-E195 HydrophobicContact CB-CG 3.94Å; R177-E195 HydrophobicContact CG-CG 3.98Å; E195-L213 HydrophobicContact CG-CD1 4.12Å; E195-V263 HydrophobicContact CB-CG1 3.61Å; E195-V263 HydrophobicContact CB-CG2 4.31Å
196	W	94	Very high	92.3	Very high	11 Å²	11	55.9 Å²	55.9	4%	0.042	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	167.9	176.9	67.1	98.4	0	0	0	111.4	R175 L176 A178 D184 R190 E194 E210	R175-W196 WeakPolarHBondContact CA-O 3.43Å; L176-W196 HydrophobicContact CB-CD2 4.22Å; L176-W196 HydrophobicContact CB-CH2 4.28Å; L176-W196 HydrophobicContact CB-CZ2 3.85Å; L176-W196 HydrophobicContact CD1-CZ2 4.01Å; L176-W196 PolarHBondContact N-O 2.83Å; L176-W196 PolarHBondContact O-N 3.43Å; L176-W196 VanDerWaalsContact O-N 3.09Å; A178-W196 HydrophobicContact CB-CH2 3.95Å; A178-W196 HydrophobicContact CB-CZ3 3.66Å; D184-W196 HydrophobicContact CB-CZ2 4.11Å; R190-W196 HydrophobicContact CB-CH2 4.17Å; R190-W196 HydrophobicContact CB-CZ3 3.96Å; R190-W196 HydrophobicContact CG-CD2 4.35Å; R190-W196 HydrophobicContact CG-CE3 4.05Å; R190-W196 HydrophobicContact CG-CH2 3.88Å; R190-W196 HydrophobicContact CG-CZ2 4.16Å; R190-W196 HydrophobicContact CG-CZ3 3.81Å; E194-W196 WeakPolarHBondContact O-CZ3 3.17Å; W196-E210 HydrophobicContact CH2-CG 4.16Å; W196-E210 HydrophobicContact CZ2-CG 3.89Å
197	L	93.9	Very high	92.6	Very high	28 Å²	28	51.2 Å²	51.2	15%	0.147	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	144.9	176.1	-64.2	-174.6	0	0	0	111.9	A173 L174 R175 V216 V260 P261 V263	A173-L197 HydrophobicContact CB-CB 4.09Å; A173-L197 HydrophobicContact CB-CD1 4.12Å; A173-L197 HydrophobicContact CB-CD2 4.39Å; A173-L197 HydrophobicContact CB-CG 4.43Å; L174-L197 CarbonylContact O-C 3.6Å; L174-L197 WeakPolarHBondContact O-CA 3.49Å; R175-L197 HydrophobicContact CB-CD2 3.64Å; R175-L197 HydrophobicContact CG-CD2 3.9Å; L197-V216 HydrophobicContact CD2-CG2 3.97Å; L197-V260 HydrophobicContact CD1-CG1 3.89Å; L197-P261 WeakPolarHBondContact CD1-O 3.34Å; L197-V263 HydrophobicContact CD2-CG2 4.2Å; L197-V263 HydrophobicContact CG-CG2 4.01Å
198	V	94.1	Very high	92.8	Very high	6 Å²	6	49.7 Å²	49.7	4%	0.036	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	120.2	166.8	179	0	0	0	0	108.7	I168 A173 L174 L176 Y204	I168-V198 HydrophobicContact CD1-CB 4.34Å; I168-V198 HydrophobicContact CD1-CG1 4.05Å; A173-V198 CarbonylContact C-O 3.59Å; A173-V198 VanDerWaalsContact CA-O 3.23Å; A173-V198 WeakPolarHBondContact CA-O 3.29Å; A173-V198 WeakPolarHBondContact CB-O 3.28Å; L174-V198 HydrophobicContact CB-CB 4.42Å; L174-V198 PolarHBondContact N-O 3.31Å; L174-V198 PolarHBondContact O-N 3.34Å; L176-V198 HydrophobicContact CD1-CG2 3.56Å; L176-V198 HydrophobicContact CG-CG2 4.28Å; V198-Y204 HydrophobicContact CB-CE2 4.39Å; V198-Y204 HydrophobicContact CG1-CD2 3.69Å; V198-Y204 HydrophobicContact CG1-CE2 3.7Å; V198-Y204 HydrophobicContact CG1-CG 4.36Å; V198-Y204 HydrophobicContact CG2-CE1 4.45Å; V198-Y204 HydrophobicContact CG2-CE2 4.03Å
199	T	90.6	Very high	93	Very high	94 Å²	94	46.6 Å²	46.6	58%	0.577	28%	0.282	S	S	*	.			trans	-103	-3.7	-176.2	53.6	0	0	0	0	113.5	A173 V201	A173-T199 HydrophobicContact CB-CG2 3.95Å; T199-V201 PolarHBondContact O-N 2.68Å; T199-V201 VanDerWaalsContact O-N 3.14Å
200	T	90.5	Very high	93	Very high	92 Å²	92	41 Å²	41	56%	0.564	26%	0.256	S	S	*	.			trans	-66.3	111.8	-179.7	-52.1	0	0	0	0	110.6	G202	T200-G202 PolarHBondContact O-N 3.15Å
201	V	93.1	Very high	93.1	Very high	78 Å²	78	42.5 Å²	42.5	47%	0.473	26%	0.264	S	S	.	.			trans	-65.4	132.5	-179.6	-179.9	0	0	0	0	110.4	I168 T199	I168-V201 WeakPolarHBondContact O-CG1 3.3Å; T199-V201 PolarHBondContact O-N 2.68Å; T199-V201 VanDerWaalsContact O-N 3.14Å
202	G	92.9	Very high	93.1	Very high	31 Å²	31	41.2 Å²	41.2	32%	0.32	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	134.1	-167.5	-179.1	0	0	0	0	0	113.1	I168 T200 Y204	I168-G202 PolarHBondContact N-O 3.21Å; I168-G202 PolarHBondContact O-N 3.28Å; T200-G202 PolarHBondContact O-N 3.15Å; G202-Y204 PolarHBondContact O-N 2.96Å
203	A	93.3	Very high	93.2	Very high	47 Å²	47	39.9 Å²	39.9	39%	0.388	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	111.8	175.5	0	0	0	0	0	109.6	N118 A165	N118-A203 HydrophobicContact CB-CB 4.43Å; A165-A203 HydrophobicContact CB-CB 3.89Å
204	Y	94.4	Very high	93.3	Very high	15 Å²	15	41.4 Å²	41.4	6%	0.059	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	113.1	176	-173.1	-93.4	0	0	0	110.5	A165 T166 I168 L174 L176 R185 V198 G202 P206 E210	A165-Y204 CarbonylContact C-O 3.51Å; A165-Y204 VanDerWaalsContact CA-O 3.23Å; A165-Y204 WeakPolarHBondContact CA-O 3.24Å; T166-Y204 PolarHBondContact N-O 3.22Å; T166-Y204 PolarHBondContact O-N 3.44Å; I168-Y204 HydrophobicContact CD1-CG 4.37Å; L174-Y204 HydrophobicContact CD2-CD1 3.61Å; L174-Y204 HydrophobicContact CD2-CE1 4.35Å; L174-Y204 HydrophobicContact CD2-CG 4.2Å; L176-Y204 HydrophobicContact CD1-CE1 3.56Å; L176-Y204 WeakPolarHBondContact CD1-OH 3.23Å; L176-Y204 HydrophobicContact CD2-CE1 4.35Å; R185-Y204 HydrophobicContact CB-CE2 4.47Å; V198-Y204 HydrophobicContact CB-CE2 4.39Å; V198-Y204 HydrophobicContact CG1-CD2 3.69Å; V198-Y204 HydrophobicContact CG1-CE2 3.7Å; V198-Y204 HydrophobicContact CG1-CG 4.36Å; V198-Y204 HydrophobicContact CG2-CE1 4.45Å; V198-Y204 HydrophobicContact CG2-CE2 4.03Å; G202-Y204 PolarHBondContact O-N 2.96Å; Y204-P206 HydrophobicContact CE1-CB 4.37Å; Y204-P206 WeakPolarHBondContact O-CD 3.47Å; Y204-E210 PolarHBondContact OH-OE1 2.98Å; Y204-E210 PolarHBondContact OH-OE2 3.43Å
205	L	93.4	Very high	93.4	Very high	15 Å²	15	42.7 Å²	42.7	8%	0.079	25%	0.251	C	S	.	.			trans	-89.5	110.4	174.7	-173.4	68	0	0	0	109.2	A120 E146 I163 A165 R185	A120-L205 HydrophobicContact CB-CD1 4.25Å; A120-L205 HydrophobicContact CB-CD2 3.91Å; A120-L205 HydrophobicContact CB-CG 4.42Å; E146-L205 HydrophobicContact CB-CD2 4.44Å; E146-L205 HydrophobicContact CG-CD2 3.98Å; I163-L205 HydrophobicContact CG2-CD1 4.03Å; A165-L205 HydrophobicContact CB-CB 4.08Å; A165-L205 HydrophobicContact CB-CD1 4.15Å; R185-L205 VanDerWaalsContact CZ-O 3.23Å; R185-L205 PolarHBondContact NH1-O 3.21Å; R185-L205 PolarHBondContact NH2-O 2.88Å
206	P	93.4	Very high	93.4	Very high	8 Å²	8	41.7 Å²	41.7	5%	0.052	25%	0.248	C	C	.	.			trans	-66.1	144.6	-176.4	28.8	-34.9	0	0	0	110.9	L144 I163 Y204 E210 V212	L144-P206 VanDerWaalsContact CD1-O 3.26Å; L144-P206 WeakPolarHBondContact CD1-O 3.43Å; I163-P206 HydrophobicContact CG2-CG 3.6Å; Y204-P206 HydrophobicContact CE1-CB 4.37Å; Y204-P206 WeakPolarHBondContact O-CD 3.47Å; P206-E210 HydrophobicContact CB-CB 4.13Å; P206-V212 HydrophobicContact CB-CG2 3.69Å; P206-V212 HydrophobicContact CG-CG2 3.69Å
207	A	92.2	Very high	93.4	Very high	34 Å²	34	46 Å²	46	28%	0.281	27%	0.272	S	S	.	.			trans	-69.7	166.7	170.7	0	0	0	0	0	111.1	F209 E210	A207-F209 PolarHBondContact O-N 2.98Å; A207-F209 VanDerWaalsContact O-N 3.14Å; A207-E210 HydrophobicContact CB-CB 4.44Å; A207-E210 HydrophobicContact CB-CG 3.92Å; A207-E210 PolarHBondContact N-OE2 3.16Å; A207-E210 PolarHBondContact O-N 2.99Å
208	V	92	Very high	93.4	Very high	18 Å²	18	45.4 Å²	45.4	11%	0.109	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.3	-44.5	-176.5	-172.6	0	0	0	0	113.4	E142 W143 L144	E142-V208 HydrophobicContact CB-CG1 3.44Å; E142-V208 VanDerWaalsContact CB-CG1 3.44Å; W143-V208 VanDerWaalsContact CA-CG2 3.45Å; L144-V208 HydrophobicContact CD1-CG2 4.47Å; L144-V208 HydrophobicContact CD2-CG2 4.05Å; L144-V208 HydrophobicContact CG-CG2 3.68Å
209	F	92.6	Very high	93.4	Very high	53 Å²	53	47.1 Å²	47.1	23%	0.232	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	6	-173.9	-52.5	-51.6	0	0	0	112.7	E142 R179 K180 C182 A207	E142-F209 HydrophobicContact CB-CE1 4.18Å; E142-F209 HydrophobicContact CB-CZ 4.36Å; R179-F209 PolarHBondContact N-O 3.29Å; K180-F209 HydrophobicContact CB-CB 4.49Å; K180-F209 HydrophobicContact CB-CD1 4.37Å; K180-F209 HydrophobicContact CB-CG 4.29Å; K180-F209 HydrophobicContact CD-CD1 4.07Å; K180-F209 HydrophobicContact CD-CE1 3.97Å; K180-F209 HydrophobicContact CD-CZ 4.5Å; K180-F209 HydrophobicContact CG-CD1 4.38Å; C182-F209 HydrophobicContact CB-CB 4.06Å; C182-F209 HydrophobicContact CB-CD2 4.17Å; A207-F209 PolarHBondContact O-N 2.98Å; A207-F209 VanDerWaalsContact O-N 3.14Å
210	E	93.9	Very high	93.5	Very high	9 Å²	9	48.5 Å²	48.5	4%	0.042	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	110.9	174.8	-67.1	177	162.9	0	0	109.2	L176 W196 Y204 P206 A207	L176-E210 HydrophobicContact CD1-CB 4.39Å; L176-E210 HydrophobicContact CD1-CG 4.4Å; W196-E210 HydrophobicContact CH2-CG 4.16Å; W196-E210 HydrophobicContact CZ2-CG 3.89Å; Y204-E210 PolarHBondContact OH-OE1 2.98Å; Y204-E210 PolarHBondContact OH-OE2 3.43Å; P206-E210 HydrophobicContact CB-CB 4.13Å; A207-E210 HydrophobicContact CB-CB 4.44Å; A207-E210 HydrophobicContact CB-CG 3.92Å; A207-E210 PolarHBondContact N-OE2 3.16Å; A207-E210 PolarHBondContact O-N 2.99Å
211	E	93.9	Very high	93.6	Very high	50 Å²	50	44.5 Å²	44.5	23%	0.234	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	119.8	171.5	-173.5	-177.2	-176.2	0	0	109.5	L176 R177 R179 L213	L176-E211 CarbonylContact C-O 3.51Å; L176-E211 WeakPolarHBondContact CA-O 3.31Å; R177-E211 HydrophobicContact CB-CB 4.32Å; R177-E211 IonicContact CZ-OE1 3.38Å; R177-E211 IonicContact CZ-OE2 3.78Å; R177-E211 PolarHBondContact N-O 3.21Å; R177-E211 IonicContact NE-OE2 2.78Å; R177-E211 PolarHBondContact NE-OE2 3.21Å; R177-E211 IonicContact NH2-OE1 3.09Å; R177-E211 PolarHBondContact NH2-OE1 3.37Å; R177-E211 IonicContact NH2-OE2 2.69Å; R177-E211 PolarHBondContact NH2-OE2 3.28Å; R177-E211 WeakPolarHBondContact O-CB 3.24Å; R177-E211 PolarHBondContact O-N 2.8Å; R179-E211 HydrophobicContact CG-CB 3.97Å; E211-L213 HydrophobicContact CG-CD2 4.41Å; E211-L213 PolarHBondContact O-N 3.29Å
212	V	94.9	Very high	93.6	Very high	53 Å²	53	43.8 Å²	43.8	32%	0.321	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	123	174.1	-179.7	0	0	0	0	109.7	L174 L176 P206	L174-V212 HydrophobicContact CD1-CG1 3.66Å; L174-V212 HydrophobicContact CD2-CG1 4.3Å; L174-V212 HydrophobicContact CD2-CG2 4.41Å; L174-V212 HydrophobicContact CG-CG1 4.25Å; L176-V212 HydrophobicContact CD2-CB 4.35Å; L176-V212 HydrophobicContact CD2-CG2 3.84Å; P206-V212 HydrophobicContact CB-CG2 3.69Å; P206-V212 HydrophobicContact CG-CG2 3.69Å
213	L	94.9	Very high	93.5	Very high	60 Å²	60	49.8 Å²	49.8	31%	0.314	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	-77.5	179.2	-64.5	-178.9	0	0	0	111.7	R175 R177 E195 E211	R175-L213 HydrophobicContact CB-CB 4.35Å; R175-L213 HydrophobicContact CG-CB 4.46Å; R175-L213 HydrophobicContact CG-CD1 4.15Å; R175-L213 PolarHBondContact O-N 3.02Å; R177-L213 HydrophobicContact CB-CD1 3.94Å; R177-L213 HydrophobicContact CB-CD2 4.4Å; R177-L213 HydrophobicContact CB-CG 4.15Å; E195-L213 HydrophobicContact CG-CD1 4.12Å; E211-L213 HydrophobicContact CG-CD2 4.41Å; E211-L213 PolarHBondContact O-N 3.29Å
214	D	94.4	Very high	93.5	Very high	77 Å²	77	54.7 Å²	54.7	41%	0.412	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	162	-174.9	58.1	-8.5	0	0	0	112.4	R175	R175-D214 WeakPolarHBondContact CB-O 3.23Å; R175-D214 WeakPolarHBondContact CB-OD1 3.43Å; R175-D214 WeakPolarHBondContact CD-OD1 3.49Å; R175-D214 PolarHBondContact N-O 3.3Å
215	L	94.3	Very high	93.6	Very high	69 Å²	69	55.7 Å²	55.7	36%	0.361	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	128.4	168.7	-76.2	167.7	0	0	0	108.6	T166 I168 A173 L174	T166-L215 HydrophobicContact CG2-CD1 4.35Å; T166-L215 HydrophobicContact CG2-CD2 4.34Å; T166-L215 HydrophobicContact CG2-CG 4.41Å; I168-L215 HydrophobicContact CG1-CD2 4.29Å; A173-L215 CarbonylContact O-C 3.49Å; A173-L215 WeakPolarHBondContact O-CA 3.48Å; L174-L215 HydrophobicContact CB-CD2 4.25Å; L174-L215 HydrophobicContact CD1-CD2 3.73Å; L174-L215 HydrophobicContact CD1-CG 4.11Å
216	V	94.7	Very high	93.7	Very high	27 Å²	27	55 Å²	55	16%	0.164	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	117.8	178.7	-173.6	0	0	0	0	108.8	Q172 A173 R175 L197 V260	Q172-V216 CarbonylContact C-O 3.58Å; Q172-V216 WeakPolarHBondContact CA-O 3.12Å; A173-V216 PolarHBondContact N-O 3.43Å; A173-V216 PolarHBondContact O-N 3Å; R175-V216 HydrophobicContact CB-CG2 4.38Å; L197-V216 HydrophobicContact CD2-CG2 3.97Å; V216-V260 HydrophobicContact CB-CG1 4.02Å; V216-V260 HydrophobicContact CG1-CG1 3.74Å
217	D	93.8	Very high	93.8	Very high	101 Å²	101	54.6 Å²	54.6	54%	0.54	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	143.6	175.4	-67.7	-42.2	0	0	0	111.2	Q172	Q172-D217 VanDerWaalsContact CG-OD1 3.32Å; Q172-D217 WeakPolarHBondContact CG-OD1 3.31Å; Q172-D217 PolarHBondContact NE2-OD1 3.45Å
218	A	93.6	Very high	94	Very high	16 Å²	16	54.5 Å²	54.5	13%	0.132	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-71.3	139	171.6	0	0	0	0	0	111	N171 I220 A258 H259 V260	N171-A218 HydrophobicContact CB-CB 3.84Å; N171-A218 WeakPolarHBondContact O-CB 3.41Å; N171-A218 PolarHBondContact O-N 3.09Å; A218-I220 PolarHBondContact O-N 2.96Å; A218-A258 HydrophobicContact CB-CB 3.87Å; A218-H259 CarbonylContact C-O 3.58Å; A218-H259 WeakPolarHBondContact CA-O 3.4Å; A218-V260 HydrophobicContact CB-CG2 3.53Å
219	V	93.9	Very high	94.1	Very high	43 Å²	43	53.6 Å²	53.6	26%	0.261	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	119.5	166.9	-174.1	0	0	0	0	108.4	L221 L227 A258 H259 P261 V270	V219-L221 HydrophobicContact CG1-CD2 4.07Å; V219-L221 PolarHBondContact O-N 2.93Å; V219-L227 HydrophobicContact CB-CD1 4.33Å; V219-L227 HydrophobicContact CB-CD2 4.23Å; V219-L227 HydrophobicContact CG1-CD1 4.13Å; V219-L227 HydrophobicContact CG2-CD1 4.14Å; V219-L227 HydrophobicContact CG2-CD2 4.29Å; V219-A258 WeakPolarHBondContact O-CA 3.23Å; V219-H259 PolarHBondContact N-O 3.04Å; V219-H259 PolarHBondContact O-N 3.44Å; V219-P261 HydrophobicContact CG2-CG 4.34Å; V219-V270 HydrophobicContact CG1-CG2 4.44Å
220	I	92.7	Very high	94.3	Very high	123 Å²	123	55 Å²	55	63%	0.631	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.3	121.7	177.8	-54.9	172.3	0	0	0	108.7	A218	A218-I220 PolarHBondContact O-N 2.96Å
221	L	93.1	Very high	94.3	Very high	7 Å²	7	54.6 Å²	54.6	4%	0.037	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-100.4	148.1	-179.6	-53.5	-178.9	0	0	0	110.2	V219 L227 V251 E257 H259	V219-L221 HydrophobicContact CG1-CD2 4.07Å; V219-L221 PolarHBondContact O-N 2.93Å; L221-L227 HydrophobicContact CD1-CB 4.45Å; L221-L227 HydrophobicContact CD2-CB 3.79Å; L221-V251 HydrophobicContact CD1-CB 4.18Å; L221-V251 HydrophobicContact CD1-CG1 3.74Å; L221-E257 PolarHBondContact N-O 3.18Å; L221-H259 HydrophobicContact CD1-CB 4.31Å
222	T	93	Very high	94.2	Very high	64 Å²	64	58.3 Å²	58.3	39%	0.393	29%	0.292	S	S	.	.	B	Isolated β-bridge	trans	-129.2	170.6	178.2	67.3	0	0	0	0	109.1	K224 T225	T222-K224 PolarHBondContact O-N 3.44Å; T222-K224 PolarHBondContact OG1-N 3.3Å; T222-T225 PolarHBondContact N-OG1 2.61Å; T222-T225 PolarHBondContact O-N 3.27Å; T222-T225 VanDerWaalsContact O-N 3.1Å; T222-T225 PolarHBondContact OG1-N 3.33Å; T222-T225 PolarHBondContact OG1-OG1 2.56Å
223	E	91.8	Very high	94	Very high	157 Å²	157	63.9 Å²	63.9	73%	0.734	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-17	171.1	-63.3	-179.6	173.4	0	0	113.1	V253 I273	E223-V253 HydrophobicContact CG-CG1 4.09Å; E223-I273 VanDerWaalsContact O-CD1 3.25Å; E223-I273 WeakPolarHBondContact O-CD1 3.34Å
224	K	93.5	Very high	93.9	Very high	149 Å²	149	66.5 Å²	66.5	65%	0.648	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	-4.7	-179	-60	-176.4	-179	-178.6	0	114.1	T222 I273	T222-K224 PolarHBondContact O-N 3.44Å; T222-K224 PolarHBondContact OG1-N 3.3Å; K224-I273 HydrophobicContact CB-CG2 3.92Å; K224-I273 HydrophobicContact CG-CG2 4.11Å; K224-I273 PolarHBondContact O-N 2.84Å
225	T	94.8	Very high	93.9	Very high	37 Å²	37	64 Å²	64	23%	0.227	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	133.8	-174.4	53.6	0	0	0	0	111.5	T222 V270	T222-T225 PolarHBondContact N-OG1 2.61Å; T222-T225 PolarHBondContact O-N 3.27Å; T222-T225 VanDerWaalsContact O-N 3.1Å; T222-T225 PolarHBondContact OG1-N 3.33Å; T222-T225 PolarHBondContact OG1-OG1 2.56Å; T225-V270 HydrophobicContact CG2-CG1 3.96Å
226	A	95.4	Very high	93.7	Very high	0 Å²	0	69.4 Å²	69.4	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	148.9	171.6	0	0	0	0	0	110	L250 V251 T252 V270 V271 F309	A226-L250 HydrophobicContact CB-CB 4.33Å; A226-L250 HydrophobicContact CB-CD1 4.36Å; A226-V251 CarbonylContact C-O 3.58Å; A226-V251 VanDerWaalsContact CA-O 3.3Å; A226-V251 WeakPolarHBondContact CA-O 3.46Å; A226-T252 HydrophobicContact CB-CG2 4.05Å; A226-V270 CarbonylContact O-C 3.46Å; A226-V270 WeakPolarHBondContact O-CA 3.4Å; A226-V271 PolarHBondContact N-O 2.88Å; A226-V271 PolarHBondContact O-N 3.46Å; A226-F309 HydrophobicContact CB-CB 4.46Å; A226-F309 HydrophobicContact CB-CD1 3.59Å; A226-F309 HydrophobicContact CB-CD2 4.12Å; A226-F309 HydrophobicContact CB-CE1 3.72Å; A226-F309 HydrophobicContact CB-CE2 4.24Å; A226-F309 HydrophobicContact CB-CG 3.8Å; A226-F309 HydrophobicContact CB-CZ 4.05Å
227	L	96.1	Very high	93.5	Very high	0 Å²	0	68.5 Å²	68.5	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	123.3	177.2	-174.9	64	0	0	0	110.2	V219 L221 L229 L250 V251 H259 V267 V270	V219-L227 HydrophobicContact CB-CD1 4.33Å; V219-L227 HydrophobicContact CB-CD2 4.23Å; V219-L227 HydrophobicContact CG1-CD1 4.13Å; V219-L227 HydrophobicContact CG2-CD1 4.14Å; V219-L227 HydrophobicContact CG2-CD2 4.29Å; L221-L227 HydrophobicContact CD1-CB 4.45Å; L221-L227 HydrophobicContact CD2-CB 3.79Å; L227-L229 HydrophobicContact CD1-CD2 4.48Å; L227-L229 HydrophobicContact CD2-CD1 4.23Å; L227-L229 HydrophobicContact CD2-CD2 3.75Å; L227-L229 HydrophobicContact CD2-CG 4.12Å; L227-L229 HydrophobicContact CG-CD2 3.75Å; L227-L229 HydrophobicContact CG-CG 4.01Å; L227-L250 CarbonylContact O-C 3.59Å; L227-L250 VanDerWaalsContact O-CA 3.27Å; L227-L250 WeakPolarHBondContact O-CA 3.43Å; L227-V251 HydrophobicContact CB-CB 4.28Å; L227-V251 PolarHBondContact N-O 3.45Å; L227-V251 PolarHBondContact O-N 2.73Å; L227-H259 HydrophobicContact CD2-CB 4.11Å; L227-H259 VanDerWaalsContact CD2-CD2 3.5Å; L227-H259 WeakPolarHBondContact CD2-CD2 3.45Å; L227-V267 HydrophobicContact CD1-CG1 3.7Å; L227-V270 HydrophobicContact CD1-CG2 4.34Å
228	H	96.3	Very high	93	Very high	31 Å²	31	68.7 Å²	68.7	14%	0.144	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	116.6	176.9	-175.8	-170	0	0	0	110.1	E248 L250 L268 G269 V271	H228-E248 IonicContact CE1-OE2 2.75Å; H228-E248 PolarHBondContact CE1-OE2 2.95Å; H228-E248 IonicContact NE2-OE2 3.2Å; H228-E248 PolarHBondContact NE2-OE2 3.16Å; H228-L250 HydrophobicContact CB-CD2 3.67Å; H228-L268 HydrophobicContact CB-CB 4.45Å; H228-L268 WeakPolarHBondContact NE2-CD1 3.33Å; H228-L268 PolarHBondContact O-N 3.15Å; H228-G269 PolarHBondContact N-O 3.45Å; H228-V271 HydrophobicContact CB-CG2 3.89Å
229	L	95.1	Very high	92.6	Very high	0 Å²	0	71.5 Å²	71.5	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	151	-176.6	-61.9	179.8	0	0	0	111.2	L227 E248 W249 V251 E265 E266 V267	L227-L229 HydrophobicContact CD1-CD2 4.48Å; L227-L229 HydrophobicContact CD2-CD1 4.23Å; L227-L229 HydrophobicContact CD2-CD2 3.75Å; L227-L229 HydrophobicContact CD2-CG 4.12Å; L227-L229 HydrophobicContact CG-CD2 3.75Å; L227-L229 HydrophobicContact CG-CG 4.01Å; L229-E248 VanDerWaalsContact O-CA 3.23Å; L229-E248 WeakPolarHBondContact O-CA 3.43Å; L229-W249 HydrophobicContact CB-CD2 4.31Å; L229-W249 HydrophobicContact CB-CH2 4.29Å; L229-W249 HydrophobicContact CB-CZ2 3.81Å; L229-W249 HydrophobicContact CD1-CZ2 4.07Å; L229-W249 PolarHBondContact N-O 3.11Å; L229-W249 PolarHBondContact O-N 3.34Å; L229-V251 HydrophobicContact CD1-CG2 3.63Å; L229-V251 HydrophobicContact CG-CG2 4.44Å; L229-E265 HydrophobicContact CD1-CB 4.43Å; L229-E265 HydrophobicContact CD1-CG 4.36Å; L229-E265 HydrophobicContact CD2-CB 4.45Å; L229-E266 CarbonylContact C-O 3.56Å; L229-E266 WeakPolarHBondContact CA-O 3.24Å; L229-V267 HydrophobicContact CD2-CB 4.31Å; L229-V267 HydrophobicContact CD2-CG2 3.74Å
230	R	95.6	Very high	92.2	Very high	81 Å²	81	71.6 Å²	71.6	31%	0.306	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	136.2	170.4	-178.1	168.9	67.2	-169.4	2.2	110.7	R232 E247 E248 E266 L268	R230-R232 PolarHBondContact O-N 2.92Å; R230-E247 WeakPolarHBondContact CA-O 3.45Å; R230-E248 HydrophobicContact CB-CG 4.02Å; R230-E248 HydrophobicContact CG-CG 3.96Å; R230-E266 HydrophobicContact CB-CB 4.34Å; R230-E266 IonicContact CZ-OE2 2.64Å; R230-E266 PolarHBondContact N-O 3.27Å; R230-E266 IonicContact NE-OE2 3.34Å; R230-E266 PolarHBondContact NE-OE2 3.28Å; R230-E266 IonicContact NH2-OE1 3.74Å; R230-E266 PolarHBondContact NH2-OE1 3.14Å; R230-E266 VanDerWaalsContact NH2-OE1 3.11Å; R230-E266 IonicContact NH2-OE2 2.74Å; R230-E266 PolarHBondContact NH2-OE2 3.38Å; R230-E266 PolarHBondContact O-N 3.4Å; R230-L268 HydrophobicContact CB-CD1 3.91Å; R230-L268 HydrophobicContact CB-CG 4.15Å
231	A	94.7	Very high	92.1	Very high	2 Å²	2	68.7 Å²	68.7	2%	0.017	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	122	176.8	0	0	0	0	0	111.4	F235 R243 R244 G246 E247 W249	A231-F235 HydrophobicContact CB-CD1 4.44Å; A231-F235 HydrophobicContact CB-CE1 3.95Å; A231-R243 HydrophobicContact CB-CB 4.06Å; A231-R244 VanDerWaalsContact CB-O 3.24Å; A231-R244 WeakPolarHBondContact CB-O 3.46Å; A231-G246 PolarHBondContact O-N 3.34Å; A231-E247 PolarHBondContact N-O 3.1Å; A231-W249 HydrophobicContact CB-CH2 3.88Å; A231-W249 HydrophobicContact CB-CZ3 3.61Å
232	R	92.8	Very high	92.1	Very high	128 Å²	128	71.9 Å²	71.9	48%	0.483	34%	0.34	S	S	.	.	S	Bend	trans	-76.9	-28.4	173.5	-68.2	-176.4	163.7	-176.6	-1.4	113.2	R230 T245 H264 E266	R230-R232 PolarHBondContact O-N 2.92Å; R232-T245 WeakPolarHBondContact O-CG2 3.34Å; R232-H264 PolarHBondContact N-O 2.86Å; R232-E266 HydrophobicContact CG-CB 4Å
233	R	90.3	Very high	92.1	Very high	170 Å²	170	71 Å²	71	64%	0.642	33%	0.329	S	S	*	.	S	Bend	trans	-145.1	171.1	-179.9	-66.5	-172.1	179.6	175.9	1.7	109.6	F235 T245	R233-F235 WeakPolarHBondContact O-CD1 3.4Å; R233-F235 PolarHBondContact O-N 3.39Å; R233-T245 WeakPolarHBondContact CA-OG1 3.43Å
234	N	93.2	Very high	92.1	Very high	115 Å²	115	70.6 Å²	70.6	62%	0.615	32%	0.321	S	S	*	.	S	Bend	trans	-74.1	119.5	171.3	-60.8	-5.2	0	0	0	109.1	R243 R244 T245	N234-R243 VanDerWaalsContact CA-O 3.28Å; N234-R243 WeakPolarHBondContact CA-O 3.38Å; N234-R244 WeakPolarHBondContact OD1-CA 2.98Å; N234-T245 PolarHBondContact N-OG1 2.89Å; N234-T245 PolarHBondContact OD1-N 3.38Å; N234-T245 PolarHBondContact OD1-OG1 3.06Å
235	F	92.9	Very high	92.1	Very high	23 Å²	23	67.7 Å²	67.7	10%	0.101	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	175.5	179	79.4	-67	0	0	0	110.6	A231 R233 D237 R243 W249 H264 E265	A231-F235 HydrophobicContact CB-CD1 4.44Å; A231-F235 HydrophobicContact CB-CE1 3.95Å; R233-F235 WeakPolarHBondContact O-CD1 3.4Å; R233-F235 PolarHBondContact O-N 3.39Å; F235-D237 HydrophobicContact CE2-CB 4.23Å; F235-D237 HydrophobicContact CZ-CB 4.43Å; F235-R243 HydrophobicContact CD1-CB 4.17Å; F235-R243 HydrophobicContact CE1-CB 3.85Å; F235-R243 HydrophobicContact CE1-CG 4.2Å; F235-R243 HydrophobicContact CZ-CG 4.4Å; F235-R243 PolarHBondContact N-O 3.42Å; F235-R243 VanDerWaalsContact N-O 3.09Å; F235-R243 PolarHBondContact O-N 3.49Å; F235-W249 AromaticContact CE1-CH2 3.88Å; F235-W249 HydrophobicContact CE1-CH2 3.88Å; F235-W249 AromaticContact CZ-CH2 3.92Å; F235-W249 HydrophobicContact CZ-CH2 3.92Å; F235-W249 HydrophobicContact CZ-CZ2 4.09Å; F235-H264 HydrophobicContact CB-CB 4.14Å; F235-H264 HydrophobicContact CD1-CB 3.6Å; F235-H264 HydrophobicContact CD2-CB 3.89Å; F235-H264 HydrophobicContact CE1-CB 3.95Å; F235-H264 HydrophobicContact CE2-CB 4.22Å; F235-H264 HydrophobicContact CG-CB 3.6Å; F235-H264 AromaticContact CG-CD2 3.87Å; F235-H264 HydrophobicContact CZ-CB 4.28Å; F235-E265 HydrophobicContact CE1-CG 4.21Å; F235-E265 HydrophobicContact CE2-CG 3.95Å; F235-E265 HydrophobicContact CZ-CG 3.36Å
236	R	91.3	Very high	91.9	Very high	184 Å²	184	68 Å²	68	69%	0.694	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.6	127.9	170.4	-68.7	-174.9	177.9	-169.5	1.3	108.3	V241	R236-V241 WeakPolarHBondContact CA-O 3.15Å
237	D	88.9	Confident	91.8	Very high	8 Å²	8	70.8 Å²	70.8	4%	0.043	34%	0.34	C	S	.	.			trans	-69.5	173.9	177.5	72.1	11.7	0	0	0	111.5	F235 R239 G240 V241 R243	F235-D237 HydrophobicContact CE2-CB 4.23Å; F235-D237 HydrophobicContact CZ-CB 4.43Å; D237-R239 PolarHBondContact O-N 3.26Å; D237-R239 VanDerWaalsContact O-N 3.1Å; D237-R239 WeakPolarHBondContact OD1-CA 3.47Å; D237-R239 WeakPolarHBondContact OD1-CB 3.34Å; D237-R239 PolarHBondContact OD1-N 3.3Å; D237-R239 IonicContact OD2-CZ 2.86Å; D237-R239 IonicContact OD2-NE 3.53Å; D237-R239 PolarHBondContact OD2-NE 3.1Å; D237-R239 IonicContact OD2-NH2 3.3Å; D237-R239 PolarHBondContact OD2-NH2 2.81Å; D237-G240 WeakPolarHBondContact O-CA 3.45Å; D237-G240 PolarHBondContact O-N 3.06Å; D237-G240 PolarHBondContact OD1-N 2.9Å; D237-G240 VanDerWaalsContact OD1-N 3.1Å; D237-V241 PolarHBondContact N-O 2.93Å; D237-V241 WeakPolarHBondContact OD1-CB 3.28Å; D237-V241 PolarHBondContact OD1-N 3.39Å; D237-R243 HydrophobicContact CB-CG 4.49Å; D237-R243 IonicContact OD2-CZ 2.63Å; D237-R243 IonicContact OD2-NE 3.37Å; D237-R243 PolarHBondContact OD2-NE 2.66Å; D237-R243 IonicContact OD2-NH2 3.52Å; D237-R243 PolarHBondContact OD2-NH2 2.79Å
238	F	84.1	Confident	91.7	Very high	105 Å²	105	74.4 Å²	74.4	46%	0.461	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-19.3	-179.5	75	-82.9	0	0	0	114	G240 V251 D255 T256 H259	F238-G240 VanDerWaalsContact C-N 3.34Å; F238-V251 HydrophobicContact CE1-CG1 4.35Å; F238-V251 HydrophobicContact CZ-CG1 4.31Å; F238-D255 HydrophobicContact CZ-CB 4.18Å; F238-T256 HydrophobicContact CE2-CG2 4.23Å; F238-T256 HydrophobicContact CZ-CG2 3.75Å; F238-H259 AromaticContact CD1-CE1 3.44Å; F238-H259 VanDerWaalsContact CD1-CE1 3.44Å; F238-H259 WeakPolarHBondContact CD1-CE1 3.45Å; F238-H259 AromaticContact CD1-ND1 3.7Å; F238-H259 AromaticContact CE1-CE1 3.38Å; F238-H259 WeakPolarHBondContact CE1-CE1 3.5Å; F238-H259 AromaticContact CE1-ND1 3.27Å; F238-H259 VanDerWaalsContact CE1-ND1 3.27Å; F238-H259 WeakPolarHBondContact CE1-ND1 2.96Å; F238-H259 AromaticContact CZ-ND1 3.92Å
239	R	85.3	Confident	91.6	Very high	74 Å²	74	73.4 Å²	73.4	28%	0.279	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-5.5	174.1	-61.5	170.9	-66.8	-128.7	-14.6	112.5	D237 V241 D255	D237-R239 PolarHBondContact O-N 3.26Å; D237-R239 VanDerWaalsContact O-N 3.1Å; D237-R239 WeakPolarHBondContact OD1-CA 3.47Å; D237-R239 WeakPolarHBondContact OD1-CB 3.34Å; D237-R239 PolarHBondContact OD1-N 3.3Å; D237-R239 IonicContact OD2-CZ 2.86Å; D237-R239 IonicContact OD2-NE 3.53Å; D237-R239 PolarHBondContact OD2-NE 3.1Å; D237-R239 IonicContact OD2-NH2 3.3Å; D237-R239 PolarHBondContact OD2-NH2 2.81Å; R239-V241 HydrophobicContact CB-CG2 4.32Å; R239-D255 WeakPolarHBondContact CD-OD1 3.19Å; R239-D255 IonicContact CZ-OD1 3.51Å; R239-D255 IonicContact NE-OD1 3.81Å; R239-D255 IonicContact NH1-OD1 2.74Å; R239-D255 PolarHBondContact NH1-OD1 3.42Å; R239-D255 IonicContact NH1-OD2 3.76Å; R239-D255 PolarHBondContact NH1-OD2 2.79Å; R239-D255 VanDerWaalsContact NH1-OD2 3.09Å
240	G	86.5	Confident	91.6	Very high	45 Å²	45	74.1 Å²	74.1	46%	0.464	36%	0.356	S	S	.	.	S	Bend	trans	84.6	10	-176.5	0	0	0	0	0	114.7	D237 F238	D237-G240 WeakPolarHBondContact O-CA 3.45Å; D237-G240 PolarHBondContact O-N 3.06Å; D237-G240 PolarHBondContact OD1-N 2.9Å; D237-G240 VanDerWaalsContact OD1-N 3.1Å; F238-G240 VanDerWaalsContact C-N 3.34Å
241	V	89.3	Confident	91.5	Very high	63 Å²	63	70.3 Å²	70.3	38%	0.382	34%	0.341	S	S	.	.			trans	-78.7	129	176.5	-175.7	0	0	0	0	109.3	R236 D237 R239 R243	R236-V241 WeakPolarHBondContact CA-O 3.15Å; D237-V241 PolarHBondContact N-O 2.93Å; D237-V241 WeakPolarHBondContact OD1-CB 3.28Å; D237-V241 PolarHBondContact OD1-N 3.39Å; R239-V241 HydrophobicContact CB-CG2 4.32Å; V241-R243 PolarHBondContact O-N 3.45Å
242	S	92.6	Very high	91.6	Very high	73 Å²	73	71.4 Å²	71.4	51%	0.51	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	122.2	177.7	-61.2	0	0	0	0	110.4
243	R	92.8	Very high	91.6	Very high	45 Å²	45	67.6 Å²	67.6	17%	0.17	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	134.8	178	-55.7	-62.4	179.4	171.8	-0.3	109.6	A231 N234 F235 D237 V241 W249	A231-R243 HydrophobicContact CB-CB 4.06Å; N234-R243 VanDerWaalsContact CA-O 3.28Å; N234-R243 WeakPolarHBondContact CA-O 3.38Å; F235-R243 HydrophobicContact CD1-CB 4.17Å; F235-R243 HydrophobicContact CE1-CB 3.85Å; F235-R243 HydrophobicContact CE1-CG 4.2Å; F235-R243 HydrophobicContact CZ-CG 4.4Å; F235-R243 PolarHBondContact N-O 3.42Å; F235-R243 VanDerWaalsContact N-O 3.09Å; F235-R243 PolarHBondContact O-N 3.49Å; D237-R243 HydrophobicContact CB-CG 4.49Å; D237-R243 IonicContact OD2-CZ 2.63Å; D237-R243 IonicContact OD2-NE 3.37Å; D237-R243 PolarHBondContact OD2-NE 2.66Å; D237-R243 IonicContact OD2-NH2 3.52Å; D237-R243 PolarHBondContact OD2-NH2 2.79Å; V241-R243 PolarHBondContact O-N 3.45Å; R243-W249 HydrophobicContact CB-CH2 4.16Å; R243-W249 HydrophobicContact CB-CZ3 4.01Å; R243-W249 HydrophobicContact CG-CD2 4.46Å; R243-W249 HydrophobicContact CG-CE3 4.17Å; R243-W249 HydrophobicContact CG-CH2 3.82Å; R243-W249 HydrophobicContact CG-CZ2 4.1Å; R243-W249 HydrophobicContact CG-CZ3 3.84Å
244	R	93.1	Very high	91.7	Very high	150 Å²	150	68.3 Å²	68.3	57%	0.566	35%	0.349	S	S	*	.			trans	-97	154.6	173	-63.8	179.6	-70.8	-161	-8.1	110.9	A231 N234 G246 E247	A231-R244 VanDerWaalsContact CB-O 3.24Å; A231-R244 WeakPolarHBondContact CB-O 3.46Å; N234-R244 WeakPolarHBondContact OD1-CA 2.98Å; R244-G246 PolarHBondContact O-N 2.91Å; R244-E247 HydrophobicContact CB-CG 4.01Å; R244-E247 IonicContact CZ-OE1 3.15Å; R244-E247 PolarHBondContact N-OE2 3.38Å; R244-E247 IonicContact NE-OE1 2.87Å; R244-E247 PolarHBondContact NE-OE1 3.32Å; R244-E247 IonicContact NH2-OE1 2.63Å; R244-E247 PolarHBondContact NH2-OE1 2.86Å; R244-E247 VanDerWaalsContact O-CB 3.26Å; R244-E247 WeakPolarHBondContact O-CB 3.39Å; R244-E247 WeakPolarHBondContact O-CG 3.3Å; R244-E247 PolarHBondContact O-N 3.32Å
245	T	93.7	Very high	91.6	Very high	87 Å²	87	65.9 Å²	65.9	53%	0.534	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	127.4	179.6	-52.3	0	0	0	0	111	R232 R233 N234 E247	R232-T245 WeakPolarHBondContact O-CG2 3.34Å; R233-T245 WeakPolarHBondContact CA-OG1 3.43Å; N234-T245 PolarHBondContact N-OG1 2.89Å; N234-T245 PolarHBondContact OD1-N 3.38Å; N234-T245 PolarHBondContact OD1-OG1 3.06Å; T245-E247 VanDerWaalsContact C-N 3.28Å; T245-E247 PolarHBondContact O-N 2.92Å
246	G	90.8	Very high	91.5	Very high	44 Å²	44	66.5 Å²	66.5	45%	0.454	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.1	-6.5	-178.1	0	0	0	0	0	115.2	A231 R244	A231-G246 PolarHBondContact O-N 3.34Å; R244-G246 PolarHBondContact O-N 2.91Å
247	E	92.4	Very high	91.5	Very high	58 Å²	58	65 Å²	65	27%	0.271	34%	0.343	S	S	.	.			trans	-67.2	140.7	170.1	-68.5	-179.4	166.5	0	0	110	R230 A231 R244 T245 W249	R230-E247 WeakPolarHBondContact CA-O 3.45Å; A231-E247 PolarHBondContact N-O 3.1Å; R244-E247 HydrophobicContact CB-CG 4.01Å; R244-E247 IonicContact CZ-OE1 3.15Å; R244-E247 PolarHBondContact N-OE2 3.38Å; R244-E247 IonicContact NE-OE1 2.87Å; R244-E247 PolarHBondContact NE-OE1 3.32Å; R244-E247 IonicContact NH2-OE1 2.63Å; R244-E247 PolarHBondContact NH2-OE1 2.86Å; R244-E247 VanDerWaalsContact O-CB 3.26Å; R244-E247 WeakPolarHBondContact O-CB 3.39Å; R244-E247 WeakPolarHBondContact O-CG 3.3Å; R244-E247 PolarHBondContact O-N 3.32Å; T245-E247 VanDerWaalsContact C-N 3.28Å; T245-E247 PolarHBondContact O-N 2.92Å; E247-W249 VanDerWaalsContact O-CZ3 3.3Å; E247-W249 WeakPolarHBondContact O-CZ3 3.18Å
248	E	94.1	Very high	91.7	Very high	76 Å²	76	65.7 Å²	65.7	36%	0.355	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	144.1	179.3	-61.1	-174.7	-175.8	0	0	109.7	H228 L229 R230 L268 P312	H228-E248 IonicContact CE1-OE2 2.75Å; H228-E248 PolarHBondContact CE1-OE2 2.95Å; H228-E248 IonicContact NE2-OE2 3.2Å; H228-E248 PolarHBondContact NE2-OE2 3.16Å; L229-E248 VanDerWaalsContact O-CA 3.23Å; L229-E248 WeakPolarHBondContact O-CA 3.43Å; R230-E248 HydrophobicContact CB-CG 4.02Å; R230-E248 HydrophobicContact CG-CG 3.96Å; E248-L268 HydrophobicContact CG-CD1 4.2Å; E248-P312 HydrophobicContact CB-CB 3.63Å; E248-P312 HydrophobicContact CB-CG 3.97Å
249	W	94	Very high	92.2	Very high	10 Å²	10	61.1 Å²	61.1	4%	0.038	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	168.2	176.9	66.7	94.8	0	0	0	111.3	L229 A231 F235 R243 E247 E265	L229-W249 HydrophobicContact CB-CD2 4.31Å; L229-W249 HydrophobicContact CB-CH2 4.29Å; L229-W249 HydrophobicContact CB-CZ2 3.81Å; L229-W249 HydrophobicContact CD1-CZ2 4.07Å; L229-W249 PolarHBondContact N-O 3.11Å; L229-W249 PolarHBondContact O-N 3.34Å; A231-W249 HydrophobicContact CB-CH2 3.88Å; A231-W249 HydrophobicContact CB-CZ3 3.61Å; F235-W249 AromaticContact CE1-CH2 3.88Å; F235-W249 HydrophobicContact CE1-CH2 3.88Å; F235-W249 AromaticContact CZ-CH2 3.92Å; F235-W249 HydrophobicContact CZ-CH2 3.92Å; F235-W249 HydrophobicContact CZ-CZ2 4.09Å; R243-W249 HydrophobicContact CB-CH2 4.16Å; R243-W249 HydrophobicContact CB-CZ3 4.01Å; R243-W249 HydrophobicContact CG-CD2 4.46Å; R243-W249 HydrophobicContact CG-CE3 4.17Å; R243-W249 HydrophobicContact CG-CH2 3.82Å; R243-W249 HydrophobicContact CG-CZ2 4.1Å; R243-W249 HydrophobicContact CG-CZ3 3.84Å; E247-W249 VanDerWaalsContact O-CZ3 3.3Å; E247-W249 WeakPolarHBondContact O-CZ3 3.18Å; W249-E265 HydrophobicContact CH2-CG 4.28Å; W249-E265 HydrophobicContact CZ2-CG 4.03Å
250	L	94.6	Very high	92.6	Very high	16 Å²	16	59 Å²	59	8%	0.084	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	143.1	172.2	-58.1	-177.7	0	0	0	111	A226 L227 H228 V271 F309 L310 P312	A226-L250 HydrophobicContact CB-CB 4.33Å; A226-L250 HydrophobicContact CB-CD1 4.36Å; L227-L250 CarbonylContact O-C 3.59Å; L227-L250 VanDerWaalsContact O-CA 3.27Å; L227-L250 WeakPolarHBondContact O-CA 3.43Å; H228-L250 HydrophobicContact CB-CD2 3.67Å; L250-V271 HydrophobicContact CD2-CB 4.48Å; L250-V271 HydrophobicContact CD2-CG2 3.96Å; L250-F309 HydrophobicContact CD1-CB 3.7Å; L250-L310 WeakPolarHBondContact CD1-O 3.32Å; L250-P312 HydrophobicContact CD2-CG 4.34Å; L250-P312 HydrophobicContact CG-CG 4.37Å
251	V	95.2	Very high	93	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	130.3	164.1	-175.1	0	0	0	0	107.5	L221 A226 L227 L229 F238 D255 T256 H259	L221-V251 HydrophobicContact CD1-CB 4.18Å; L221-V251 HydrophobicContact CD1-CG1 3.74Å; A226-V251 CarbonylContact C-O 3.58Å; A226-V251 VanDerWaalsContact CA-O 3.3Å; A226-V251 WeakPolarHBondContact CA-O 3.46Å; L227-V251 HydrophobicContact CB-CB 4.28Å; L227-V251 PolarHBondContact N-O 3.45Å; L227-V251 PolarHBondContact O-N 2.73Å; L229-V251 HydrophobicContact CD1-CG2 3.63Å; L229-V251 HydrophobicContact CG-CG2 4.44Å; F238-V251 HydrophobicContact CE1-CG1 4.35Å; F238-V251 HydrophobicContact CZ-CG1 4.31Å; V251-D255 HydrophobicContact CG1-CB 3.96Å; V251-T256 HydrophobicContact CG1-CG2 3.93Å; V251-H259 HydrophobicContact CG1-CB 4.35Å
252	T	94.9	Very high	93.2	Very high	25 Å²	25	57.4 Å²	57.4	15%	0.153	31%	0.305	C	S	.	.			trans	-118.3	170.3	-177.4	67.4	0	0	0	0	110.7	A226 Q254 D255 T256 F309	A226-T252 HydrophobicContact CB-CG2 4.05Å; T252-Q254 PolarHBondContact O-N 2.67Å; T252-Q254 VanDerWaalsContact O-N 3.14Å; T252-Q254 PolarHBondContact OG1-N 3.38Å; T252-D255 PolarHBondContact N-OD2 3.49Å; T252-D255 WeakPolarHBondContact O-CB 3.47Å; T252-D255 PolarHBondContact O-N 3.08Å; T252-D255 PolarHBondContact OG1-OD2 3.27Å; T252-D255 VanDerWaalsContact OG1-OD2 3.06Å; T252-T256 PolarHBondContact O-N 3.34Å; T252-F309 HydrophobicContact CG2-CD2 4.03Å; T252-F309 HydrophobicContact CG2-CE2 4.07Å
253	V	94.6	Very high	93.1	Very high	48 Å²	48	54.8 Å²	54.8	29%	0.291	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-21.8	175.3	74.3	0	0	0	0	113.4	E223 D255 E257	E223-V253 HydrophobicContact CG-CG1 4.09Å; V253-D255 PolarHBondContact O-N 2.97Å; V253-E257 HydrophobicContact CG2-CG 4.32Å
254	Q	91.3	Very high	93.2	Very high	186 Å²	186	54.9 Å²	54.9	87%	0.869	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-24.2	174.8	-62.3	-177.5	1	0	0	112.3	T252	T252-Q254 PolarHBondContact O-N 2.67Å; T252-Q254 VanDerWaalsContact O-N 3.14Å; T252-Q254 PolarHBondContact OG1-N 3.38Å
255	D	90.6	Very high	93.2	Very high	63 Å²	63	48.2 Å²	48.2	34%	0.337	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-51.6	178.4	-57.7	-74.9	0	0	0	111.4	F238 R239 V251 T252 V253	F238-D255 HydrophobicContact CZ-CB 4.18Å; R239-D255 WeakPolarHBondContact CD-OD1 3.19Å; R239-D255 IonicContact CZ-OD1 3.51Å; R239-D255 IonicContact NE-OD1 3.81Å; R239-D255 IonicContact NH1-OD1 2.74Å; R239-D255 PolarHBondContact NH1-OD1 3.42Å; R239-D255 IonicContact NH1-OD2 3.76Å; R239-D255 PolarHBondContact NH1-OD2 2.79Å; R239-D255 VanDerWaalsContact NH1-OD2 3.09Å; V251-D255 HydrophobicContact CG1-CB 3.96Å; T252-D255 PolarHBondContact N-OD2 3.49Å; T252-D255 WeakPolarHBondContact O-CB 3.47Å; T252-D255 PolarHBondContact O-N 3.08Å; T252-D255 PolarHBondContact OG1-OD2 3.27Å; T252-D255 VanDerWaalsContact OG1-OD2 3.06Å; V253-D255 PolarHBondContact O-N 2.97Å
256	T	91.6	Very high	93.2	Very high	37 Å²	37	46.6 Å²	46.6	23%	0.227	25%	0.25	C	C	.	.			trans	-159.5	143.9	178.5	-176.6	0	0	0	0	110.2	F238 V251 T252 A258 H259	F238-T256 HydrophobicContact CE2-CG2 4.23Å; F238-T256 HydrophobicContact CZ-CG2 3.75Å; V251-T256 HydrophobicContact CG1-CG2 3.93Å; T252-T256 PolarHBondContact O-N 3.34Å; T256-A258 VanDerWaalsContact C-N 3.34Å; T256-A258 PolarHBondContact OG1-N 2.9Å; T256-A258 PolarHBondContact OG1-O 3.02Å; T256-H259 HydrophobicContact CG2-CB 3.72Å
257	E	91.3	Very high	93.4	Very high	151 Å²	151	47.6 Å²	47.6	71%	0.706	25%	0.247	S	C	*	.	S	Bend	trans	-72.1	-30.1	174.2	-64.1	-179.7	177.5	0	0	112.2	L221 V253	L221-E257 PolarHBondContact N-O 3.18Å; V253-E257 HydrophobicContact CG2-CG 4.32Å
258	A	92.6	Very high	93.5	Very high	24 Å²	24	48.2 Å²	48.2	20%	0.198	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	119	-179.9	0	0	0	0	0	109.1	A218 V219 T256	A218-A258 HydrophobicContact CB-CB 3.87Å; V219-A258 WeakPolarHBondContact O-CA 3.23Å; T256-A258 VanDerWaalsContact C-N 3.34Å; T256-A258 PolarHBondContact OG1-N 2.9Å; T256-A258 PolarHBondContact OG1-O 3.02Å
259	H	94.4	Very high	93.5	Very high	9 Å²	9	45.9 Å²	45.9	4%	0.042	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	117.4	-179.4	-172.6	72.8	0	0	0	110.3	A218 V219 L221 L227 F238 V251 T256 P261 E265	A218-H259 CarbonylContact C-O 3.58Å; A218-H259 WeakPolarHBondContact CA-O 3.4Å; V219-H259 PolarHBondContact N-O 3.04Å; V219-H259 PolarHBondContact O-N 3.44Å; L221-H259 HydrophobicContact CD1-CB 4.31Å; L227-H259 HydrophobicContact CD2-CB 4.11Å; L227-H259 VanDerWaalsContact CD2-CD2 3.5Å; L227-H259 WeakPolarHBondContact CD2-CD2 3.45Å; F238-H259 AromaticContact CD1-CE1 3.44Å; F238-H259 VanDerWaalsContact CD1-CE1 3.44Å; F238-H259 WeakPolarHBondContact CD1-CE1 3.45Å; F238-H259 AromaticContact CD1-ND1 3.7Å; F238-H259 AromaticContact CE1-CE1 3.38Å; F238-H259 WeakPolarHBondContact CE1-CE1 3.5Å; F238-H259 AromaticContact CE1-ND1 3.27Å; F238-H259 VanDerWaalsContact CE1-ND1 3.27Å; F238-H259 WeakPolarHBondContact CE1-ND1 2.96Å; F238-H259 AromaticContact CZ-ND1 3.92Å; V251-H259 HydrophobicContact CG1-CB 4.35Å; T256-H259 HydrophobicContact CG2-CB 3.72Å; H259-P261 WeakPolarHBondContact O-CD 3.38Å; H259-E265 IonicContact CD2-OE2 3.88Å; H259-E265 IonicContact CE1-OE2 3.21Å; H259-E265 IonicContact NE2-OE1 2.67Å; H259-E265 IonicContact NE2-OE2 3.36Å; H259-E265 PolarHBondContact NE2-OE2 3.24Å
260	V	94.3	Very high	93.5	Very high	30 Å²	30	49.3 Å²	49.3	18%	0.182	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-85.4	116.4	168.9	-175.3	0	0	0	0	107.8	A173 L197 V216 A218 D262	A173-V260 HydrophobicContact CB-CG1 3.77Å; L197-V260 HydrophobicContact CD1-CG1 3.89Å; V216-V260 HydrophobicContact CB-CG1 4.02Å; V216-V260 HydrophobicContact CG1-CG1 3.74Å; A218-V260 HydrophobicContact CB-CG2 3.53Å; V260-D262 PolarHBondContact O-N 3.31Å
261	P	94.4	Very high	93.5	Very high	20 Å²	20	49.8 Å²	49.8	13%	0.13	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-61.5	122.2	178.4	-21.2	33.3	0	0	0	111	L197 V219 H259 V267	L197-P261 WeakPolarHBondContact CD1-O 3.34Å; V219-P261 HydrophobicContact CG2-CG 4.34Å; H259-P261 WeakPolarHBondContact O-CD 3.38Å; P261-V267 HydrophobicContact CB-CG2 3.63Å; P261-V267 HydrophobicContact CG-CG2 3.45Å; P261-V267 VanDerWaalsContact CG-CG2 3.45Å
262	D	93.3	Very high	93.5	Very high	54 Å²	54	54 Å²	54	29%	0.289	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-72.6	164.3	179.2	-162.8	4.9	0	0	0	111.6	V260 H264 E265	V260-D262 PolarHBondContact O-N 3.31Å; D262-H264 PolarHBondContact O-N 2.96Å; D262-H264 VanDerWaalsContact O-N 3.12Å; D262-E265 HydrophobicContact CB-CG 4.11Å; D262-E265 PolarHBondContact N-OE2 3.03Å; D262-E265 WeakPolarHBondContact O-CA 2.92Å; D262-E265 WeakPolarHBondContact O-CB 3.44Å; D262-E265 PolarHBondContact O-N 3.06Å
263	V	92.3	Very high	93.5	Very high	18 Å²	18	54.9 Å²	54.9	11%	0.109	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-31.5	-179.8	-179.7	0	0	0	0	112.4	R175 E195 L197 E265	R175-V263 HydrophobicContact CG-CG2 4.34Å; E195-V263 HydrophobicContact CB-CG1 3.61Å; E195-V263 HydrophobicContact CB-CG2 4.31Å; L197-V263 HydrophobicContact CD2-CG2 4.2Å; L197-V263 HydrophobicContact CG-CG2 4.01Å; V263-E265 VanDerWaalsContact C-N 3.33Å
264	H	93.1	Very high	93.5	Very high	47 Å²	47	53.4 Å²	53.4	22%	0.218	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-3.5	179.4	-54.5	-35.5	0	0	0	113.3	R232 F235 D262	R232-H264 PolarHBondContact N-O 2.86Å; F235-H264 HydrophobicContact CB-CB 4.14Å; F235-H264 HydrophobicContact CD1-CB 3.6Å; F235-H264 HydrophobicContact CD2-CB 3.89Å; F235-H264 HydrophobicContact CE1-CB 3.95Å; F235-H264 HydrophobicContact CE2-CB 4.22Å; F235-H264 HydrophobicContact CG-CB 3.6Å; F235-H264 AromaticContact CG-CD2 3.87Å; F235-H264 HydrophobicContact CZ-CB 4.28Å; D262-H264 PolarHBondContact O-N 2.96Å; D262-H264 VanDerWaalsContact O-N 3.12Å
265	E	94	Very high	93.6	Very high	10 Å²	10	48 Å²	48	5%	0.047	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	135.8	178.4	-63.3	177.7	157.2	0	0	109.8	L229 F235 W249 H259 D262 V263	L229-E265 HydrophobicContact CD1-CB 4.43Å; L229-E265 HydrophobicContact CD1-CG 4.36Å; L229-E265 HydrophobicContact CD2-CB 4.45Å; F235-E265 HydrophobicContact CE1-CG 4.21Å; F235-E265 HydrophobicContact CE2-CG 3.95Å; F235-E265 HydrophobicContact CZ-CG 3.36Å; W249-E265 HydrophobicContact CH2-CG 4.28Å; W249-E265 HydrophobicContact CZ2-CG 4.03Å; H259-E265 IonicContact CD2-OE2 3.88Å; H259-E265 IonicContact CE1-OE2 3.21Å; H259-E265 IonicContact NE2-OE1 2.67Å; H259-E265 IonicContact NE2-OE2 3.36Å; H259-E265 PolarHBondContact NE2-OE2 3.24Å; D262-E265 HydrophobicContact CB-CG 4.11Å; D262-E265 PolarHBondContact N-OE2 3.03Å; D262-E265 WeakPolarHBondContact O-CA 2.92Å; D262-E265 WeakPolarHBondContact O-CB 3.44Å; D262-E265 PolarHBondContact O-N 3.06Å; V263-E265 VanDerWaalsContact C-N 3.33Å
266	E	94	Very high	93.8	Very high	53 Å²	53	45 Å²	45	25%	0.248	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	121.2	171.5	-176	-179.7	-164	0	0	108.5	L229 R230 R232 L268	L229-E266 CarbonylContact C-O 3.56Å; L229-E266 WeakPolarHBondContact CA-O 3.24Å; R230-E266 HydrophobicContact CB-CB 4.34Å; R230-E266 IonicContact CZ-OE2 2.64Å; R230-E266 PolarHBondContact N-O 3.27Å; R230-E266 IonicContact NE-OE2 3.34Å; R230-E266 PolarHBondContact NE-OE2 3.28Å; R230-E266 IonicContact NH2-OE1 3.74Å; R230-E266 PolarHBondContact NH2-OE1 3.14Å; R230-E266 VanDerWaalsContact NH2-OE1 3.11Å; R230-E266 IonicContact NH2-OE2 2.74Å; R230-E266 PolarHBondContact NH2-OE2 3.38Å; R230-E266 PolarHBondContact O-N 3.4Å; R232-E266 HydrophobicContact CG-CB 4Å; E266-L268 PolarHBondContact O-N 3.34Å
267	V	95.4	Very high	93.8	Very high	65 Å²	65	44.2 Å²	44.2	39%	0.394	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	115.5	175.8	-178.2	0	0	0	0	109.2	L227 L229 P261	L227-V267 HydrophobicContact CD1-CG1 3.7Å; L229-V267 HydrophobicContact CD2-CB 4.31Å; L229-V267 HydrophobicContact CD2-CG2 3.74Å; P261-V267 HydrophobicContact CB-CG2 3.63Å; P261-V267 HydrophobicContact CG-CG2 3.45Å; P261-V267 VanDerWaalsContact CG-CG2 3.45Å
268	L	94.6	Very high	93.7	Very high	71 Å²	71	41.1 Å²	41.1	37%	0.372	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	-33.1	173.4	-69.4	176.7	0	0	0	111.7	H228 R230 E248 E266	H228-L268 HydrophobicContact CB-CB 4.45Å; H228-L268 WeakPolarHBondContact NE2-CD1 3.33Å; H228-L268 PolarHBondContact O-N 3.15Å; R230-L268 HydrophobicContact CB-CD1 3.91Å; R230-L268 HydrophobicContact CB-CG 4.15Å; E248-L268 HydrophobicContact CG-CD1 4.2Å; E266-L268 PolarHBondContact O-N 3.34Å
269	G	93.2	Very high	93.6	Very high	27 Å²	27	44.1 Å²	44.1	28%	0.278	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	164.6	-173.5	176.5	0	0	0	0	0	113.6	H228	H228-G269 PolarHBondContact N-O 3.45Å
270	V	94.1	Very high	93.5	Very high	81 Å²	81	45.8 Å²	45.8	49%	0.491	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	123.1	174.5	-178.3	0	0	0	0	108.4	V219 T225 A226 L227	V219-V270 HydrophobicContact CG1-CG2 4.44Å; T225-V270 HydrophobicContact CG2-CG1 3.96Å; A226-V270 CarbonylContact O-C 3.46Å; A226-V270 WeakPolarHBondContact O-CA 3.4Å; L227-V270 HydrophobicContact CD1-CG2 4.34Å
271	V	95.1	Very high	93.5	Very high	26 Å²	26	44.7 Å²	44.7	16%	0.158	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	122	-178.7	178.6	0	0	0	0	109.2	A226 H228 L250 F309	A226-V271 PolarHBondContact N-O 2.88Å; A226-V271 PolarHBondContact O-N 3.46Å; H228-V271 HydrophobicContact CB-CG2 3.89Å; L250-V271 HydrophobicContact CD2-CB 4.48Å; L250-V271 HydrophobicContact CD2-CG2 3.96Å; V271-F309 HydrophobicContact CG1-CD1 4.41Å
272	P	95	Very high	93.5	Very high	88 Å²	88	43.7 Å²	43.7	57%	0.571	26%	0.256	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.5	150.2	174.4	31	-34.1	0	0	0	111
273	I	95.2	Very high	93.5	Very high	44 Å²	44	41.8 Å²	41.8	23%	0.226	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-66.5	134.7	173.1	-162.5	159.2	0	0	0	110.4	E223 K224 F309	E223-I273 VanDerWaalsContact O-CD1 3.25Å; E223-I273 WeakPolarHBondContact O-CD1 3.34Å; K224-I273 HydrophobicContact CB-CG2 3.92Å; K224-I273 HydrophobicContact CG-CG2 4.11Å; K224-I273 PolarHBondContact O-N 2.84Å; I273-F309 HydrophobicContact CB-CD1 4.06Å; I273-F309 HydrophobicContact CB-CE1 3.55Å; I273-F309 HydrophobicContact CB-CZ 3.92Å; I273-F309 HydrophobicContact CD1-CE1 4.45Å; I273-F309 HydrophobicContact CD1-CE2 4.14Å; I273-F309 HydrophobicContact CD1-CZ 3.99Å; I273-F309 HydrophobicContact CG1-CD1 4.37Å; I273-F309 HydrophobicContact CG1-CE1 4.09Å; I273-F309 HydrophobicContact CG1-CE2 4.45Å; I273-F309 HydrophobicContact CG1-CZ 4.14Å
274	T	94.5	Very high	93.7	Very high	18 Å²	18	41 Å²	41	11%	0.11	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	115.1	169.4	-57.9	0	0	0	0	107.8	S307 F308 L316 I320	T274-S307 WeakPolarHBondContact O-CA 3.48Å; T274-F308 WeakPolarHBondContact CA-O 3.48Å; T274-F308 WeakPolarHBondContact CB-O 3.44Å; T274-F308 HydrophobicContact CG2-CE1 4.33Å; T274-F308 HydrophobicContact CG2-CZ 4.04Å; T274-F308 PolarHBondContact N-O 3.46Å; T274-F308 PolarHBondContact O-N 2.85Å; T274-L316 HydrophobicContact CG2-CD1 4.28Å; T274-I320 HydrophobicContact CG2-CD1 4.18Å; T274-I320 HydrophobicContact CG2-CG1 4.29Å
275	T	92.6	Very high	93.7	Very high	73 Å²	73	40.9 Å²	40.9	45%	0.448	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	121.1	-179.8	-62.7	0	0	0	0	109.9	S307	T275-S307 WeakPolarHBondContact CG2-OG 3.38Å; T275-S307 PolarHBondContact OG1-OG 3.32Å; T275-S307 VanDerWaalsContact OG1-OG 3.05Å
276	L	94	Very high	93.7	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	128.6	172.2	-60.9	176.7	0	0	0	109.2	N280 C282 V302 E305 K306 F308 I320	L276-N280 HydrophobicContact CB-CB 4.45Å; L276-N280 HydrophobicContact CD2-CB 4.31Å; L276-C282 HydrophobicContact CD2-CB 4.15Å; L276-V302 HydrophobicContact CD1-CB 4.14Å; L276-V302 HydrophobicContact CD1-CG1 3.79Å; L276-V302 WeakPolarHBondContact CD1-O 3.37Å; L276-E305 WeakPolarHBondContact O-CA 3.14Å; L276-K306 PolarHBondContact N-O 3.01Å; L276-K306 PolarHBondContact O-N 2.73Å; L276-F308 HydrophobicContact CD1-CE1 3.91Å; L276-F308 HydrophobicContact CG-CE1 4.18Å; L276-I320 HydrophobicContact CD2-CB 4.43Å; L276-I320 HydrophobicContact CD2-CG1 4.1Å; L276-I320 HydrophobicContact CD2-CG2 3.72Å
277	G	91.4	Very high	93.7	Very high	20 Å²	20	40.4 Å²	40.4	21%	0.206	24%	0.242	C	C	.	.			trans	-76.2	-177.9	169.5	0	0	0	0	0	113.1	H279 N280	G277-H279 VanDerWaalsContact C-N 3.33Å; G277-H279 PolarHBondContact O-N 3.45Å; G277-N280 PolarHBondContact O-N 3.04Å
278	P	89.6	Confident	93.5	Very high	86 Å²	86	38.7 Å²	38.7	56%	0.558	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-36.1	-178.5	23.7	-33	0	0	0	113.2
279	H	90	Very high	93.3	Very high	87 Å²	87	35.7 Å²	35.7	40%	0.403	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.6	26.7	179.1	-55.2	-62.7	0	0	0	112.6	G277 D322 V323 E364	G277-H279 VanDerWaalsContact C-N 3.33Å; G277-H279 PolarHBondContact O-N 3.45Å; H279-D322 WeakPolarHBondContact O-CA 3.41Å; H279-V323 WeakPolarHBondContact O-CB 3.29Å; H279-V323 WeakPolarHBondContact O-CG2 3.4Å; H279-V323 PolarHBondContact O-N 3.25Å; H279-E364 IonicContact CE1-OE1 2.76Å; H279-E364 PolarHBondContact CE1-OE1 3.48Å; H279-E364 IonicContact CE1-OE2 3.18Å; H279-E364 IonicContact ND1-OE1 3.54Å; H279-E364 PolarHBondContact ND1-OE1 3.43Å; H279-E364 IonicContact ND1-OE2 3Å; H279-E364 PolarHBondContact ND1-OE2 2.84Å
280	N	93.3	Very high	93	Very high	43 Å²	43	41.2 Å²	41.2	23%	0.23	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	149.1	178.6	-61.7	29.2	0	0	0	110.5	L276 G277 I320 Q321	L276-N280 HydrophobicContact CB-CB 4.45Å; L276-N280 HydrophobicContact CD2-CB 4.31Å; G277-N280 PolarHBondContact O-N 3.04Å; N280-I320 HydrophobicContact CB-CG2 3.82Å; N280-I320 WeakPolarHBondContact ND2-CG2 3.39Å; N280-Q321 CarbonylContact C-O 3.6Å; N280-Q321 VanDerWaalsContact CA-O 3.28Å; N280-Q321 WeakPolarHBondContact CA-O 3.39Å
281	Y	94.6	Very high	92.6	Very high	7 Å²	7	42.4 Å²	42.4	3%	0.027	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	167	171.3	79.2	-78.1	0	0	0	109.8	V283 V301 V302 Q321 D322 V323 V366	Y281-V283 HydrophobicContact CE2-CG2 4.26Å; Y281-V301 HydrophobicContact CD2-CG1 4.04Å; Y281-V302 CarbonylContact C-O 3.59Å; Y281-V302 WeakPolarHBondContact CA-O 3.48Å; Y281-V302 WeakPolarHBondContact CB-O 3.49Å; Y281-Q321 HydrophobicContact CD1-CB 4.04Å; Y281-Q321 HydrophobicContact CE1-CB 3.64Å; Y281-Q321 HydrophobicContact CE2-CB 4.46Å; Y281-Q321 PolarHBondContact N-O 2.85Å; Y281-Q321 PolarHBondContact O-N 2.9Å; Y281-Q321 VanDerWaalsContact O-O 3.05Å; Y281-Q321 PolarHBondContact OH-OE1 2.77Å; Y281-D322 VanDerWaalsContact CE1-O 3.29Å; Y281-D322 WeakPolarHBondContact CE1-O 3.29Å; Y281-V323 HydrophobicContact CD1-CG2 4Å; Y281-V366 HydrophobicContact CD1-CG1 4.23Å; Y281-V366 HydrophobicContact CD1-CG2 4.4Å; Y281-V366 HydrophobicContact CD2-CG1 3.49Å; Y281-V366 VanDerWaalsContact CD2-CG1 3.49Å; Y281-V366 HydrophobicContact CE2-CG1 3.94Å; Y281-V366 HydrophobicContact CG-CG1 3.64Å; Y281-V366 HydrophobicContact CG-CG2 4.35Å
282	C	94.4	Very high	92.1	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	160.6	171	68.2	0	0	0	0	111	L276 V302 L316 G319	L276-C282 HydrophobicContact CD2-CB 4.15Å; C282-V302 PolarHBondContact N-O 2.83Å; C282-V302 PolarHBondContact O-N 2.64Å; C282-L316 HydrophobicContact CB-CD2 3.94Å; C282-G319 WeakPolarHBondContact CB-O 3.42Å
283	V	94.1	Very high	91.8	Very high	14 Å²	14	45.8 Å²	45.8	9%	0.085	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	116.8	176.2	-172.9	0	0	0	0	108.6	Y281 K299 V301 L316 E317	Y281-V283 HydrophobicContact CE2-CG2 4.26Å; V283-K299 HydrophobicContact CG1-CB 3.89Å; V283-K299 HydrophobicContact CG1-CD 4.16Å; V283-K299 HydrophobicContact CG1-CG 4.39Å; V283-V301 HydrophobicContact CG2-CG2 4.24Å; V283-L316 WeakPolarHBondContact O-CA 3.37Å; V283-E317 HydrophobicContact CB-CB 4.19Å; V283-E317 HydrophobicContact CG1-CB 4.49Å; V283-E317 PolarHBondContact O-N 2.92Å
284	I	95.1	Very high	91.6	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	123.6	175.8	-58.9	173.8	0	0	0	108.3	P287 K299 R300 V302 F308 L310 E314 Q315 L316	I284-P287 HydrophobicContact CG2-CB 4.27Å; I284-K299 CarbonylContact O-C 3.54Å; I284-K299 WeakPolarHBondContact O-CA 3.39Å; I284-R300 PolarHBondContact N-O 2.92Å; I284-R300 PolarHBondContact O-N 2.84Å; I284-V302 HydrophobicContact CD1-CG2 3.62Å; I284-V302 HydrophobicContact CG1-CG2 4.26Å; I284-F308 HydrophobicContact CD1-CD2 4.45Å; I284-F308 HydrophobicContact CD1-CE2 3.58Å; I284-F308 HydrophobicContact CD1-CZ 3.95Å; I284-F308 HydrophobicContact CG1-CE2 4.4Å; I284-L310 HydrophobicContact CD1-CD2 4.49Å; I284-L310 HydrophobicContact CG1-CD2 4.35Å; I284-E314 HydrophobicContact CG2-CB 3.76Å; I284-E314 HydrophobicContact CG2-CG 3.81Å; I284-Q315 CarbonylContact C-O 3.52Å; I284-Q315 WeakPolarHBondContact CA-O 3.25Å; I284-L316 HydrophobicContact CG1-CD2 4.06Å
285	L	93.4	Very high	91.5	Very high	46 Å²	46	49.5 Å²	49.5	24%	0.241	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	144.1	168.9	-58.6	-178.3	0	0	0	110	K299 Q315 E317	L285-K299 HydrophobicContact CD2-CD 4.12Å; L285-K299 HydrophobicContact CD2-CG 3.85Å; L285-Q315 PolarHBondContact N-O 3.33Å; L285-Q315 PolarHBondContact O-N 2.7Å; L285-E317 HydrophobicContact CD1-CB 4.15Å; L285-E317 HydrophobicContact CD1-CG 4.34Å; L285-E317 HydrophobicContact CD2-CB 3.89Å; L285-E317 HydrophobicContact CD2-CG 4.11Å; L285-E317 HydrophobicContact CG-CB 3.93Å; L285-E317 HydrophobicContact CG-CG 4.46Å
286	D	93.8	Very high	91.3	Very high	47 Å²	47	52.7 Å²	52.7	25%	0.251	30%	0.304	S	S	.	.	S	Bend	trans	51.3	49.5	178.5	-58.3	-21.9	0	0	0	113.8	N294 L296 G297 Q298	D286-N294 HydrophobicContact CB-CB 4.35Å; D286-N294 PolarHBondContact O-OD1 3.24Å; D286-L296 HydrophobicContact CB-CD2 4.4Å; D286-L296 WeakPolarHBondContact OD1-CA 3.38Å; D286-G297 PolarHBondContact OD1-N 2.97Å; D286-Q298 PolarHBondContact N-O 2.83Å
287	P	93.9	Very high	90.9	Very high	5 Å²	5	56 Å²	56	3%	0.032	34%	0.338	C	S	.	.			trans	-59.7	142.3	-172.5	28.1	-37	0	0	0	111.9	I284 G289 Q295 Q298 R300 E314	I284-P287 HydrophobicContact CG2-CB 4.27Å; P287-G289 PolarHBondContact O-N 3.2Å; P287-Q295 WeakPolarHBondContact O-CB 3.46Å; P287-Q295 PolarHBondContact O-N 3.41Å; P287-Q298 VanDerWaalsContact CD-O 3.26Å; P287-Q298 WeakPolarHBondContact CD-O 3.4Å; P287-Q298 HydrophobicContact CG-CB 4.32Å; P287-R300 HydrophobicContact CB-CB 3.71Å; P287-R300 HydrophobicContact CG-CB 3.81Å; P287-E314 WeakPolarHBondContact CA-OE1 3.35Å
288	V	92.4	Very high	90.8	Very high	29 Å²	29	60.4 Å²	60.4	18%	0.176	35%	0.353	C	S	.	.	B	Isolated β-bridge	trans	-69	126.6	174	174.5	0	0	0	0	109.9	K293 N294 R300 Q311 E314	V288-K293 WeakPolarHBondContact CA-O 3.26Å; V288-N294 WeakPolarHBondContact CG2-OD1 3.42Å; V288-R300 PolarHBondContact O-NH1 3.05Å; V288-R300 VanDerWaalsContact O-NH1 3.1Å; V288-Q311 HydrophobicContact CB-CB 4.17Å; V288-Q311 HydrophobicContact CB-CG 4.3Å; V288-Q311 HydrophobicContact CG2-CB 3.47Å; V288-Q311 VanDerWaalsContact CG2-CB 3.47Å; V288-Q311 HydrophobicContact CG2-CG 4.12Å; V288-E314 HydrophobicContact CG2-CG 4.19Å; V288-E314 PolarHBondContact N-OE1 3.23Å
289	G	89.3	Confident	90.8	Very high	9 Å²	9	60.5 Å²	60.5	9%	0.093	34%	0.344	C	S	.	.			trans	-80.2	175.1	173.1	0	0	0	0	0	114.1	P287 D291 G292 K293	P287-G289 PolarHBondContact O-N 3.2Å; G289-D291 WeakPolarHBondContact CA-OD1 3.23Å; G289-D291 PolarHBondContact O-N 3.03Å; G289-G292 PolarHBondContact O-N 2.77Å; G289-K293 PolarHBondContact N-O 2.77Å
290	P	87.8	Confident	90.9	Very high	143 Å²	143	60.9 Å²	60.9	93%	0.929	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-16.3	176.1	28.4	-35	0	0	0	113.3
291	D	84.3	Confident	90.9	Very high	105 Å²	105	60.8 Å²	60.8	56%	0.561	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-2.3	172.2	63.4	-29.5	0	0	0	113.4	G289 K293	G289-D291 WeakPolarHBondContact CA-OD1 3.23Å; G289-D291 PolarHBondContact O-N 3.03Å; D291-K293 VanDerWaalsContact C-N 3.32Å
292	G	84.7	Confident	90.8	Very high	58 Å²	58	61.3 Å²	61.3	60%	0.598	35%	0.347	S	S	*	.	S	Bend	trans	76.1	16.6	179.1	0	0	0	0	0	113.9	G289	G289-G292 PolarHBondContact O-N 2.77Å
293	K	88.6	Confident	90.6	Very high	128 Å²	128	67.4 Å²	67.4	56%	0.557	37%	0.374	S	S	*	.	S	Bend	trans	-118.3	150.6	179.6	-64	-179	179.9	178.5	0	111.9	V288 G289 D291	V288-K293 WeakPolarHBondContact CA-O 3.26Å; G289-K293 PolarHBondContact N-O 2.77Å; D291-K293 VanDerWaalsContact C-N 3.32Å
294	N	91.5	Very high	90.1	Very high	58 Å²	58	68.1 Å²	68.1	31%	0.31	38%	0.384	S	S	.	.	B	Isolated β-bridge	trans	-69.9	129.2	176	-65.7	-28.3	0	0	0	111.1	D286 V288 L296 P312	D286-N294 HydrophobicContact CB-CB 4.35Å; D286-N294 PolarHBondContact O-OD1 3.24Å; V288-N294 WeakPolarHBondContact CG2-OD1 3.42Å; N294-L296 HydrophobicContact CB-CD2 4.32Å; N294-L296 PolarHBondContact O-N 2.87Å; N294-P312 PolarHBondContact ND2-O 3.02Å; N294-P312 PolarHBondContact OD1-O 3.22Å
295	Q	92.3	Very high	89.9	Confident	82 Å²	82	75.9 Å²	75.9	38%	0.383	42%	0.42	S	S	.	.			trans	-86	82.4	175	-63.6	174.5	41.3	0	0	109.8	P287 G297 Q298	P287-Q295 WeakPolarHBondContact O-CB 3.46Å; P287-Q295 PolarHBondContact O-N 3.41Å; Q295-G297 PolarHBondContact O-N 2.96Å; Q295-Q298 HydrophobicContact CB-CB 3.95Å; Q295-Q298 HydrophobicContact CB-CG 3.95Å; Q295-Q298 WeakPolarHBondContact O-CB 3.39Å; Q295-Q298 PolarHBondContact O-N 2.75Å
296	L	88.4	Confident	89.9	Confident	140 Å²	140	79.3 Å²	79.3	73%	0.733	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	127.6	-174.7	-58.4	178.1	0	0	0	112.5	D286 N294 Q298	D286-L296 HydrophobicContact CB-CD2 4.4Å; D286-L296 WeakPolarHBondContact OD1-CA 3.38Å; N294-L296 HydrophobicContact CB-CD2 4.32Å; N294-L296 PolarHBondContact O-N 2.87Å; L296-Q298 VanDerWaalsContact C-N 3.31Å
297	G	85.8	Confident	89.8	Confident	70 Å²	70	80.5 Å²	80.5	72%	0.722	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.1	-2	-179.1	0	0	0	0	0	115.1	D286 Q295	D286-G297 PolarHBondContact OD1-N 2.97Å; Q295-G297 PolarHBondContact O-N 2.96Å
298	Q	88.9	Confident	89.8	Confident	112 Å²	112	82.1 Å²	82.1	52%	0.523	45%	0.451	S	S	.	.			trans	-89.6	159	175	-66	-70.3	-6.7	0	0	111.6	D286 P287 Q295 L296	D286-Q298 PolarHBondContact N-O 2.83Å; P287-Q298 VanDerWaalsContact CD-O 3.26Å; P287-Q298 WeakPolarHBondContact CD-O 3.4Å; P287-Q298 HydrophobicContact CG-CB 4.32Å; Q295-Q298 HydrophobicContact CB-CB 3.95Å; Q295-Q298 HydrophobicContact CB-CG 3.95Å; Q295-Q298 WeakPolarHBondContact O-CB 3.39Å; Q295-Q298 PolarHBondContact O-N 2.75Å; L296-Q298 VanDerWaalsContact C-N 3.31Å
299	K	90.9	Very high	90	Very high	87 Å²	87	82.2 Å²	82.2	38%	0.378	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	136.3	177	-58.7	-172.7	175.7	-169.5	0	110.2	V283 I284 L285 E317 A369	V283-K299 HydrophobicContact CG1-CB 3.89Å; V283-K299 HydrophobicContact CG1-CD 4.16Å; V283-K299 HydrophobicContact CG1-CG 4.39Å; I284-K299 CarbonylContact O-C 3.54Å; I284-K299 WeakPolarHBondContact O-CA 3.39Å; L285-K299 HydrophobicContact CD2-CD 4.12Å; L285-K299 HydrophobicContact CD2-CG 3.85Å; K299-E317 WeakPolarHBondContact CE-OE2 3.27Å; K299-E317 IonicContact NZ-OE1 3.57Å; K299-E317 PolarHBondContact NZ-OE1 2.9Å; K299-E317 IonicContact NZ-OE2 3.15Å; K299-E317 PolarHBondContact NZ-OE2 2.94Å; K299-A369 HydrophobicContact CB-CB 4.12Å
300	R	91.4	Very high	90.2	Very high	95 Å²	95	83.4 Å²	83.4	36%	0.358	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	117.3	174	-177.5	173.5	67.6	-153.1	-5.5	109.9	I284 P287 V288 V302 E314	I284-R300 PolarHBondContact N-O 2.92Å; I284-R300 PolarHBondContact O-N 2.84Å; P287-R300 HydrophobicContact CB-CB 3.71Å; P287-R300 HydrophobicContact CG-CB 3.81Å; V288-R300 PolarHBondContact O-NH1 3.05Å; V288-R300 VanDerWaalsContact O-NH1 3.1Å; R300-V302 HydrophobicContact CG-CG2 4.43Å; R300-E314 IonicContact CZ-OE1 2.62Å; R300-E314 IonicContact NH2-OE1 3.9Å; R300-E314 PolarHBondContact NH2-OE1 3.05Å; R300-E314 IonicContact NH2-OE2 2.85Å
301	V	92.6	Very high	90.6	Very high	42 Å²	42	80.2 Å²	80.2	26%	0.255	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	126.3	173.7	-174.3	0	0	0	0	108.9	Y281 V283 V366 A369	Y281-V301 HydrophobicContact CD2-CG1 4.04Å; V283-V301 HydrophobicContact CG2-CG2 4.24Å; V301-V366 HydrophobicContact CG1-CG1 3.73Å; V301-A369 HydrophobicContact CG2-CB 4.08Å
302	V	92.7	Very high	91	Very high	18 Å²	18	76.1 Å²	76.1	11%	0.109	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	123.4	173.1	-173.9	0	0	0	0	107.7	L276 Y281 C282 I284 R300 K306 F308	L276-V302 HydrophobicContact CD1-CB 4.14Å; L276-V302 HydrophobicContact CD1-CG1 3.79Å; L276-V302 WeakPolarHBondContact CD1-O 3.37Å; Y281-V302 CarbonylContact C-O 3.59Å; Y281-V302 WeakPolarHBondContact CA-O 3.48Å; Y281-V302 WeakPolarHBondContact CB-O 3.49Å; C282-V302 PolarHBondContact N-O 2.83Å; C282-V302 PolarHBondContact O-N 2.64Å; I284-V302 HydrophobicContact CD1-CG2 3.62Å; I284-V302 HydrophobicContact CG1-CG2 4.26Å; R300-V302 HydrophobicContact CG-CG2 4.43Å; V302-K306 HydrophobicContact CG1-CD 4.03Å; V302-F308 HydrophobicContact CB-CE1 4.36Å; V302-F308 HydrophobicContact CB-CZ 4.48Å; V302-F308 HydrophobicContact CG1-CD1 4.35Å; V302-F308 HydrophobicContact CG1-CE1 3.84Å; V302-F308 HydrophobicContact CG1-CZ 4.42Å
303	K	90.3	Very high	91.3	Very high	128 Å²	128	75.3 Å²	75.3	56%	0.557	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.6	160.5	-179.7	68.6	176.3	-176.9	174.9	0	111.8	V366	K303-V366 HydrophobicContact CB-CG1 4.26Å; K303-V366 HydrophobicContact CB-CG2 4.24Å; K303-V366 HydrophobicContact CD-CB 3.97Å; K303-V366 HydrophobicContact CD-CG1 4.19Å; K303-V366 HydrophobicContact CD-CG2 3.96Å
304	G	85.1	Confident	91.6	Very high	28 Å²	28	69.9 Å²	69.9	29%	0.289	37%	0.374	S	S	.	.	S	Bend	trans	84.5	170.5	179.6	0	0	0	0	0	112.9	K306	G304-K306 PolarHBondContact O-N 2.94Å
305	E	90.4	Very high	91.6	Very high	163 Å²	163	73.5 Å²	73.5	76%	0.762	39%	0.389	S	S	*	.	S	Bend	trans	-62.9	100.4	-178.2	-169.4	179.3	174.5	0	0	110.7	L276	L276-E305 WeakPolarHBondContact O-CA 3.14Å
306	K	91.9	Very high	91.7	Very high	118 Å²	118	71.7 Å²	71.7	51%	0.513	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	138.7	-175.8	-74.7	-173.4	178	177.5	0	109.8	L276 V302 G304	L276-K306 PolarHBondContact N-O 3.01Å; L276-K306 PolarHBondContact O-N 2.73Å; V302-K306 HydrophobicContact CG1-CD 4.03Å; G304-K306 PolarHBondContact O-N 2.94Å
307	S	92.8	Very high	91.8	Very high	72 Å²	72	69 Å²	69	50%	0.503	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	125.9	170	-62.5	0	0	0	0	108.8	T274 T275	T274-S307 WeakPolarHBondContact O-CA 3.48Å; T275-S307 WeakPolarHBondContact CG2-OG 3.38Å; T275-S307 PolarHBondContact OG1-OG 3.32Å; T275-S307 VanDerWaalsContact OG1-OG 3.05Å
308	F	94.3	Very high	92.1	Very high	39 Å²	39	72 Å²	72	17%	0.171	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	157.8	-178.4	65.5	-85	0	0	0	110.9	T274 L276 I284 V302 L310	T274-F308 WeakPolarHBondContact CA-O 3.48Å; T274-F308 WeakPolarHBondContact CB-O 3.44Å; T274-F308 HydrophobicContact CG2-CE1 4.33Å; T274-F308 HydrophobicContact CG2-CZ 4.04Å; T274-F308 PolarHBondContact N-O 3.46Å; T274-F308 PolarHBondContact O-N 2.85Å; L276-F308 HydrophobicContact CD1-CE1 3.91Å; L276-F308 HydrophobicContact CG-CE1 4.18Å; I284-F308 HydrophobicContact CD1-CD2 4.45Å; I284-F308 HydrophobicContact CD1-CE2 3.58Å; I284-F308 HydrophobicContact CD1-CZ 3.95Å; I284-F308 HydrophobicContact CG1-CE2 4.4Å; V302-F308 HydrophobicContact CB-CE1 4.36Å; V302-F308 HydrophobicContact CB-CZ 4.48Å; V302-F308 HydrophobicContact CG1-CD1 4.35Å; V302-F308 HydrophobicContact CG1-CE1 3.84Å; V302-F308 HydrophobicContact CG1-CZ 4.42Å; F308-L310 HydrophobicContact CE2-CD2 4.01Å
309	F	95.3	Very high	92.3	Very high	31 Å²	31	68.1 Å²	68.1	14%	0.136	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-95	138.5	172.3	-61.4	-79.6	0	0	0	109.7	A226 L250 T252 V271 I273 Q311	A226-F309 HydrophobicContact CB-CB 4.46Å; A226-F309 HydrophobicContact CB-CD1 3.59Å; A226-F309 HydrophobicContact CB-CD2 4.12Å; A226-F309 HydrophobicContact CB-CE1 3.72Å; A226-F309 HydrophobicContact CB-CE2 4.24Å; A226-F309 HydrophobicContact CB-CG 3.8Å; A226-F309 HydrophobicContact CB-CZ 4.05Å; L250-F309 HydrophobicContact CD1-CB 3.7Å; T252-F309 HydrophobicContact CG2-CD2 4.03Å; T252-F309 HydrophobicContact CG2-CE2 4.07Å; V271-F309 HydrophobicContact CG1-CD1 4.41Å; I273-F309 HydrophobicContact CB-CD1 4.06Å; I273-F309 HydrophobicContact CB-CE1 3.55Å; I273-F309 HydrophobicContact CB-CZ 3.92Å; I273-F309 HydrophobicContact CD1-CE1 4.45Å; I273-F309 HydrophobicContact CD1-CE2 4.14Å; I273-F309 HydrophobicContact CD1-CZ 3.99Å; I273-F309 HydrophobicContact CG1-CD1 4.37Å; I273-F309 HydrophobicContact CG1-CE1 4.09Å; I273-F309 HydrophobicContact CG1-CE2 4.45Å; I273-F309 HydrophobicContact CG1-CZ 4.14Å; F309-Q311 PolarHBondContact O-N 2.79Å
310	L	95.2	Very high	92.4	Very high	35 Å²	35	67.7 Å²	67.7	18%	0.183	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-67.3	122.6	170.3	-70.4	170.6	0	0	0	109	L250 I284 F308 E314 L316	L250-L310 WeakPolarHBondContact CD1-O 3.32Å; I284-L310 HydrophobicContact CD1-CD2 4.49Å; I284-L310 HydrophobicContact CG1-CD2 4.35Å; F308-L310 HydrophobicContact CE2-CD2 4.01Å; L310-E314 HydrophobicContact CB-CB 4.41Å; L310-E314 HydrophobicContact CD2-CB 4.21Å; L310-L316 HydrophobicContact CD1-CD1 4.4Å; L310-L316 HydrophobicContact CD1-CG 4.03Å; L310-L316 HydrophobicContact CD2-CD2 3.83Å; L310-L316 HydrophobicContact CD2-CG 4.17Å
311	Q	94.6	Very high	92.4	Very high	76 Å²	76	64.7 Å²	64.7	36%	0.355	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-71.6	162	179.8	-62.2	-64.1	-34	0	0	111.3	V288 F309 G313 E314	V288-Q311 HydrophobicContact CB-CB 4.17Å; V288-Q311 HydrophobicContact CB-CG 4.3Å; V288-Q311 HydrophobicContact CG2-CB 3.47Å; V288-Q311 VanDerWaalsContact CG2-CB 3.47Å; V288-Q311 HydrophobicContact CG2-CG 4.12Å; F309-Q311 PolarHBondContact O-N 2.79Å; Q311-G313 PolarHBondContact O-N 3Å; Q311-G313 VanDerWaalsContact O-N 3.1Å; Q311-E314 HydrophobicContact CB-CG 3.97Å; Q311-E314 PolarHBondContact N-OE2 3.39Å; Q311-E314 WeakPolarHBondContact O-CB 2.95Å; Q311-E314 PolarHBondContact O-N 2.85Å
312	P	94	Very high	92.4	Very high	18 Å²	18	68.3 Å²	68.3	12%	0.117	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	118	179.9	-28.1	38.2	0	0	0	112.7	E248 L250 N294	E248-P312 HydrophobicContact CB-CB 3.63Å; E248-P312 HydrophobicContact CB-CG 3.97Å; L250-P312 HydrophobicContact CD2-CG 4.34Å; L250-P312 HydrophobicContact CG-CG 4.37Å; N294-P312 PolarHBondContact ND2-O 3.02Å; N294-P312 PolarHBondContact OD1-O 3.22Å
313	G	90.4	Very high	92.4	Very high	42 Å²	42	68.1 Å²	68.1	43%	0.433	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.2	-5.4	-177.1	0	0	0	0	0	115.3	Q311	Q311-G313 PolarHBondContact O-N 3Å; Q311-G313 VanDerWaalsContact O-N 3.1Å
314	E	94.8	Very high	92.4	Very high	13 Å²	13	65 Å²	65	6%	0.061	34%	0.343	C	S	.	.			trans	-76.1	141.6	168.7	-67.6	-173	155.8	0	0	110.9	I284 P287 V288 R300 L310 Q311	I284-E314 HydrophobicContact CG2-CB 3.76Å; I284-E314 HydrophobicContact CG2-CG 3.81Å; P287-E314 WeakPolarHBondContact CA-OE1 3.35Å; V288-E314 HydrophobicContact CG2-CG 4.19Å; V288-E314 PolarHBondContact N-OE1 3.23Å; R300-E314 IonicContact CZ-OE1 2.62Å; R300-E314 IonicContact NH2-OE1 3.9Å; R300-E314 PolarHBondContact NH2-OE1 3.05Å; R300-E314 IonicContact NH2-OE2 2.85Å; L310-E314 HydrophobicContact CB-CB 4.41Å; L310-E314 HydrophobicContact CD2-CB 4.21Å; Q311-E314 HydrophobicContact CB-CG 3.97Å; Q311-E314 PolarHBondContact N-OE2 3.39Å; Q311-E314 WeakPolarHBondContact O-CB 2.95Å; Q311-E314 PolarHBondContact O-N 2.85Å
315	Q	92.6	Very high	92.7	Very high	134 Å²	134	67.9 Å²	67.9	63%	0.626	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.1	152.2	175.2	-62	-175.8	0.9	0	0	110.3	I284 L285	I284-Q315 CarbonylContact C-O 3.52Å; I284-Q315 WeakPolarHBondContact CA-O 3.25Å; L285-Q315 PolarHBondContact N-O 3.33Å; L285-Q315 PolarHBondContact O-N 2.7Å
316	L	93.8	Very high	92.7	Very high	45 Å²	45	60.7 Å²	60.7	24%	0.236	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	128.6	173.2	-61.6	179.1	0	0	0	109.7	T274 C282 V283 I284 L310	T274-L316 HydrophobicContact CG2-CD1 4.28Å; C282-L316 HydrophobicContact CB-CD2 3.94Å; V283-L316 WeakPolarHBondContact O-CA 3.37Å; I284-L316 HydrophobicContact CG1-CD2 4.06Å; L310-L316 HydrophobicContact CD1-CD1 4.4Å; L310-L316 HydrophobicContact CD1-CG 4.03Å; L310-L316 HydrophobicContact CD2-CD2 3.83Å; L310-L316 HydrophobicContact CD2-CG 4.17Å
317	E	90.9	Very high	92.6	Very high	82 Å²	82	57.6 Å²	57.6	38%	0.383	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	-47.9	-177.4	-172.6	172.6	-164.8	0	0	112.6	V283 L285 K299	V283-E317 HydrophobicContact CB-CB 4.19Å; V283-E317 HydrophobicContact CG1-CB 4.49Å; V283-E317 PolarHBondContact O-N 2.92Å; L285-E317 HydrophobicContact CD1-CB 4.15Å; L285-E317 HydrophobicContact CD1-CG 4.34Å; L285-E317 HydrophobicContact CD2-CB 3.89Å; L285-E317 HydrophobicContact CD2-CG 4.11Å; L285-E317 HydrophobicContact CG-CB 3.93Å; L285-E317 HydrophobicContact CG-CG 4.46Å; K299-E317 WeakPolarHBondContact CE-OE2 3.27Å; K299-E317 IonicContact NZ-OE1 3.57Å; K299-E317 PolarHBondContact NZ-OE1 2.9Å; K299-E317 IonicContact NZ-OE2 3.15Å; K299-E317 PolarHBondContact NZ-OE2 2.94Å
318	Q	91.3	Very high	92.3	Very high	135 Å²	135	61.6 Å²	61.6	63%	0.631	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.2	38.5	178.1	-60.8	-175.8	-15	0	0	110.9	Q321	Q318-Q321 HydrophobicContact CB-CG 4.28Å
319	G	92.4	Very high	92.1	Very high	29 Å²	29	65.1 Å²	65.1	30%	0.299	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	62.3	-148.6	-177.2	0	0	0	0	0	113.4	C282	C282-G319 WeakPolarHBondContact CB-O 3.42Å
320	I	93.9	Very high	91.8	Very high	79 Å²	79	66.7 Å²	66.7	41%	0.405	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	124.1	172.6	-59.2	171.7	0	0	0	107.6	T274 L276 N280	T274-I320 HydrophobicContact CG2-CD1 4.18Å; T274-I320 HydrophobicContact CG2-CG1 4.29Å; L276-I320 HydrophobicContact CD2-CB 4.43Å; L276-I320 HydrophobicContact CD2-CG1 4.1Å; L276-I320 HydrophobicContact CD2-CG2 3.72Å; N280-I320 HydrophobicContact CB-CG2 3.82Å; N280-I320 WeakPolarHBondContact ND2-CG2 3.39Å
321	Q	91.8	Very high	91.6	Very high	32 Å²	32	65.1 Å²	65.1	15%	0.15	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	153.4	-177.7	-64.6	175.6	59.1	0	0	110.4	N280 Y281 Q318	N280-Q321 CarbonylContact C-O 3.6Å; N280-Q321 VanDerWaalsContact CA-O 3.28Å; N280-Q321 WeakPolarHBondContact CA-O 3.39Å; Y281-Q321 HydrophobicContact CD1-CB 4.04Å; Y281-Q321 HydrophobicContact CE1-CB 3.64Å; Y281-Q321 HydrophobicContact CE2-CB 4.46Å; Y281-Q321 PolarHBondContact N-O 2.85Å; Y281-Q321 PolarHBondContact O-N 2.9Å; Y281-Q321 VanDerWaalsContact O-O 3.05Å; Y281-Q321 PolarHBondContact OH-OE1 2.77Å; Q318-Q321 HydrophobicContact CB-CG 4.28Å
322	D	92	Very high	91.5	Very high	118 Å²	118	61.5 Å²	61.5	63%	0.631	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.7	136.2	175.5	-62.1	-36.9	0	0	0	110.2	H279 Y281	H279-D322 WeakPolarHBondContact O-CA 3.41Å; Y281-D322 VanDerWaalsContact CE1-O 3.29Å; Y281-D322 WeakPolarHBondContact CE1-O 3.29Å
323	V	91.8	Very high	91.3	Very high	14 Å²	14	61.2 Å²	61.2	9%	0.085	32%	0.323	C	S	.	.			trans	-61.6	140.3	174.8	176.2	0	0	0	0	109.1	H279 Y281 V325 E364 Y365 V366	H279-V323 WeakPolarHBondContact O-CB 3.29Å; H279-V323 WeakPolarHBondContact O-CG2 3.4Å; H279-V323 PolarHBondContact O-N 3.25Å; Y281-V323 HydrophobicContact CD1-CG2 4Å; V323-V325 PolarHBondContact O-N 2.99Å; V323-E364 HydrophobicContact CG1-CB 3.93Å; V323-Y365 WeakPolarHBondContact CG1-O 3.48Å; V323-V366 HydrophobicContact CB-CG2 4.26Å; V323-V366 HydrophobicContact CG1-CG2 3.73Å; V323-V366 HydrophobicContact CG2-CG2 3.71Å
324	Y	90.8	Very high	91.3	Very high	61 Å²	61	59.2 Å²	59.2	24%	0.239	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	103.6	177.9	-67.8	-88.5	0	0	0	110.2	L326 L332 E364 Y365 P367 V373 E376	Y324-L326 PolarHBondContact O-N 2.63Å; Y324-L332 HydrophobicContact CD1-CD1 3.97Å; Y324-L332 HydrophobicContact CD1-CD2 4.15Å; Y324-L332 HydrophobicContact CD2-CD1 4.24Å; Y324-L332 HydrophobicContact CG-CD1 3.72Å; Y324-E364 WeakPolarHBondContact O-CA 3.41Å; Y324-Y365 WeakPolarHBondContact CB-O 3.47Å; Y324-Y365 PolarHBondContact N-O 2.92Å; Y324-Y365 PolarHBondContact O-N 2.85Å; Y324-P367 HydrophobicContact CD2-CG 4.13Å; Y324-P367 HydrophobicContact CE2-CG 3.77Å; Y324-V373 HydrophobicContact CE2-CG2 4.07Å; Y324-E376 VanDerWaalsContact CE1-OE1 3.32Å; Y324-E376 WeakPolarHBondContact CE1-OE1 3.26Å
325	V	91	Very high	91.1	Very high	89 Å²	89	62.7 Å²	62.7	54%	0.539	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	101.5	174.7	-173.9	0	0	0	0	108.7	V323 E364	V323-V325 PolarHBondContact O-N 2.99Å; V325-E364 HydrophobicContact CG2-CG 4.31Å
326	L	91.5	Very high	90.9	Very high	13 Å²	13	56.4 Å²	56.4	7%	0.068	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	123.8	-177.8	-59.1	171.7	0	0	0	110.2	Y324 Q330 L332 I359 P362 L363	Y324-L326 PolarHBondContact O-N 2.63Å; L326-Q330 HydrophobicContact CB-CB 4.43Å; L326-Q330 HydrophobicContact CD2-CB 4.09Å; L326-L332 HydrophobicContact CD1-CD1 4Å; L326-L332 HydrophobicContact CD1-CG 3.81Å; L326-L332 HydrophobicContact CD2-CD1 4.14Å; L326-L332 HydrophobicContact CD2-CD2 3.93Å; L326-L332 HydrophobicContact CD2-CG 3.65Å; L326-L332 HydrophobicContact CG-CD1 4.41Å; L326-L332 HydrophobicContact CG-CG 4.27Å; L326-I359 HydrophobicContact CD1-CD1 3.93Å; L326-I359 HydrophobicContact CD1-CG1 4.18Å; L326-P362 VanDerWaalsContact O-CA 3.26Å; L326-P362 WeakPolarHBondContact O-CA 3.49Å; L326-L363 HydrophobicContact CD1-CD1 4.14Å; L326-L363 HydrophobicContact CD1-CG 4.48Å; L326-L363 PolarHBondContact N-O 2.98Å; L326-L363 PolarHBondContact O-N 3.47Å
327	S	89.7	Confident	90.6	Very high	52 Å²	52	58.6 Å²	58.6	36%	0.364	30%	0.297	S	S	.	.			trans	-74.7	169.4	167.1	64.5	0	0	0	0	112.1	Q329 Q330 G361	S327-Q329 PolarHBondContact O-N 3.04Å; S327-Q330 VanDerWaalsContact N-OE1 3.09Å; S327-Q330 PolarHBondContact O-N 3.06Å; S327-Q330 VanDerWaalsContact OG-CD 3.31Å; S327-Q330 WeakPolarHBondContact OG-CG 3.28Å; S327-Q330 PolarHBondContact OG-OE1 2.92Å; S327-G361 VanDerWaalsContact O-CA 3.3Å; S327-G361 WeakPolarHBondContact O-CA 3.29Å
328	E	86.9	Confident	90.3	Very high	157 Å²	157	59.6 Å²	59.6	73%	0.734	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-24.1	175.1	-61.7	-175.1	173.2	0	0	113.7	P362	E328-P362 HydrophobicContact CG-CB 4.2Å; E328-P362 HydrophobicContact CG-CG 3.99Å
329	Q	88.4	Confident	90.1	Very high	113 Å²	113	57.5 Å²	57.5	53%	0.528	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	0.9	-179.4	-62.4	-176.9	-0.3	0	0	113.2	S327 A379 M407	S327-Q329 PolarHBondContact O-N 3.04Å; Q329-A379 HydrophobicContact CB-CB 4.12Å; Q329-A379 WeakPolarHBondContact O-CB 3.26Å; Q329-A379 PolarHBondContact O-N 2.86Å; Q329-M407 VanDerWaalsContact C-CE 3.48Å; Q329-M407 VanDerWaalsContact O-CE 3.25Å; Q329-M407 WeakPolarHBondContact O-CE 3.37Å
330	Q	90.3	Very high	89.7	Confident	64 Å²	64	56.9 Å²	56.9	30%	0.299	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	151	-179.7	-72.8	167.4	-47.8	0	0	110.9	L326 S327 G361 R377	L326-Q330 HydrophobicContact CB-CB 4.43Å; L326-Q330 HydrophobicContact CD2-CB 4.09Å; S327-Q330 VanDerWaalsContact N-OE1 3.09Å; S327-Q330 PolarHBondContact O-N 3.06Å; S327-Q330 VanDerWaalsContact OG-CD 3.31Å; S327-Q330 WeakPolarHBondContact OG-CG 3.28Å; S327-Q330 PolarHBondContact OG-OE1 2.92Å; Q330-G361 PolarHBondContact O-N 3.47Å; Q330-R377 CarbonylContact C-O 3.53Å; Q330-R377 WeakPolarHBondContact CA-O 3.48Å
331	G	90.8	Very high	89	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.01	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	160.7	174.2	0	0	0	0	0	111.3	I359 R377	G331-I359 CarbonylContact C-O 3.5Å; G331-I359 WeakPolarHBondContact CA-O 3.38Å; G331-R377 PolarHBondContact N-O 3.06Å; G331-R377 PolarHBondContact O-N 3.39Å
332	L	91.8	Very high	87.9	Confident	1 Å²	1	60.2 Å²	60.2	1%	0.005	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	128.6	176.1	-61.2	176.2	0	0	0	109.6	Y324 L326 L334 L358 I359 Y365 V373 E376	Y324-L332 HydrophobicContact CD1-CD1 3.97Å; Y324-L332 HydrophobicContact CD1-CD2 4.15Å; Y324-L332 HydrophobicContact CD2-CD1 4.24Å; Y324-L332 HydrophobicContact CG-CD1 3.72Å; L326-L332 HydrophobicContact CD1-CD1 4Å; L326-L332 HydrophobicContact CD1-CG 3.81Å; L326-L332 HydrophobicContact CD2-CD1 4.14Å; L326-L332 HydrophobicContact CD2-CD2 3.93Å; L326-L332 HydrophobicContact CD2-CG 3.65Å; L326-L332 HydrophobicContact CG-CD1 4.41Å; L326-L332 HydrophobicContact CG-CG 4.27Å; L332-L334 HydrophobicContact CB-CD2 3.97Å; L332-L334 HydrophobicContact CB-CG 4.37Å; L332-L358 WeakPolarHBondContact O-CA 3.44Å; L332-L358 WeakPolarHBondContact O-CD1 3.48Å; L332-I359 HydrophobicContact CB-CD1 4.08Å; L332-I359 HydrophobicContact CB-CG1 3.78Å; L332-I359 HydrophobicContact CD1-CD1 4.17Å; L332-I359 HydrophobicContact CG-CD1 4.46Å; L332-I359 PolarHBondContact N-O 3.38Å; L332-I359 PolarHBondContact O-N 2.63Å; L332-Y365 HydrophobicContact CD1-CD1 3.78Å; L332-Y365 HydrophobicContact CD1-CG 4.36Å; L332-V373 HydrophobicContact CB-CG1 4.44Å; L332-V373 HydrophobicContact CD2-CG1 3.99Å; L332-E376 HydrophobicContact CD2-CB 4.17Å; L332-E376 HydrophobicContact CD2-CG 3.64Å
333	L	90.7	Very high	86.4	Confident	11 Å²	11	56.8 Å²	56.8	6%	0.058	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	115	166.4	-171.7	69.7	0	0	0	108.1	H356 V374 E375 Q410	L333-H356 HydrophobicContact CD1-CB 4.45Å; L333-V374 HydrophobicContact CD2-CB 4.39Å; L333-V374 HydrophobicContact CD2-CG1 4.31Å; L333-V374 HydrophobicContact CG-CB 4.48Å; L333-V374 PolarHBondContact O-N 2.8Å; L333-E375 HydrophobicContact CB-CB 4.05Å; L333-E375 HydrophobicContact CD2-CB 4.28Å; L333-E375 PolarHBondContact N-O 2.81Å; L333-E375 PolarHBondContact O-N 3.21Å; L333-Q410 HydrophobicContact CD1-CB 3.97Å
334	L	90.8	Very high	84.6	Confident	0 Å²	0	65 Å²	65	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	149.9	-176.6	-58.8	177.9	0	0	0	110.2	L332 H356 W357 I359 Y365 V371 E372 V373	L332-L334 HydrophobicContact CB-CD2 3.97Å; L332-L334 HydrophobicContact CB-CG 4.37Å; L334-H356 VanDerWaalsContact O-CA 3.24Å; L334-H356 WeakPolarHBondContact O-CA 3.27Å; L334-W357 HydrophobicContact CB-CD2 4Å; L334-W357 HydrophobicContact CB-CE3 4.4Å; L334-W357 HydrophobicContact CB-CH2 4.14Å; L334-W357 HydrophobicContact CB-CZ2 3.71Å; L334-W357 HydrophobicContact CB-CZ3 4.47Å; L334-W357 HydrophobicContact CD1-CZ2 3.95Å; L334-W357 PolarHBondContact N-O 3.24Å; L334-W357 PolarHBondContact O-N 3.46Å; L334-W357 VanDerWaalsContact O-N 3.11Å; L334-I359 HydrophobicContact CD1-CD1 3.8Å; L334-I359 HydrophobicContact CD1-CG1 3.89Å; L334-I359 HydrophobicContact CD1-CG2 3.94Å; L334-I359 HydrophobicContact CG-CD1 4.47Å; L334-I359 HydrophobicContact CG-CG1 4.3Å; L334-Y365 HydrophobicContact CD1-CE1 3.78Å; L334-Y365 HydrophobicContact CD1-CE2 4.08Å; L334-Y365 VanDerWaalsContact CD1-CZ 3.47Å; L334-Y365 WeakPolarHBondContact CD1-OH 3.44Å; L334-Y365 HydrophobicContact CD2-CD1 4.38Å; L334-Y365 HydrophobicContact CD2-CE1 3.66Å; L334-Y365 HydrophobicContact CG-CE1 4.38Å; L334-V371 HydrophobicContact CB-CG1 3.86Å; L334-V371 HydrophobicContact CD1-CG1 4.26Å; L334-V371 HydrophobicContact CD2-CG1 4Å; L334-V371 HydrophobicContact CG-CG1 4.26Å; L334-E372 WeakPolarHBondContact CA-O 3.26Å; L334-V373 HydrophobicContact CD2-CB 4.42Å; L334-V373 HydrophobicContact CD2-CG2 3.85Å
335	R	89.9	Confident	82.5	Confident	87 Å²	87	68.9 Å²	68.9	33%	0.328	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	130.7	172.6	178.5	175	74.4	-179.2	3.5	110.6	D355 V371 E372 V374	R335-D355 WeakPolarHBondContact CA-O 3.36Å; R335-V371 WeakPolarHBondContact O-CA 3.3Å; R335-E372 IonicContact CZ-OE2 3.38Å; R335-E372 PolarHBondContact N-O 2.87Å; R335-E372 IonicContact NE-OE2 3.55Å; R335-E372 PolarHBondContact NE-OE2 3.41Å; R335-E372 IonicContact NH2-OE1 2.89Å; R335-E372 PolarHBondContact NH2-OE1 2.88Å; R335-E372 IonicContact NH2-OE2 3.6Å; R335-E372 PolarHBondContact NH2-OE2 2.85Å; R335-E372 PolarHBondContact O-N 2.79Å; R335-V374 HydrophobicContact CB-CG2 3.41Å; R335-V374 VanDerWaalsContact CB-CG2 3.41Å
336	A	89.1	Confident	80.2	Confident	1 Å²	1	74.3 Å²	74.3	1%	0.008	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	121.9	174.1	0	0	0	0	0	110.2	L340 H351 Q352 G354 D355 W357	A336-L340 HydrophobicContact CB-CD2 4.03Å; A336-H351 HydrophobicContact CB-CB 4.11Å; A336-Q352 VanDerWaalsContact CB-O 3.27Å; A336-Q352 WeakPolarHBondContact CB-O 3.45Å; A336-G354 PolarHBondContact O-N 3.25Å; A336-D355 PolarHBondContact N-O 2.87Å; A336-D355 VanDerWaalsContact N-O 3.09Å; A336-W357 HydrophobicContact CB-CH2 3.84Å; A336-W357 HydrophobicContact CB-CZ3 3.59Å; A336-W357 VanDerWaalsContact N-CZ3 3.3Å
337	L	86.9	Confident	78.5	Confident	91 Å²	91	81.7 Å²	81.7	48%	0.476	41%	0.412	S	S	.	.	S	Bend	trans	-81	-29.6	171.6	-61.3	176.8	0	0	0	111.7	K370 E372	L337-K370 WeakPolarHBondContact CB-O 3.3Å; L337-K370 PolarHBondContact N-O 3.29Å; L337-E372 HydrophobicContact CD1-CB 4.4Å; L337-E372 HydrophobicContact CD2-CB 4.36Å; L337-E372 HydrophobicContact CG-CB 4.33Å
338	Q	84.6	Confident	77.6	Confident	104 Å²	104	85.3 Å²	85.3	49%	0.486	42%	0.421	S	S	.	.	S	Bend	trans	-139.6	160	179	-66.2	-178.1	0.8	0	0	109.7	L340 K370	Q338-L340 PolarHBondContact O-N 3.31Å; Q338-K370 HydrophobicContact CB-CB 4.27Å; Q338-K370 HydrophobicContact CB-CD 4.11Å; Q338-K370 HydrophobicContact CB-CG 4.14Å
339	P	86.4	Confident	77.2	Confident	90 Å²	90	81.7 Å²	81.7	58%	0.584	41%	0.41	S	S	*	.			trans	-56.5	127.7	172.4	-22.3	33.8	0	0	0	110.9	H351	P339-H351 WeakPolarHBondContact CA-O 3.39Å
340	L	84.1	Confident	77	Confident	16 Å²	16	80.3 Å²	80.3	8%	0.084	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	155.1	-179.5	68.8	95.1	0	0	0	110.8	A336 Q338 E342 H351 W357 K370 V371	A336-L340 HydrophobicContact CB-CD2 4.03Å; Q338-L340 PolarHBondContact O-N 3.31Å; L340-E342 HydrophobicContact CD1-CB 3.76Å; L340-H351 HydrophobicContact CG-CB 4.41Å; L340-H351 PolarHBondContact N-O 2.9Å; L340-H351 VanDerWaalsContact N-O 3.17Å; L340-H351 PolarHBondContact O-N 2.85Å; L340-W357 HydrophobicContact CD2-CH2 4.43Å; L340-K370 HydrophobicContact CB-CD 4.13Å; L340-K370 HydrophobicContact CD2-CB 3.77Å; L340-V371 HydrophobicContact CD1-CG2 4.31Å; L340-V371 HydrophobicContact CD2-CG2 3.38Å
341	E	80.8	Confident	76.8	Confident	136 Å²	136	78.1 Å²	78.1	64%	0.636	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.8	123.7	170.6	-64.8	178.1	179.1	0	0	106.9	V349	E341-V349 WeakPolarHBondContact CA-O 3.23Å
342	E	68.2	Low	76.7	Confident	45 Å²	45	84.8 Å²	84.8	21%	0.21	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	134.3	-179.6	-160.2	169.9	-143.3	0	0	109.2	L340 V349 W357 Y365	L340-E342 HydrophobicContact CD1-CB 3.76Å; E342-V349 PolarHBondContact N-O 3.31Å; E342-V349 PolarHBondContact O-N 3.25Å; E342-W357 VanDerWaalsContact OE2-CZ2 3.27Å; E342-W357 WeakPolarHBondContact OE2-CZ2 3.22Å; E342-W357 PolarHBondContact OE2-NE1 2.96Å; E342-Y365 VanDerWaalsContact OE1-CE2 3.22Å; E342-Y365 WeakPolarHBondContact OE1-CE2 3.36Å; E342-Y365 PolarHBondContact OE1-OH 3.4Å
343	G	60.7	Low	76.4	Confident	46 Å²	46	87.7 Å²	87.7	47%	0.474	46%	0.457	S	S	.	.			trans	142	149.1	-176.9	0	0	0	0	0	113.1
344	E	52.7	Low	76.1	Confident	186 Å²	186	89 Å²	89	87%	0.869	47%	0.474	S	S	*	.	S	Bend	trans	-93.3	133.5	168.9	-68.7	-175.3	165.2	0	0	109.1
345	D	47.8	Very low	76	Confident	144 Å²	144	92.2 Å²	92.2	77%	0.77	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	-138.8	-179.5	-66.5	-32.8	0	0	0	116.7	E347	D345-E347 PolarHBondContact O-N 3.24Å
346	E	42.2	Very low	75.8	Confident	203 Å²	203	91.9 Å²	91.9	95%	0.949	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-3.6	-162.4	-64.2	-174.1	163.9	0	0	115.1
347	E	55.6	Low	75.9	Confident	167 Å²	167	92.8 Å²	92.8	78%	0.78	50%	0.496	S	S	*	.			trans	-111.9	46.5	-179	-63.1	-172.6	169.6	0	0	113.1	D345 V349	D345-E347 PolarHBondContact O-N 3.24Å; E347-V349 PolarHBondContact O-N 3.47Å
348	K	71.7	Confident	76	Confident	129 Å²	129	89.8 Å²	89.8	56%	0.561	48%	0.481	S	S	*	.	P	Polyproline II helix	trans	-70.1	116.8	172.8	-69.9	179.8	-176.1	-179.9	0	111.1
349	V	78.7	Confident	76.3	Confident	81 Å²	81	86.2 Å²	86.2	49%	0.491	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	123.4	172.4	-172.4	0	0	0	0	108.5	E341 E342 E347 H351	E341-V349 WeakPolarHBondContact CA-O 3.23Å; E342-V349 PolarHBondContact N-O 3.31Å; E342-V349 PolarHBondContact O-N 3.25Å; E347-V349 PolarHBondContact O-N 3.47Å; V349-H351 WeakPolarHBondContact CG1-NE2 3.37Å
350	S	84	Confident	76.4	Confident	83 Å²	83	88 Å²	88	58%	0.58	46%	0.46	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.6	126.3	176.4	-173.6	0	0	0	0	109.8
351	H	86.1	Confident	76.6	Confident	18 Å²	18	88 Å²	88	8%	0.083	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	131.9	177	-61.6	-74.7	0	0	0	110	A336 P339 L340 V349 D355 W357	A336-H351 HydrophobicContact CB-CB 4.11Å; P339-H351 WeakPolarHBondContact CA-O 3.39Å; L340-H351 HydrophobicContact CG-CB 4.41Å; L340-H351 PolarHBondContact N-O 2.9Å; L340-H351 VanDerWaalsContact N-O 3.17Å; L340-H351 PolarHBondContact O-N 2.85Å; V349-H351 WeakPolarHBondContact CG1-NE2 3.37Å; H351-D355 HydrophobicContact CB-CB 4.48Å; H351-W357 HydrophobicContact CB-CE3 4.34Å; H351-W357 HydrophobicContact CB-CH2 4.25Å; H351-W357 HydrophobicContact CB-CZ3 3.92Å; H351-W357 AromaticContact CD2-CE2 3.93Å; H351-W357 AromaticContact CD2-CZ2 3.97Å; H351-W357 AromaticContact CE1-CD1 3.82Å; H351-W357 AromaticContact CE1-CD2 3.38Å; H351-W357 AromaticContact CE1-CE2 3.81Å; H351-W357 AromaticContact CE1-CE3 3.73Å; H351-W357 AromaticContact CE1-CG 3.44Å; H351-W357 VanDerWaalsContact CE1-CG 3.44Å; H351-W357 AromaticContact CE1-NE1 3.99Å; H351-W357 AromaticContact CG-CE3 3.77Å; H351-W357 AromaticContact CG-CZ3 3.75Å; H351-W357 AromaticContact ND1-CD2 3.59Å; H351-W357 AromaticContact ND1-CE3 3.41Å; H351-W357 AromaticContact ND1-CZ3 3.89Å; H351-W357 AromaticContact NE2-CD1 3.95Å; H351-W357 AromaticContact NE2-CD2 3.75Å; H351-W357 AromaticContact NE2-CE2 3.66Å; H351-W357 AromaticContact NE2-CG 3.97Å; H351-W357 AromaticContact NE2-NE1 3.73Å
352	Q	87.6	Confident	77.1	Confident	141 Å²	141	86.2 Å²	86.2	66%	0.659	46%	0.464	S	S	*	.			trans	-82.6	160.3	172	-57.7	-170.8	3.6	0	0	110.6	A336 G354 D355	A336-Q352 VanDerWaalsContact CB-O 3.27Å; A336-Q352 WeakPolarHBondContact CB-O 3.45Å; Q352-G354 PolarHBondContact O-N 2.95Å; Q352-D355 WeakPolarHBondContact CB-OD2 3.34Å; Q352-D355 PolarHBondContact N-OD2 3.08Å; Q352-D355 WeakPolarHBondContact O-CB 3.44Å; Q352-D355 PolarHBondContact O-N 2.77Å; Q352-D355 VanDerWaalsContact O-N 3.08Å
353	A	86.8	Confident	78.1	Confident	62 Å²	62	87.5 Å²	87.5	51%	0.512	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	124.7	175.8	0	0	0	0	0	110.5
354	G	84.5	Confident	79.4	Confident	40 Å²	40	90.4 Å²	90.4	41%	0.412	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.7	-6.8	-177.2	0	0	0	0	0	115	A336 Q352 H356	A336-G354 PolarHBondContact O-N 3.25Å; Q352-G354 PolarHBondContact O-N 2.95Å; G354-H356 PolarHBondContact O-CE1 2.77Å; G354-H356 VanDerWaalsContact O-CE1 3.25Å; G354-H356 PolarHBondContact O-ND1 3.23Å
355	D	86.9	Confident	81.2	Confident	66 Å²	66	82.4 Å²	82.4	35%	0.353	43%	0.434	S	S	.	.			trans	-66.5	142.3	175.9	-73.3	-13.5	0	0	0	110.9	R335 A336 H351 Q352 W357	R335-D355 WeakPolarHBondContact CA-O 3.36Å; A336-D355 PolarHBondContact N-O 2.87Å; A336-D355 VanDerWaalsContact N-O 3.09Å; H351-D355 HydrophobicContact CB-CB 4.48Å; Q352-D355 WeakPolarHBondContact CB-OD2 3.34Å; Q352-D355 PolarHBondContact N-OD2 3.08Å; Q352-D355 WeakPolarHBondContact O-CB 3.44Å; Q352-D355 PolarHBondContact O-N 2.77Å; Q352-D355 VanDerWaalsContact O-N 3.08Å; D355-W357 WeakPolarHBondContact O-CZ3 3.26Å
356	H	87.3	Confident	83.2	Confident	80 Å²	80	76.6 Å²	76.6	37%	0.37	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	134	175.2	-61.1	68.8	0	0	0	109.7	L333 L334 G354	L333-H356 HydrophobicContact CD1-CB 4.45Å; L334-H356 VanDerWaalsContact O-CA 3.24Å; L334-H356 WeakPolarHBondContact O-CA 3.27Å; G354-H356 PolarHBondContact O-CE1 2.77Å; G354-H356 VanDerWaalsContact O-CE1 3.25Å; G354-H356 PolarHBondContact O-ND1 3.23Å
357	W	90	Very high	85.4	Confident	20 Å²	20	67.6 Å²	67.6	8%	0.076	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	158.9	174.3	68.2	105.9	0	0	0	111.3	L334 A336 L340 E342 H351 D355 V371	L334-W357 HydrophobicContact CB-CD2 4Å; L334-W357 HydrophobicContact CB-CE3 4.4Å; L334-W357 HydrophobicContact CB-CH2 4.14Å; L334-W357 HydrophobicContact CB-CZ2 3.71Å; L334-W357 HydrophobicContact CB-CZ3 4.47Å; L334-W357 HydrophobicContact CD1-CZ2 3.95Å; L334-W357 PolarHBondContact N-O 3.24Å; L334-W357 PolarHBondContact O-N 3.46Å; L334-W357 VanDerWaalsContact O-N 3.11Å; A336-W357 HydrophobicContact CB-CH2 3.84Å; A336-W357 HydrophobicContact CB-CZ3 3.59Å; A336-W357 VanDerWaalsContact N-CZ3 3.3Å; L340-W357 HydrophobicContact CD2-CH2 4.43Å; E342-W357 VanDerWaalsContact OE2-CZ2 3.27Å; E342-W357 WeakPolarHBondContact OE2-CZ2 3.22Å; E342-W357 PolarHBondContact OE2-NE1 2.96Å; H351-W357 HydrophobicContact CB-CE3 4.34Å; H351-W357 HydrophobicContact CB-CH2 4.25Å; H351-W357 HydrophobicContact CB-CZ3 3.92Å; H351-W357 AromaticContact CD2-CE2 3.93Å; H351-W357 AromaticContact CD2-CZ2 3.97Å; H351-W357 AromaticContact CE1-CD1 3.82Å; H351-W357 AromaticContact CE1-CD2 3.38Å; H351-W357 AromaticContact CE1-CE2 3.81Å; H351-W357 AromaticContact CE1-CE3 3.73Å; H351-W357 AromaticContact CE1-CG 3.44Å; H351-W357 VanDerWaalsContact CE1-CG 3.44Å; H351-W357 AromaticContact CE1-NE1 3.99Å; H351-W357 AromaticContact CG-CE3 3.77Å; H351-W357 AromaticContact CG-CZ3 3.75Å; H351-W357 AromaticContact ND1-CD2 3.59Å; H351-W357 AromaticContact ND1-CE3 3.41Å; H351-W357 AromaticContact ND1-CZ3 3.89Å; H351-W357 AromaticContact NE2-CD1 3.95Å; H351-W357 AromaticContact NE2-CD2 3.75Å; H351-W357 AromaticContact NE2-CE2 3.66Å; H351-W357 AromaticContact NE2-CG 3.97Å; H351-W357 AromaticContact NE2-NE1 3.73Å; D355-W357 WeakPolarHBondContact O-CZ3 3.26Å; W357-V371 HydrophobicContact CH2-CG1 4.13Å; W357-V371 HydrophobicContact CH2-CG2 4.13Å; W357-V371 HydrophobicContact CZ2-CG1 4.11Å; W357-V371 HydrophobicContact CZ2-CG2 4.2Å
358	L	90.5	Very high	87	Confident	29 Å²	29	62.3 Å²	62.3	15%	0.152	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	122	-178.3	178.3	68.9	0	0	0	109.8	L332 R360 R377 M407 L408 Q410	L332-L358 WeakPolarHBondContact O-CA 3.44Å; L332-L358 WeakPolarHBondContact O-CD1 3.48Å; L358-R360 HydrophobicContact CD2-CG 4.37Å; L358-R360 HydrophobicContact CG-CG 4.33Å; L358-R377 HydrophobicContact CD1-CB 4.47Å; L358-M407 HydrophobicContact CD2-CG 4.43Å; L358-M407 HydrophobicContact CD2-SD 4.02Å; L358-L408 WeakPolarHBondContact CD2-O 3.46Å; L358-Q410 HydrophobicContact CB-CB 4.2Å
359	I	90.1	Very high	87.7	Confident	29 Å²	29	58.2 Å²	58.2	15%	0.149	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	143.9	165.7	58.1	165.8	0	0	0	109.7	L326 G331 L332 L334 L363 Y365	L326-I359 HydrophobicContact CD1-CD1 3.93Å; L326-I359 HydrophobicContact CD1-CG1 4.18Å; G331-I359 CarbonylContact C-O 3.5Å; G331-I359 WeakPolarHBondContact CA-O 3.38Å; L332-I359 HydrophobicContact CB-CD1 4.08Å; L332-I359 HydrophobicContact CB-CG1 3.78Å; L332-I359 HydrophobicContact CD1-CD1 4.17Å; L332-I359 HydrophobicContact CG-CD1 4.46Å; L332-I359 PolarHBondContact N-O 3.38Å; L332-I359 PolarHBondContact O-N 2.63Å; L334-I359 HydrophobicContact CD1-CD1 3.8Å; L334-I359 HydrophobicContact CD1-CG1 3.89Å; L334-I359 HydrophobicContact CD1-CG2 3.94Å; L334-I359 HydrophobicContact CG-CD1 4.47Å; L334-I359 HydrophobicContact CG-CG1 4.3Å; I359-L363 HydrophobicContact CD1-CD1 4.41Å; I359-Y365 HydrophobicContact CD1-CD1 3.74Å; I359-Y365 HydrophobicContact CD1-CD2 3.41Å; I359-Y365 VanDerWaalsContact CD1-CD2 3.41Å; I359-Y365 HydrophobicContact CD1-CE1 4.16Å; I359-Y365 HydrophobicContact CD1-CE2 3.87Å; I359-Y365 HydrophobicContact CD1-CG 3.34Å
360	R	89.3	Confident	88.1	Confident	127 Å²	127	58.3 Å²	58.3	48%	0.479	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	146.4	-179.1	-62.6	-175.4	176.5	174.1	-3	109.8	L358 L363 M407	L358-R360 HydrophobicContact CD2-CG 4.37Å; L358-R360 HydrophobicContact CG-CG 4.33Å; R360-L363 VanDerWaalsContact O-CD2 3.26Å; R360-L363 WeakPolarHBondContact O-CD2 3.35Å; R360-M407 HydrophobicContact CG-SD 3.83Å
361	G	87.9	Confident	88.3	Confident	15 Å²	15	54.9 Å²	54.9	16%	0.155	30%	0.304	C	S	.	.	S	Bend	trans	-71.5	174.5	172.6	0	0	0	0	0	113.4	S327 Q330	S327-G361 VanDerWaalsContact O-CA 3.3Å; S327-G361 WeakPolarHBondContact O-CA 3.29Å; Q330-G361 PolarHBondContact O-N 3.47Å
362	P	90.6	Very high	88.5	Confident	100 Å²	100	57.7 Å²	57.7	65%	0.649	32%	0.318	S	S	*	.	S	Bend	cis	-88.3	112.7	8.3	32.2	-27.5	0	0	0	112.3	L326 E328	L326-P362 VanDerWaalsContact O-CA 3.26Å; L326-P362 WeakPolarHBondContact O-CA 3.49Å; E328-P362 HydrophobicContact CG-CB 4.2Å; E328-P362 HydrophobicContact CG-CG 3.99Å
363	L	89.6	Confident	88.7	Confident	72 Å²	72	52.5 Å²	52.5	38%	0.377	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	160.3	176.8	68.9	85.1	0	0	0	112.1	L326 I359 R360 Y365	L326-L363 HydrophobicContact CD1-CD1 4.14Å; L326-L363 HydrophobicContact CD1-CG 4.48Å; L326-L363 PolarHBondContact N-O 2.98Å; L326-L363 PolarHBondContact O-N 3.47Å; I359-L363 HydrophobicContact CD1-CD1 4.41Å; R360-L363 VanDerWaalsContact O-CD2 3.26Å; R360-L363 WeakPolarHBondContact O-CD2 3.35Å; L363-Y365 HydrophobicContact CD1-CD2 4.49Å
364	E	88.7	Confident	88.9	Confident	106 Å²	106	52.8 Å²	52.8	50%	0.495	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	123.4	171.2	-66	-174.5	-166.6	0	0	110.1	H279 V323 Y324 V325	H279-E364 IonicContact CE1-OE1 2.76Å; H279-E364 PolarHBondContact CE1-OE1 3.48Å; H279-E364 IonicContact CE1-OE2 3.18Å; H279-E364 IonicContact ND1-OE1 3.54Å; H279-E364 PolarHBondContact ND1-OE1 3.43Å; H279-E364 IonicContact ND1-OE2 3Å; H279-E364 PolarHBondContact ND1-OE2 2.84Å; V323-E364 HydrophobicContact CG1-CB 3.93Å; Y324-E364 WeakPolarHBondContact O-CA 3.41Å; V325-E364 HydrophobicContact CG2-CG 4.31Å
365	Y	89.9	Confident	89.1	Confident	18 Å²	18	55 Å²	55	7%	0.071	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	132.3	-176.5	-170.7	-106.2	0	0	0	112.3	V323 Y324 L332 L334 E342 I359 L363 P367	V323-Y365 WeakPolarHBondContact CG1-O 3.48Å; Y324-Y365 WeakPolarHBondContact CB-O 3.47Å; Y324-Y365 PolarHBondContact N-O 2.92Å; Y324-Y365 PolarHBondContact O-N 2.85Å; L332-Y365 HydrophobicContact CD1-CD1 3.78Å; L332-Y365 HydrophobicContact CD1-CG 4.36Å; L334-Y365 HydrophobicContact CD1-CE1 3.78Å; L334-Y365 HydrophobicContact CD1-CE2 4.08Å; L334-Y365 VanDerWaalsContact CD1-CZ 3.47Å; L334-Y365 WeakPolarHBondContact CD1-OH 3.44Å; L334-Y365 HydrophobicContact CD2-CD1 4.38Å; L334-Y365 HydrophobicContact CD2-CE1 3.66Å; L334-Y365 HydrophobicContact CG-CE1 4.38Å; E342-Y365 VanDerWaalsContact OE1-CE2 3.22Å; E342-Y365 WeakPolarHBondContact OE1-CE2 3.36Å; E342-Y365 PolarHBondContact OE1-OH 3.4Å; I359-Y365 HydrophobicContact CD1-CD1 3.74Å; I359-Y365 HydrophobicContact CD1-CD2 3.41Å; I359-Y365 VanDerWaalsContact CD1-CD2 3.41Å; I359-Y365 HydrophobicContact CD1-CE1 4.16Å; I359-Y365 HydrophobicContact CD1-CE2 3.87Å; I359-Y365 HydrophobicContact CD1-CG 3.34Å; L363-Y365 HydrophobicContact CD1-CD2 4.49Å; Y365-P367 HydrophobicContact CD1-CG 4.3Å; Y365-P367 HydrophobicContact CE1-CB 4.25Å; Y365-P367 HydrophobicContact CE1-CG 4.03Å
366	V	89.9	Confident	89.3	Confident	22 Å²	22	58.1 Å²	58.1	13%	0.133	30%	0.303	C	S	.	.			trans	-120.2	116.9	170.8	179.1	0	0	0	0	108.2	Y281 V301 K303 V323 S368	Y281-V366 HydrophobicContact CD1-CG1 4.23Å; Y281-V366 HydrophobicContact CD1-CG2 4.4Å; Y281-V366 HydrophobicContact CD2-CG1 3.49Å; Y281-V366 VanDerWaalsContact CD2-CG1 3.49Å; Y281-V366 HydrophobicContact CE2-CG1 3.94Å; Y281-V366 HydrophobicContact CG-CG1 3.64Å; Y281-V366 HydrophobicContact CG-CG2 4.35Å; V301-V366 HydrophobicContact CG1-CG1 3.73Å; K303-V366 HydrophobicContact CB-CG1 4.26Å; K303-V366 HydrophobicContact CB-CG2 4.24Å; K303-V366 HydrophobicContact CD-CB 3.97Å; K303-V366 HydrophobicContact CD-CG1 4.19Å; K303-V366 HydrophobicContact CD-CG2 3.96Å; V323-V366 HydrophobicContact CB-CG2 4.26Å; V323-V366 HydrophobicContact CG1-CG2 3.73Å; V323-V366 HydrophobicContact CG2-CG2 3.71Å; V366-S368 PolarHBondContact O-N 2.66Å
367	P	88.9	Confident	89.4	Confident	15 Å²	15	55.1 Å²	55.1	10%	0.097	29%	0.288	C	S	.	.			trans	-57.6	130.2	177.8	-23.4	33.3	0	0	0	111.3	Y324 Y365 V373	Y324-P367 HydrophobicContact CD2-CG 4.13Å; Y324-P367 HydrophobicContact CE2-CG 3.77Å; Y365-P367 HydrophobicContact CD1-CG 4.3Å; Y365-P367 HydrophobicContact CE1-CB 4.25Å; Y365-P367 HydrophobicContact CE1-CG 4.03Å; P367-V373 HydrophobicContact CB-CG2 4.37Å; P367-V373 HydrophobicContact CG-CG2 3.62Å
368	S	88.1	Confident	89.4	Confident	56 Å²	56	60.5 Å²	60.5	39%	0.392	31%	0.314	S	S	.	.			trans	-68.7	157.7	168.8	178.7	0	0	0	0	110.2	V366 K370 V371	V366-S368 PolarHBondContact O-N 2.66Å; S368-K370 PolarHBondContact O-N 3.42Å; S368-V371 PolarHBondContact O-N 3.04Å
369	A	85.6	Confident	89.4	Confident	43 Å²	43	59.6 Å²	59.6	36%	0.355	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-17.9	177.5	0	0	0	0	0	114	K299 V301	K299-A369 HydrophobicContact CB-CB 4.12Å; V301-A369 HydrophobicContact CG2-CB 4.08Å
370	K	87.6	Confident	89.3	Confident	83 Å²	83	60 Å²	60	36%	0.361	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-1.9	179.8	-61.2	177.9	176.9	-178.3	0	113.7	L337 Q338 L340 S368	L337-K370 WeakPolarHBondContact CB-O 3.3Å; L337-K370 PolarHBondContact N-O 3.29Å; Q338-K370 HydrophobicContact CB-CB 4.27Å; Q338-K370 HydrophobicContact CB-CD 4.11Å; Q338-K370 HydrophobicContact CB-CG 4.14Å; L340-K370 HydrophobicContact CB-CD 4.13Å; L340-K370 HydrophobicContact CD2-CB 3.77Å; S368-K370 PolarHBondContact O-N 3.42Å
371	V	89.4	Confident	89.2	Confident	10 Å²	10	58.2 Å²	58.2	6%	0.061	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	139.6	-176.5	-176.9	0	0	0	0	108.9	L334 R335 L340 W357 S368	L334-V371 HydrophobicContact CB-CG1 3.86Å; L334-V371 HydrophobicContact CD1-CG1 4.26Å; L334-V371 HydrophobicContact CD2-CG1 4Å; L334-V371 HydrophobicContact CG-CG1 4.26Å; R335-V371 WeakPolarHBondContact O-CA 3.3Å; L340-V371 HydrophobicContact CD1-CG2 4.31Å; L340-V371 HydrophobicContact CD2-CG2 3.38Å; W357-V371 HydrophobicContact CH2-CG1 4.13Å; W357-V371 HydrophobicContact CH2-CG2 4.13Å; W357-V371 HydrophobicContact CZ2-CG1 4.11Å; W357-V371 HydrophobicContact CZ2-CG2 4.2Å; S368-V371 PolarHBondContact O-N 3.04Å
372	E	89.9	Confident	89.1	Confident	78 Å²	78	58 Å²	58	36%	0.364	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	137.6	171.3	-176.1	-178.1	176.6	0	0	109.8	L334 R335 L337 V374	L334-E372 WeakPolarHBondContact CA-O 3.26Å; R335-E372 IonicContact CZ-OE2 3.38Å; R335-E372 PolarHBondContact N-O 2.87Å; R335-E372 IonicContact NE-OE2 3.55Å; R335-E372 PolarHBondContact NE-OE2 3.41Å; R335-E372 IonicContact NH2-OE1 2.89Å; R335-E372 PolarHBondContact NH2-OE1 2.88Å; R335-E372 IonicContact NH2-OE2 3.6Å; R335-E372 PolarHBondContact NH2-OE2 2.85Å; R335-E372 PolarHBondContact O-N 2.79Å; L337-E372 HydrophobicContact CD1-CB 4.4Å; L337-E372 HydrophobicContact CD2-CB 4.36Å; L337-E372 HydrophobicContact CG-CB 4.33Å; E372-V374 PolarHBondContact O-N 3Å
373	V	92.3	Very high	88.7	Confident	32 Å²	32	58.3 Å²	58.3	19%	0.194	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	113.8	172.2	-176.2	0	0	0	0	108	Y324 L332 L334 P367	Y324-V373 HydrophobicContact CE2-CG2 4.07Å; L332-V373 HydrophobicContact CB-CG1 4.44Å; L332-V373 HydrophobicContact CD2-CG1 3.99Å; L334-V373 HydrophobicContact CD2-CB 4.42Å; L334-V373 HydrophobicContact CD2-CG2 3.85Å; P367-V373 HydrophobicContact CB-CG2 4.37Å; P367-V373 HydrophobicContact CG-CG2 3.62Å
374	V	91.1	Very high	88.3	Confident	67 Å²	67	62.2 Å²	62.2	41%	0.406	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	-45.2	-177.8	179.9	0	0	0	0	111.2	L333 R335 E372	L333-V374 HydrophobicContact CD2-CB 4.39Å; L333-V374 HydrophobicContact CD2-CG1 4.31Å; L333-V374 HydrophobicContact CG-CB 4.48Å; L333-V374 PolarHBondContact O-N 2.8Å; R335-V374 HydrophobicContact CB-CG2 3.41Å; R335-V374 VanDerWaalsContact CB-CG2 3.41Å; E372-V374 PolarHBondContact O-N 3Å
375	E	88.3	Confident	87.8	Confident	88 Å²	88	63.8 Å²	63.8	41%	0.411	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	133.3	-173.2	-171	-173.9	-170.2	0	0	110.4	L333 R377	L333-E375 HydrophobicContact CB-CB 4.05Å; L333-E375 HydrophobicContact CD2-CB 4.28Å; L333-E375 PolarHBondContact N-O 2.81Å; L333-E375 PolarHBondContact O-N 3.21Å; E375-R377 HydrophobicContact CG-CG 4.14Å; E375-R377 IonicContact OE2-CZ 3.34Å; E375-R377 IonicContact OE2-NE 3.04Å; E375-R377 PolarHBondContact OE2-NE 3.43Å; E375-R377 IonicContact OE2-NH2 2.79Å; E375-R377 PolarHBondContact OE2-NH2 2.87Å
376	E	90.5	Very high	87.4	Confident	130 Å²	130	66.6 Å²	66.6	61%	0.607	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84	120.2	165	-59.5	-171.4	-172.5	0	0	109.3	Y324 L332	Y324-E376 VanDerWaalsContact CE1-OE1 3.32Å; Y324-E376 WeakPolarHBondContact CE1-OE1 3.26Å; L332-E376 HydrophobicContact CD2-CB 4.17Å; L332-E376 HydrophobicContact CD2-CG 3.64Å
377	R	90.3	Very high	87.3	Confident	17 Å²	17	65.7 Å²	65.7	6%	0.064	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	134.9	-177.7	-69.8	-169.9	169.5	-161.5	-2.7	111.1	Q330 G331 L358 E375 L408 T409 E412	Q330-R377 CarbonylContact C-O 3.53Å; Q330-R377 WeakPolarHBondContact CA-O 3.48Å; G331-R377 PolarHBondContact N-O 3.06Å; G331-R377 PolarHBondContact O-N 3.39Å; L358-R377 HydrophobicContact CD1-CB 4.47Å; E375-R377 HydrophobicContact CG-CG 4.14Å; E375-R377 IonicContact OE2-CZ 3.34Å; E375-R377 IonicContact OE2-NE 3.04Å; E375-R377 PolarHBondContact OE2-NE 3.43Å; E375-R377 IonicContact OE2-NH2 2.79Å; E375-R377 PolarHBondContact OE2-NH2 2.87Å; R377-L408 PolarHBondContact NH1-O 3.4Å; R377-T409 PolarHBondContact NH1-O 2.81Å; R377-E412 PolarHBondContact NH1-O 3.36Å; R377-E412 PolarHBondContact NH2-O 3.3Å
378	Q	89.6	Confident	87.4	Confident	133 Å²	133	65 Å²	65	62%	0.621	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.5	138.9	172.8	-163.6	167.1	20.2	0	0	110.1	I380	Q378-I380 PolarHBondContact O-N 2.79Å
379	A	89.3	Confident	87.5	Confident	10 Å²	10	63.6 Å²	63.6	8%	0.083	33%	0.328	C	S	.	.			trans	-63.9	129.7	171.8	0	0	0	0	0	109.3	Q329 P381 T405 M407	Q329-A379 HydrophobicContact CB-CB 4.12Å; Q329-A379 WeakPolarHBondContact O-CB 3.26Å; Q329-A379 PolarHBondContact O-N 2.86Å; A379-P381 WeakPolarHBondContact O-CD 3.29Å; A379-T405 HydrophobicContact CB-CG2 3.81Å; A379-M407 HydrophobicContact CB-CB 4.1Å; A379-M407 HydrophobicContact CB-CE 4.09Å
380	I	88.9	Confident	87.8	Confident	37 Å²	37	61.6 Å²	61.6	19%	0.19	31%	0.311	C	S	.	.	B	Isolated β-bridge	trans	-87.5	115.3	-178.6	-59.1	165.6	0	0	0	107.2	Q378 L382 I388 T405 Y406 L414	Q378-I380 PolarHBondContact O-N 2.79Å; I380-L382 HydrophobicContact CG2-CD2 3.96Å; I380-L382 HydrophobicContact CG2-CG 4.37Å; I380-L382 PolarHBondContact O-N 2.85Å; I380-I388 HydrophobicContact CD1-CD1 3.8Å; I380-I388 HydrophobicContact CG2-CG2 4.4Å; I380-T405 WeakPolarHBondContact O-CA 3.35Å; I380-Y406 PolarHBondContact N-O 3.2Å; I380-Y406 PolarHBondContact O-N 2.69Å; I380-L414 HydrophobicContact CD1-CD1 4.23Å; I380-L414 HydrophobicContact CD1-CD2 4.04Å
381	P	86.3	Confident	87.9	Confident	90 Å²	90	60.6 Å²	60.6	58%	0.584	31%	0.308	S	S	*	.			trans	-68.9	126.8	175.5	28.5	-32.8	0	0	0	109.4	A379	A379-P381 WeakPolarHBondContact O-CD 3.29Å
382	L	87.4	Confident	87.9	Confident	11 Å²	11	61.6 Å²	61.6	6%	0.058	31%	0.313	C	S	.	.			trans	-125.9	124.7	178.4	-58.9	171.5	0	0	0	108.5	I380 I388 S404	I380-L382 HydrophobicContact CG2-CD2 3.96Å; I380-L382 HydrophobicContact CG2-CG 4.37Å; I380-L382 PolarHBondContact O-N 2.85Å; L382-I388 HydrophobicContact CD1-CD1 4.3Å; L382-I388 HydrophobicContact CD1-CG1 3.93Å; L382-I388 HydrophobicContact CD2-CG2 3.94Å; L382-S404 WeakPolarHBondContact CD1-O 3.17Å
383	D	81	Confident	87.8	Confident	106 Å²	106	62.5 Å²	62.5	57%	0.567	32%	0.324	S	S	*	.			trans	-75.3	167.7	172.1	-164.3	9.4	0	0	0	111	N385 E386 G403	D383-N385 PolarHBondContact O-N 3.44Å; D383-E386 HydrophobicContact CB-CB 4.32Å; D383-E386 HydrophobicContact CB-CG 4.03Å; D383-E386 PolarHBondContact O-N 2.78Å; D383-G403 WeakPolarHBondContact O-CA 3.46Å
384	E	80.4	Confident	87.4	Confident	154 Å²	154	67.9 Å²	67.9	72%	0.72	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-34.4	-174.2	-68.3	-175.6	170.6	0	0	113.4
385	N	79.4	Confident	87.2	Confident	140 Å²	140	69.1 Å²	69.1	75%	0.749	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.5	7.7	-179.2	-66.2	-58.3	0	0	0	113.8	D383	D383-N385 PolarHBondContact O-N 3.44Å
386	E	82.1	Confident	87	Confident	76 Å²	76	66.9 Å²	66.9	36%	0.355	35%	0.352	S	S	.	.			trans	-108.5	156.1	178.7	-64.2	-166.1	150.8	0	0	111.6	D383 I402 G403 R456	D383-E386 HydrophobicContact CB-CB 4.32Å; D383-E386 HydrophobicContact CB-CG 4.03Å; D383-E386 PolarHBondContact O-N 2.78Å; E386-I402 VanDerWaalsContact O-CA 3.3Å; E386-I402 WeakPolarHBondContact O-CA 3.28Å; E386-G403 PolarHBondContact O-N 2.95Å; E386-R456 IonicContact OE1-NH1 3.28Å; E386-R456 PolarHBondContact OE1-NH1 3.33Å; E386-R456 IonicContact OE2-CZ 3.35Å; E386-R456 IonicContact OE2-NH1 2.68Å; E386-R456 PolarHBondContact OE2-NH1 2.85Å; E386-R456 IonicContact OE2-NH2 3.34Å
387	G	87.1	Confident	86.7	Confident	3 Å²	3	67 Å²	67	3%	0.031	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.9	170.7	175.4	0	0	0	0	0	113.5	V401 R456 V457	G387-V401 CarbonylContact C-O 3.52Å; G387-V401 WeakPolarHBondContact CA-O 3.16Å; G387-R456 WeakPolarHBondContact O-CA 3.46Å; G387-V457 VanDerWaalsContact C-CG2 3.43Å; G387-V457 PolarHBondContact O-N 2.91Å
388	I	91	Very high	86.6	Confident	2 Å²	2	67.7 Å²	67.7	1%	0.01	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	151.8	176.6	53.3	173.7	0	0	0	110.5	I380 L382 V390 A400 V401 Y406 L414 T455 R456	I380-I388 HydrophobicContact CD1-CD1 3.8Å; I380-I388 HydrophobicContact CG2-CG2 4.4Å; L382-I388 HydrophobicContact CD1-CD1 4.3Å; L382-I388 HydrophobicContact CD1-CG1 3.93Å; L382-I388 HydrophobicContact CD2-CG2 3.94Å; I388-V390 HydrophobicContact CD1-CG1 3.83Å; I388-V390 HydrophobicContact CG1-CG1 4.02Å; I388-A400 WeakPolarHBondContact O-CA 3.17Å; I388-V401 HydrophobicContact CG1-CB 4.39Å; I388-V401 PolarHBondContact N-O 3.42Å; I388-V401 PolarHBondContact O-N 2.9Å; I388-Y406 HydrophobicContact CD1-CD1 4.25Å; I388-L414 HydrophobicContact CB-CD2 4.01Å; I388-L414 HydrophobicContact CD1-CD2 3.89Å; I388-L414 HydrophobicContact CG1-CD2 4.46Å; I388-L414 HydrophobicContact CG2-CD2 4.28Å; I388-T455 CarbonylContact C-O 3.6Å; I388-T455 WeakPolarHBondContact CA-O 3.44Å; I388-R456 HydrophobicContact CG2-CG 4.46Å
389	Y	90.2	Very high	86.5	Confident	26 Å²	26	65.4 Å²	65.4	10%	0.102	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	123.8	167.4	-64.6	-62.1	0	0	0	109.3	A400 W415 K417 T455 R456 V457 V458	Y389-A400 HydrophobicContact CD1-CB 4.11Å; Y389-A400 HydrophobicContact CE1-CB 4.06Å; Y389-W415 WeakPolarHBondContact CB-O 2.78Å; Y389-W415 HydrophobicContact CD2-CE3 4.42Å; Y389-W415 HydrophobicContact CG-CE3 4.09Å; Y389-W415 PolarHBondContact O-N 3.21Å; Y389-K417 HydrophobicContact CD2-CB 3.9Å; Y389-K417 HydrophobicContact CE2-CB 3.66Å; Y389-K417 HydrophobicContact CE2-CD 3.74Å; Y389-K417 HydrophobicContact CE2-CG 4.35Å; Y389-T455 PolarHBondContact N-O 3.43Å; Y389-R456 WeakPolarHBondContact CE2-O 3.32Å; Y389-V457 HydrophobicContact CD1-CG2 4.26Å; Y389-V457 HydrophobicContact CE1-CG2 4Å; Y389-V457 HydrophobicContact CE2-CG2 4.49Å; Y389-V458 HydrophobicContact CE2-CG2 4.38Å; Y389-V458 PolarHBondContact OH-N 2.86Å
390	V	91.3	Very high	86.4	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	136.2	176.1	-57.5	0	0	0	0	109.2	I388 V398 R399 V401 Y406 L408	I388-V390 HydrophobicContact CD1-CG1 3.83Å; I388-V390 HydrophobicContact CG1-CG1 4.02Å; V390-V398 WeakPolarHBondContact O-CA 3.47Å; V390-R399 HydrophobicContact CG2-CG 3.57Å; V390-R399 PolarHBondContact N-O 2.98Å; V390-R399 PolarHBondContact O-N 2.82Å; V390-V401 HydrophobicContact CG1-CG2 4.28Å; V390-V401 HydrophobicContact CG2-CG2 3.68Å; V390-Y406 HydrophobicContact CG1-CE1 4.34Å; V390-L408 HydrophobicContact CB-CD2 4.31Å; V390-L408 HydrophobicContact CG1-CD2 3.67Å
391	Q	90.8	Very high	86.3	Confident	62 Å²	62	66.6 Å²	66.6	29%	0.29	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	126.5	171.6	-179.3	175.9	24	0	0	108.8	V398 E412 V413 W415	Q391-V398 HydrophobicContact CB-CG2 4.09Å; Q391-V398 HydrophobicContact CG-CG2 4.01Å; Q391-E412 WeakPolarHBondContact O-CA 3.46Å; Q391-V413 HydrophobicContact CB-CG2 4.31Å; Q391-V413 PolarHBondContact N-O 2.83Å; Q391-V413 PolarHBondContact O-N 3.25Å; Q391-W415 HydrophobicContact CB-CB 3.93Å; Q391-W415 HydrophobicContact CB-CG 4.33Å; Q391-W415 VanDerWaalsContact OE1-CD1 3.32Å
392	D	89.6	Confident	86.4	Confident	31 Å²	31	67.6 Å²	67.6	17%	0.166	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	122	167	175.3	-19.8	0	0	0	108.7	K394 T395 G396 K397 D411	D392-K394 WeakPolarHBondContact OD1-CA 2.96Å; D392-K394 WeakPolarHBondContact OD1-CB 3.43Å; D392-K394 PolarHBondContact OD1-N 2.86Å; D392-T395 VanDerWaalsContact CB-OG1 3.31Å; D392-T395 WeakPolarHBondContact CB-OG1 3.46Å; D392-T395 PolarHBondContact OD1-N 2.85Å; D392-T395 WeakPolarHBondContact OD2-CG2 3.32Å; D392-T395 PolarHBondContact OD2-OG1 2.84Å; D392-G396 WeakPolarHBondContact O-CA 2.96Å; D392-G396 PolarHBondContact O-N 2.79Å; D392-K397 PolarHBondContact N-O 2.94Å; D392-D411 CarbonylContact C-O 3.6Å; D392-D411 WeakPolarHBondContact CA-O 3.36Å
393	V	86.5	Confident	86.1	Confident	97 Å²	97	68.6 Å²	68.6	59%	0.588	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-30.9	-176.9	-179.8	0	0	0	0	111.4	D411 V413	V393-D411 WeakPolarHBondContact CG2-O 3.49Å; V393-D411 PolarHBondContact N-O 3.09Å; V393-V413 HydrophobicContact CG2-CB 4.41Å; V393-V413 HydrophobicContact CG2-CG1 3.79Å; V393-V413 HydrophobicContact CG2-CG2 3.83Å
394	K	85.1	Confident	86.3	Confident	146 Å²	146	66.9 Å²	66.9	64%	0.635	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-43.5	178.3	-72.8	-178.8	175	153.2	0	111.7	D392 D411	D392-K394 WeakPolarHBondContact OD1-CA 2.96Å; D392-K394 WeakPolarHBondContact OD1-CB 3.43Å; D392-K394 PolarHBondContact OD1-N 2.86Å; K394-D411 HydrophobicContact CD-CB 4.25Å; K394-D411 WeakPolarHBondContact CD-OD2 3.47Å; K394-D411 VanDerWaalsContact CE-CG 3.43Å; K394-D411 WeakPolarHBondContact CE-OD1 3.33Å; K394-D411 WeakPolarHBondContact CE-OD2 3.42Å; K394-D411 HydrophobicContact CG-CB 4.32Å; K394-D411 IonicContact NZ-OD1 3.32Å; K394-D411 PolarHBondContact NZ-OD1 2.6Å; K394-D411 IonicContact NZ-OD2 2.66Å; K394-D411 PolarHBondContact NZ-OD2 2.91Å
395	T	85.7	Confident	86.6	Confident	93 Å²	93	63.2 Å²	63.2	57%	0.571	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-15	-175.5	66.7	0	0	0	0	114.1	D392 K397	D392-T395 VanDerWaalsContact CB-OG1 3.31Å; D392-T395 WeakPolarHBondContact CB-OG1 3.46Å; D392-T395 PolarHBondContact OD1-N 2.85Å; D392-T395 WeakPolarHBondContact OD2-CG2 3.32Å; D392-T395 PolarHBondContact OD2-OG1 2.84Å; T395-K397 PolarHBondContact O-N 3.11Å; T395-K397 WeakPolarHBondContact OG1-CB 3.33Å; T395-K397 PolarHBondContact OG1-N 2.86Å
396	G	84.2	Confident	87	Confident	40 Å²	40	58.9 Å²	58.9	41%	0.412	33%	0.326	S	S	.	.			trans	68.2	4.6	-172.4	0	0	0	0	0	114	D392 V398	D392-G396 WeakPolarHBondContact O-CA 2.96Å; D392-G396 PolarHBondContact O-N 2.79Å; G396-V398 PolarHBondContact O-N 3.01Å
397	K	85.8	Confident	87.3	Confident	133 Å²	133	56 Å²	56	58%	0.578	31%	0.313	S	S	*	.			trans	-76.9	114.6	-173.6	-172.9	179.5	178.8	-177.6	0	110.6	D392 T395	D392-K397 PolarHBondContact N-O 2.94Å; T395-K397 PolarHBondContact O-N 3.11Å; T395-K397 WeakPolarHBondContact OG1-CB 3.33Å; T395-K397 PolarHBondContact OG1-N 2.86Å
398	V	88	Confident	87.4	Confident	31 Å²	31	56.8 Å²	56.8	19%	0.188	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	129.7	171.7	-175.2	0	0	0	0	110.2	V390 Q391 G396 W415	V390-V398 WeakPolarHBondContact O-CA 3.47Å; Q391-V398 HydrophobicContact CB-CG2 4.09Å; Q391-V398 HydrophobicContact CG-CG2 4.01Å; G396-V398 PolarHBondContact O-N 3.01Å; V398-W415 HydrophobicContact CG1-CB 4.23Å; V398-W415 HydrophobicContact CG1-CD2 3.67Å; V398-W415 HydrophobicContact CG1-CE3 3.59Å; V398-W415 HydrophobicContact CG1-CG 3.95Å; V398-W415 HydrophobicContact CG1-CZ3 4.18Å; V398-W415 HydrophobicContact CG2-CD2 4.09Å; V398-W415 HydrophobicContact CG2-CG 4.02Å
399	R	86.3	Confident	87.3	Confident	86 Å²	86	58.9 Å²	58.9	33%	0.325	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	158.3	173.9	69.8	-176.2	-169.1	-90.2	3	111.5	V390 Y406 E412	V390-R399 HydrophobicContact CG2-CG 3.57Å; V390-R399 PolarHBondContact N-O 2.98Å; V390-R399 PolarHBondContact O-N 2.82Å; R399-Y406 PolarHBondContact NH2-OH 2.87Å; R399-E412 IonicContact CZ-OE1 3.08Å; R399-E412 IonicContact NH1-OE1 2.8Å; R399-E412 PolarHBondContact NH1-OE1 3.05Å; R399-E412 IonicContact NH2-OE1 3.27Å; R399-E412 PolarHBondContact NH2-OE1 2.77Å
400	A	86.7	Confident	87.1	Confident	53 Å²	53	61.3 Å²	61.3	44%	0.438	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	131.1	170.8	0	0	0	0	0	109.5	I388 Y389 V457	I388-A400 WeakPolarHBondContact O-CA 3.17Å; Y389-A400 HydrophobicContact CD1-CB 4.11Å; Y389-A400 HydrophobicContact CE1-CB 4.06Å; A400-V457 HydrophobicContact CB-CG2 3.78Å
401	V	88.1	Confident	86.9	Confident	19 Å²	19	63.2 Å²	63.2	12%	0.115	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	123.1	170.7	-179.5	0	0	0	0	107.2	G387 I388 V390 Y406	G387-V401 CarbonylContact C-O 3.52Å; G387-V401 WeakPolarHBondContact CA-O 3.16Å; I388-V401 HydrophobicContact CG1-CB 4.39Å; I388-V401 PolarHBondContact N-O 3.42Å; I388-V401 PolarHBondContact O-N 2.9Å; V390-V401 HydrophobicContact CG1-CG2 4.28Å; V390-V401 HydrophobicContact CG2-CG2 3.68Å; V401-Y406 HydrophobicContact CG1-CD1 4.21Å; V401-Y406 HydrophobicContact CG1-CD2 3.77Å; V401-Y406 HydrophobicContact CG1-CE2 4.22Å; V401-Y406 HydrophobicContact CG1-CG 3.76Å; V401-Y406 HydrophobicContact CG2-CD1 4.48Å; V401-Y406 HydrophobicContact CG2-CE1 4.25Å
402	I	88.1	Confident	86.9	Confident	110 Å²	110	60.6 Å²	60.6	56%	0.564	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.1	147.2	-172.7	52.7	169.9	0	0	0	110.9	E386 S404 V457	E386-I402 VanDerWaalsContact O-CA 3.3Å; E386-I402 WeakPolarHBondContact O-CA 3.28Å; I402-S404 PolarHBondContact O-N 2.99Å; I402-V457 HydrophobicContact CG2-CG2 4.28Å
403	G	80.6	Confident	86.9	Confident	32 Å²	32	61.9 Å²	61.9	33%	0.33	35%	0.349	S	S	.	.	S	Bend	trans	85	-0.7	161.4	0	0	0	0	0	118.3	D383 E386	D383-G403 WeakPolarHBondContact O-CA 3.46Å; E386-G403 PolarHBondContact O-N 2.95Å
404	S	85.6	Confident	87.1	Confident	70 Å²	70	60.5 Å²	60.5	49%	0.49	34%	0.338	S	S	.	.	S	Bend	trans	-150.4	148.9	173.6	61.5	0	0	0	0	112.4	L382 I402 Y406	L382-S404 WeakPolarHBondContact CD1-O 3.17Å; I402-S404 PolarHBondContact O-N 2.99Å; S404-Y406 PolarHBondContact O-N 2.96Å
405	T	86.8	Confident	87.5	Confident	78 Å²	78	57.7 Å²	57.7	48%	0.479	32%	0.323	S	S	.	.			trans	-51.7	124.1	175.2	-57.1	0	0	0	0	110.4	A379 I380	A379-T405 HydrophobicContact CB-CG2 3.81Å; I380-T405 WeakPolarHBondContact O-CA 3.35Å
406	Y	88.5	Confident	87.6	Confident	48 Å²	48	58.5 Å²	58.5	19%	0.188	32%	0.321	C	S	.	.	B	Isolated β-bridge	trans	-127.6	130.1	-172.2	-163.7	-106.2	0	0	0	111.7	I380 I388 V390 R399 V401 S404 E412	I380-Y406 PolarHBondContact N-O 3.2Å; I380-Y406 PolarHBondContact O-N 2.69Å; I388-Y406 HydrophobicContact CD1-CD1 4.25Å; V390-Y406 HydrophobicContact CG1-CE1 4.34Å; R399-Y406 PolarHBondContact NH2-OH 2.87Å; V401-Y406 HydrophobicContact CG1-CD1 4.21Å; V401-Y406 HydrophobicContact CG1-CD2 3.77Å; V401-Y406 HydrophobicContact CG1-CE2 4.22Å; V401-Y406 HydrophobicContact CG1-CG 3.76Å; V401-Y406 HydrophobicContact CG2-CD1 4.48Å; V401-Y406 HydrophobicContact CG2-CE1 4.25Å; S404-Y406 PolarHBondContact O-N 2.96Å; Y406-E412 PolarHBondContact OH-OE2 3.28Å
407	M	87.3	Confident	87.7	Confident	16 Å²	16	60.1 Å²	60.1	8%	0.079	32%	0.316	C	S	.	.			trans	-106.3	124.6	169.8	-175.7	-174.6	-73	0	0	108.8	Q329 L358 R360 A379 T409	Q329-M407 VanDerWaalsContact C-CE 3.48Å; Q329-M407 VanDerWaalsContact O-CE 3.25Å; Q329-M407 WeakPolarHBondContact O-CE 3.37Å; L358-M407 HydrophobicContact CD2-CG 4.43Å; L358-M407 HydrophobicContact CD2-SD 4.02Å; R360-M407 HydrophobicContact CG-SD 3.83Å; A379-M407 HydrophobicContact CB-CB 4.1Å; A379-M407 HydrophobicContact CB-CE 4.09Å; M407-T409 PolarHBondContact O-N 3.45Å
408	L	89.9	Confident	87.6	Confident	19 Å²	19	60.5 Å²	60.5	10%	0.099	32%	0.32	C	S	.	.			trans	-56.1	131.8	177.3	-64.7	158.3	0	0	0	110.4	L358 R377 V390 E412 L414	L358-L408 WeakPolarHBondContact CD2-O 3.46Å; R377-L408 PolarHBondContact NH1-O 3.4Å; V390-L408 HydrophobicContact CB-CD2 4.31Å; V390-L408 HydrophobicContact CG1-CD2 3.67Å; L408-E412 HydrophobicContact CB-CB 4.32Å; L408-E412 HydrophobicContact CD2-CB 4.05Å; L408-L414 HydrophobicContact CD1-CG 4.07Å; L408-L414 HydrophobicContact CD2-CD2 4.4Å
409	T	89.1	Confident	87.3	Confident	47 Å²	47	60.7 Å²	60.7	29%	0.288	32%	0.32	S	S	.	.			trans	-73.5	166.7	173.8	64.1	0	0	0	0	111.7	R377 M407 D411 E412	R377-T409 PolarHBondContact NH1-O 2.81Å; M407-T409 PolarHBondContact O-N 3.45Å; T409-D411 PolarHBondContact O-N 2.99Å; T409-E412 WeakPolarHBondContact CB-OE2 3.29Å; T409-E412 WeakPolarHBondContact CG2-OE2 3.18Å; T409-E412 PolarHBondContact N-OE2 2.67Å; T409-E412 PolarHBondContact O-N 2.85Å; T409-E412 WeakPolarHBondContact OG1-CG 3.18Å; T409-E412 PolarHBondContact OG1-OE2 2.86Å
410	Q	85.4	Confident	87.1	Confident	77 Å²	77	60.6 Å²	60.6	36%	0.36	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-27.2	-176.5	71.6	-162.8	19.4	0	0	114.9	L333 L358	L333-Q410 HydrophobicContact CD1-CB 3.97Å; L358-Q410 HydrophobicContact CB-CB 4.2Å
411	D	87.7	Confident	86.7	Confident	39 Å²	39	62.6 Å²	62.6	21%	0.209	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	8.7	-177.7	-61.9	-51	0	0	0	112.7	D392 V393 K394 T409	D392-D411 CarbonylContact C-O 3.6Å; D392-D411 WeakPolarHBondContact CA-O 3.36Å; V393-D411 WeakPolarHBondContact CG2-O 3.49Å; V393-D411 PolarHBondContact N-O 3.09Å; K394-D411 HydrophobicContact CD-CB 4.25Å; K394-D411 WeakPolarHBondContact CD-OD2 3.47Å; K394-D411 VanDerWaalsContact CE-CG 3.43Å; K394-D411 WeakPolarHBondContact CE-OD1 3.33Å; K394-D411 WeakPolarHBondContact CE-OD2 3.42Å; K394-D411 HydrophobicContact CG-CB 4.32Å; K394-D411 IonicContact NZ-OD1 3.32Å; K394-D411 PolarHBondContact NZ-OD1 2.6Å; K394-D411 IonicContact NZ-OD2 2.66Å; K394-D411 PolarHBondContact NZ-OD2 2.91Å; T409-D411 PolarHBondContact O-N 2.99Å
412	E	89.5	Confident	86	Confident	7 Å²	7	63.7 Å²	63.7	3%	0.033	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	142.3	-176.5	-73.7	170.5	160.2	0	0	112.6	R377 Q391 R399 Y406 L408 T409	R377-E412 PolarHBondContact NH1-O 3.36Å; R377-E412 PolarHBondContact NH2-O 3.3Å; Q391-E412 WeakPolarHBondContact O-CA 3.46Å; R399-E412 IonicContact CZ-OE1 3.08Å; R399-E412 IonicContact NH1-OE1 2.8Å; R399-E412 PolarHBondContact NH1-OE1 3.05Å; R399-E412 IonicContact NH2-OE1 3.27Å; R399-E412 PolarHBondContact NH2-OE1 2.77Å; Y406-E412 PolarHBondContact OH-OE2 3.28Å; L408-E412 HydrophobicContact CB-CB 4.32Å; L408-E412 HydrophobicContact CD2-CB 4.05Å; T409-E412 WeakPolarHBondContact CB-OE2 3.29Å; T409-E412 WeakPolarHBondContact CG2-OE2 3.18Å; T409-E412 PolarHBondContact N-OE2 2.67Å; T409-E412 PolarHBondContact O-N 2.85Å; T409-E412 WeakPolarHBondContact OG1-CG 3.18Å; T409-E412 PolarHBondContact OG1-OE2 2.86Å
413	V	90.8	Very high	85.3	Confident	59 Å²	59	61.5 Å²	61.5	36%	0.358	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	156.6	173.3	-61.4	0	0	0	0	110	Q391 V393	Q391-V413 HydrophobicContact CB-CG2 4.31Å; Q391-V413 PolarHBondContact N-O 2.83Å; Q391-V413 PolarHBondContact O-N 3.25Å; V393-V413 HydrophobicContact CG2-CB 4.41Å; V393-V413 HydrophobicContact CG2-CG1 3.79Å; V393-V413 HydrophobicContact CG2-CG2 3.83Å
414	L	91.1	Very high	85	Confident	67 Å²	67	62.2 Å²	62.2	35%	0.351	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	136	173.6	-70.9	169.1	0	0	0	110.4	I380 I388 L408 T455	I380-L414 HydrophobicContact CD1-CD1 4.23Å; I380-L414 HydrophobicContact CD1-CD2 4.04Å; I388-L414 HydrophobicContact CB-CD2 4.01Å; I388-L414 HydrophobicContact CD1-CD2 3.89Å; I388-L414 HydrophobicContact CG1-CD2 4.46Å; I388-L414 HydrophobicContact CG2-CD2 4.28Å; L408-L414 HydrophobicContact CD1-CG 4.07Å; L408-L414 HydrophobicContact CD2-CD2 4.4Å; L414-T455 HydrophobicContact CB-CG2 3.79Å; L414-T455 HydrophobicContact CD1-CG2 4.46Å
415	W	91.8	Very high	84.3	Confident	87 Å²	87	64.4 Å²	64.4	33%	0.33	34%	0.343	S	S	.	.			trans	-108.1	130.9	179.2	-174.2	75.7	0	0	0	111.3	Y389 Q391 V398 K417 T455	Y389-W415 WeakPolarHBondContact CB-O 2.78Å; Y389-W415 HydrophobicContact CD2-CE3 4.42Å; Y389-W415 HydrophobicContact CG-CE3 4.09Å; Y389-W415 PolarHBondContact O-N 3.21Å; Q391-W415 HydrophobicContact CB-CB 3.93Å; Q391-W415 HydrophobicContact CB-CG 4.33Å; Q391-W415 VanDerWaalsContact OE1-CD1 3.32Å; V398-W415 HydrophobicContact CG1-CB 4.23Å; V398-W415 HydrophobicContact CG1-CD2 3.67Å; V398-W415 HydrophobicContact CG1-CE3 3.59Å; V398-W415 HydrophobicContact CG1-CG 3.95Å; V398-W415 HydrophobicContact CG1-CZ3 4.18Å; V398-W415 HydrophobicContact CG2-CD2 4.09Å; V398-W415 HydrophobicContact CG2-CG 4.02Å; W415-K417 HydrophobicContact CE3-CB 4.12Å; W415-K417 HydrophobicContact CH2-CB 4.19Å; W415-K417 HydrophobicContact CH2-CG 4.16Å; W415-K417 HydrophobicContact CZ3-CB 3.51Å; W415-K417 HydrophobicContact CZ3-CD 4.31Å; W415-K417 HydrophobicContact CZ3-CG 3.8Å; W415-T455 WeakPolarHBondContact O-CA 3.32Å
416	E	89.6	Confident	83.5	Confident	111 Å²	111	66.2 Å²	66.2	52%	0.519	35%	0.349	S	S	.	.			trans	-88.7	124.8	178.6	-66.6	-172.2	-179	0	0	111.3	K454 T455	E416-K454 HydrophobicContact CB-CB 3.85Å; E416-K454 HydrophobicContact CB-CD 4.4Å; E416-K454 HydrophobicContact CG-CB 3.97Å; E416-T455 HydrophobicContact CG-CG2 3.73Å
417	K	84.9	Confident	82.7	Confident	74 Å²	74	65.6 Å²	65.6	32%	0.322	35%	0.349	S	S	.	.			trans	-96.4	110.1	172.1	-170.8	174.4	177.6	-177.3	0	110.3	Y389 W415 K454 V458	Y389-K417 HydrophobicContact CD2-CB 3.9Å; Y389-K417 HydrophobicContact CE2-CB 3.66Å; Y389-K417 HydrophobicContact CE2-CD 3.74Å; Y389-K417 HydrophobicContact CE2-CG 4.35Å; W415-K417 HydrophobicContact CE3-CB 4.12Å; W415-K417 HydrophobicContact CH2-CB 4.19Å; W415-K417 HydrophobicContact CH2-CG 4.16Å; W415-K417 HydrophobicContact CZ3-CB 3.51Å; W415-K417 HydrophobicContact CZ3-CD 4.31Å; W415-K417 HydrophobicContact CZ3-CG 3.8Å; K417-K454 PolarHBondContact N-O 2.88Å; K417-V458 HydrophobicContact CD-CG2 4.05Å
418	E	83.7	Confident	81.7	Confident	140 Å²	140	67.6 Å²	67.6	65%	0.654	36%	0.36	S	S	*	.			trans	-78.8	138.4	173.6	-55.5	-152.2	126.8	0	0	111.6	K454	E418-K454 IonicContact OE1-NZ 3.37Å; E418-K454 PolarHBondContact OE1-NZ 3.17Å
419	L	81.4	Confident	80.5	Confident	35 Å²	35	72.8 Å²	72.8	18%	0.183	38%	0.381	C	S	.	.			trans	-121	153.2	175.4	-65.7	175.8	0	0	0	109.8	V423 E424 L427 V458	L419-V423 HydrophobicContact CD1-CG1 4.29Å; L419-E424 HydrophobicContact CB-CG 3.71Å; L419-L427 HydrophobicContact CD1-CD1 3.64Å; L419-V458 HydrophobicContact CD1-CG1 4.13Å; L419-V458 HydrophobicContact CD1-CG2 3.96Å
420	P	83.6	Confident	78.9	Confident	84 Å²	84	73.9 Å²	73.9	55%	0.545	40%	0.402	S	S	.	.			trans	-58.4	143.9	171.1	-23.3	33.9	0	0	0	111.1	G422 V423 E424	P420-G422 VanDerWaalsContact C-N 3.28Å; P420-G422 PolarHBondContact O-N 3.31Å; P420-G422 VanDerWaalsContact O-N 3.16Å; P420-V423 HydrophobicContact CB-CG2 4.35Å; P420-V423 HydrophobicContact CG-CG2 4.48Å; P420-V423 WeakPolarHBondContact O-CB 3.41Å; P420-V423 PolarHBondContact O-N 2.72Å; P420-E424 PolarHBondContact O-N 3.18Å
421	P	77.2	Confident	77.5	Confident	96 Å²	96	75.8 Å²	75.8	62%	0.623	41%	0.411	S	S	*	.	H	α-helix	trans	-58.6	-37.2	-170.7	20.3	-32.5	0	0	0	113.2	V423 E424 E425	P421-V423 VanDerWaalsContact C-N 3.26Å; P421-V423 PolarHBondContact O-N 2.9Å; P421-E424 PolarHBondContact O-N 2.92Å; P421-E425 WeakPolarHBondContact O-CG 3.46Å; P421-E425 PolarHBondContact O-N 2.79Å
422	G	73	Confident	75.8	Confident	42 Å²	42	76.2 Å²	76.2	43%	0.433	41%	0.413	S	S	.	.	H	α-helix	trans	-63.9	-28.1	176.2	0	0	0	0	0	114	P420 L426	P420-G422 VanDerWaalsContact C-N 3.28Å; P420-G422 PolarHBondContact O-N 3.31Å; P420-G422 VanDerWaalsContact O-N 3.16Å; G422-L426 WeakPolarHBondContact O-CD1 3.24Å; G422-L426 VanDerWaalsContact O-CG 3.27Å; G422-L426 WeakPolarHBondContact O-CG 3.26Å; G422-L426 PolarHBondContact O-N 3.02Å
423	V	75	Confident	74.1	Confident	63 Å²	63	79.7 Å²	79.7	38%	0.382	44%	0.437	S	S	.	.	H	α-helix	trans	-78.8	-37.9	175.9	-179.5	0	0	0	0	110.4	L419 P420 P421 E425 L426 L427	L419-V423 HydrophobicContact CD1-CG1 4.29Å; P420-V423 HydrophobicContact CB-CG2 4.35Å; P420-V423 HydrophobicContact CG-CG2 4.48Å; P420-V423 WeakPolarHBondContact O-CB 3.41Å; P420-V423 PolarHBondContact O-N 2.72Å; P421-V423 VanDerWaalsContact C-N 3.26Å; P421-V423 PolarHBondContact O-N 2.9Å; V423-E425 VanDerWaalsContact C-N 3.34Å; V423-L426 PolarHBondContact O-N 2.99Å; V423-L427 HydrophobicContact CG1-CD1 3.84Å; V423-L427 HydrophobicContact CG1-CG 4.35Å; V423-L427 VanDerWaalsContact O-CG 3.26Å; V423-L427 WeakPolarHBondContact O-CG 3.45Å; V423-L427 PolarHBondContact O-N 3.03Å
424	E	74.2	Confident	72.2	Confident	48 Å²	48	81.7 Å²	81.7	22%	0.224	45%	0.445	C	S	.	.	H	α-helix	trans	-62.5	-42.8	175.5	-63.3	-173.4	160.3	0	0	111.4	L419 P420 P421 L426 L427 N428	L419-E424 HydrophobicContact CB-CG 3.71Å; P420-E424 PolarHBondContact O-N 3.18Å; P421-E424 PolarHBondContact O-N 2.92Å; E424-L426 VanDerWaalsContact C-N 3.34Å; E424-L426 PolarHBondContact O-N 2.92Å; E424-L427 PolarHBondContact O-N 3.29Å; E424-N428 WeakPolarHBondContact O-CB 3.4Å; E424-N428 VanDerWaalsContact O-CG 3.28Å; E424-N428 PolarHBondContact O-N 2.65Å
425	E	71	Confident	70.3	Confident	115 Å²	115	81.9 Å²	81.9	54%	0.537	46%	0.456	S	S	.	.	H	α-helix	trans	-58.6	-43.1	173.7	-74.7	-178.6	-164.2	0	0	112.7	P421 V423 N428 K429	P421-E425 WeakPolarHBondContact O-CG 3.46Å; P421-E425 PolarHBondContact O-N 2.79Å; V423-E425 VanDerWaalsContact C-N 3.34Å; E425-N428 PolarHBondContact O-N 2.94Å; E425-K429 WeakPolarHBondContact O-CG 3.3Å; E425-K429 PolarHBondContact O-N 3.33Å
426	L	69.9	Low	68.6	Low	116 Å²	116	80.7 Å²	80.7	61%	0.607	46%	0.456	S	S	*	.	H	α-helix	trans	-67.6	-40.1	-179.8	-73.2	169.8	0	0	0	112.3	G422 V423 E424 N428	G422-L426 WeakPolarHBondContact O-CD1 3.24Å; G422-L426 VanDerWaalsContact O-CG 3.27Å; G422-L426 WeakPolarHBondContact O-CG 3.26Å; G422-L426 PolarHBondContact O-N 3.02Å; V423-L426 PolarHBondContact O-N 2.99Å; E424-L426 VanDerWaalsContact C-N 3.34Å; E424-L426 PolarHBondContact O-N 2.92Å; L426-N428 VanDerWaalsContact C-N 3.31Å
427	L	70.9	Confident	66.8	Low	35 Å²	35	85.8 Å²	85.8	18%	0.183	47%	0.471	C	S	.	.	H	α-helix	trans	-69.9	-32.6	178.1	-67.3	169.4	0	0	0	111.9	L419 V423 E424 V458 Y460	L419-L427 HydrophobicContact CD1-CD1 3.64Å; V423-L427 HydrophobicContact CG1-CD1 3.84Å; V423-L427 HydrophobicContact CG1-CG 4.35Å; V423-L427 VanDerWaalsContact O-CG 3.26Å; V423-L427 WeakPolarHBondContact O-CG 3.45Å; V423-L427 PolarHBondContact O-N 3.03Å; E424-L427 PolarHBondContact O-N 3.29Å; L427-V458 HydrophobicContact CD1-CG1 3.7Å; L427-V458 HydrophobicContact CD2-CG1 4.49Å; L427-Y460 HydrophobicContact CD2-CD2 3.61Å; L427-Y460 HydrophobicContact CD2-CE2 4.5Å; L427-Y460 HydrophobicContact CD2-CG 4.12Å
428	N	66.6	Low	65.1	Low	58 Å²	58	85.6 Å²	85.6	31%	0.31	49%	0.49	S	S	.	.	H	α-helix	trans	-75.4	-36.7	178.6	-86.2	-2.5	0	0	0	112.7	E424 E425 L426 G430 L449	E424-N428 WeakPolarHBondContact O-CB 3.4Å; E424-N428 VanDerWaalsContact O-CG 3.28Å; E424-N428 PolarHBondContact O-N 2.65Å; E425-N428 PolarHBondContact O-N 2.94Å; L426-N428 VanDerWaalsContact C-N 3.31Å; N428-G430 PolarHBondContact O-N 3.01Å; N428-G430 VanDerWaalsContact O-N 3.16Å; N428-L449 HydrophobicContact CB-CD2 3.36Å; N428-L449 WeakPolarHBondContact O-CD2 3.43Å
429	K	64.9	Low	63.4	Low	128 Å²	128	85 Å²	85	56%	0.557	49%	0.487	S	S	*	.	H	α-helix	trans	-59.9	-29.3	179.9	-80.2	172.8	-176.4	173	0	112.9	E425 Q431	E425-K429 WeakPolarHBondContact O-CG 3.3Å; E425-K429 PolarHBondContact O-N 3.33Å; K429-Q431 PolarHBondContact O-N 3.01Å
430	G	55.5	Low	61.7	Low	71 Å²	71	92.1 Å²	92.1	73%	0.732	52%	0.517	S	S	*	.			trans	57.8	0.4	173.8	0	0	0	0	0	115.8	N428	N428-G430 PolarHBondContact O-N 3.01Å; N428-G430 VanDerWaalsContact O-N 3.16Å
431	Q	55.4	Low	59.9	Low	116 Å²	116	96.2 Å²	96.2	54%	0.542	53%	0.534	S	S	.	.			trans	-75.8	130.6	-175.7	-82.2	175.7	-31.7	0	0	109.5	K429 P433 D436	K429-Q431 PolarHBondContact O-N 3.01Å; Q431-P433 VanDerWaalsContact O-CD 3.23Å; Q431-P433 WeakPolarHBondContact O-CD 3.35Å; Q431-D436 WeakPolarHBondContact CG-OD2 3.45Å
432	D	52.3	Low	58.1	Low	48 Å²	48	96.4 Å²	96.4	26%	0.257	53%	0.533	S	S	.	.			trans	-72.2	112.5	162.5	-176.2	-25.8	0	0	0	106.8	L434 A435 D436	D432-L434 PolarHBondContact O-N 3.06Å; D432-L434 WeakPolarHBondContact OD1-CB 3.23Å; D432-L434 PolarHBondContact OD1-N 2.75Å; D432-A435 HydrophobicContact CB-CB 3.89Å; D432-A435 PolarHBondContact O-N 2.84Å; D432-A435 PolarHBondContact OD1-N 3.46Å; D432-D436 PolarHBondContact O-N 3.02Å
433	P	54.4	Low	56.7	Low	80 Å²	80	99.5 Å²	99.5	52%	0.519	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61	-14	-177	-19.4	32.1	0	0	0	113.6	Q431 P463	Q431-P433 VanDerWaalsContact O-CD 3.23Å; Q431-P433 WeakPolarHBondContact O-CD 3.35Å; P433-P463 HydrophobicContact CG-CG 4.47Å
434	L	50.1	Low	55.2	Low	102 Å²	102	104.1 Å²	104.1	53%	0.534	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.2	-39.6	-179.2	-141.2	81.1	0	0	0	112.7	D432	D432-L434 PolarHBondContact O-N 3.06Å; D432-L434 WeakPolarHBondContact OD1-CB 3.23Å; D432-L434 PolarHBondContact OD1-N 2.75Å
435	A	51.9	Low	53.4	Low	71 Å²	71	105.8 Å²	105.8	59%	0.587	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	-34.1	-176.4	0	0	0	0	0	113	D432 R437	D432-A435 HydrophobicContact CB-CB 3.89Å; D432-A435 PolarHBondContact O-N 2.84Å; D432-A435 PolarHBondContact OD1-N 3.46Å; A435-R437 PolarHBondContact O-N 2.91Å
436	D	54.1	Low	52	Low	62 Å²	62	109.1 Å²	109.1	33%	0.332	61%	0.608	S	S	.	*			trans	-93.2	11.5	-170.4	-66.1	-29.6	0	0	0	114.4	Q431 D432 G438 E439	Q431-D436 WeakPolarHBondContact CG-OD2 3.45Å; D432-D436 PolarHBondContact O-N 3.02Å; D436-G438 PolarHBondContact O-N 3.5Å; D436-E439 PolarHBondContact O-N 3.43Å
437	R	53.4	Low	50.7	Low	217 Å²	217	110.9 Å²	110.9	82%	0.819	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	0.8	-178.8	-89.2	-176.3	176.1	-166.1	-3.1	115.7	A435	A435-R437 PolarHBondContact O-N 2.91Å
438	G	47.5	Very low	49.5	Very low	71 Å²	71	115.1 Å²	115.1	73%	0.732	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.2	-10.5	-179.8	0	0	0	0	0	115.4	D436 K440	D436-G438 PolarHBondContact O-N 3.5Å; G438-K440 PolarHBondContact O-N 3.3Å; G438-K440 VanDerWaalsContact O-N 3.11Å
439	E	49.3	Very low	49.1	Very low	126 Å²	126	117.9 Å²	117.9	59%	0.589	66%	0.657	S	S	*	*			trans	-78.5	97.9	171.5	-72.8	-160.5	161.7	0	0	107.7	D436 D441	D436-E439 PolarHBondContact O-N 3.43Å; E439-D441 PolarHBondContact O-N 3.47Å
440	K	44.7	Very low	48.9	Very low	186 Å²	186	115.4 Å²	115.4	81%	0.809	66%	0.66	S	S	*	*			trans	-49.4	140.3	157.9	-81.5	-176.8	174.7	179.5	0	107.4	G438 T442	G438-K440 PolarHBondContact O-N 3.3Å; G438-K440 VanDerWaalsContact O-N 3.11Å; K440-T442 PolarHBondContact O-N 2.91Å; K440-T442 PolarHBondContact O-OG1 2.9Å
441	D	46.9	Very low	49.6	Very low	170 Å²	170	118 Å²	118	91%	0.909	66%	0.663	S	S	*	*			trans	-44.7	71.8	166.3	-78.4	-41.9	0	0	0	111.2	E439 A443	E439-D441 PolarHBondContact O-N 3.47Å; D441-A443 PolarHBondContact O-N 2.78Å
442	T	39.4	Very low	50.7	Low	99 Å²	99	114.9 Å²	114.9	61%	0.607	65%	0.647	S	S	*	*			trans	-74.8	118.1	163.6	40.1	0	0	0	0	102.7	K440 K444	K440-T442 PolarHBondContact O-N 2.91Å; K440-T442 PolarHBondContact O-OG1 2.9Å; T442-K444 PolarHBondContact O-N 2.84Å
443	A	43.4	Very low	52.1	Low	108 Å²	108	116.9 Å²	116.9	89%	0.893	66%	0.657	S	S	*	*			trans	-55	73.3	179.6	0	0	0	0	0	111.4	D441 S445	D441-A443 PolarHBondContact O-N 2.78Å; A443-S445 VanDerWaalsContact C-N 3.28Å; A443-S445 PolarHBondContact O-N 2.8Å; A443-S445 VanDerWaalsContact O-N 3.08Å
444	K	42.8	Very low	53.7	Low	160 Å²	160	116 Å²	116	70%	0.696	65%	0.646	S	S	*	*			trans	-71.4	97.5	156.4	-82.5	179.3	-178.6	163	0	104.2	T442	T442-K444 PolarHBondContact O-N 2.84Å
445	S	36.3	Very low	55.4	Low	82 Å²	82	111.9 Å²	111.9	57%	0.573	63%	0.625	S	S	*	*			trans	16	111.2	161.3	56.9	0	0	0	0	114.7	A443 Q447	A443-S445 VanDerWaalsContact C-N 3.28Å; A443-S445 PolarHBondContact O-N 2.8Å; A443-S445 VanDerWaalsContact O-N 3.08Å; S445-Q447 PolarHBondContact O-N 3.01Å
446	L	42.8	Very low	57	Low	186 Å²	186	112.4 Å²	112.4	97%	0.974	61%	0.611	S	S	*	*			trans	-57.4	67.9	154.6	-76.1	151	0	0	0	109.5
447	Q	42.9	Very low	58.5	Low	152 Å²	152	111.2 Å²	111.2	71%	0.71	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-72.8	125.2	150.3	-71	-174.7	-1.2	0	0	104.4	S445 L449	S445-Q447 PolarHBondContact O-N 3.01Å; Q447-L449 PolarHBondContact O-N 2.89Å
448	P	45.3	Very low	59.9	Low	125 Å²	125	102.9 Å²	102.9	81%	0.812	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-54.3	117.3	173.2	21.9	-29.7	0	0	0	106.7	A450	P448-A450 PolarHBondContact O-N 3.27Å; P448-A450 VanDerWaalsContact O-N 3.1Å
449	L	57.1	Low	61.4	Low	116 Å²	116	103.7 Å²	103.7	61%	0.607	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-56.2	123.3	-178.6	-151.6	95.3	0	0	0	107.3	N428 Q447	N428-L449 HydrophobicContact CB-CD2 3.36Å; N428-L449 WeakPolarHBondContact O-CD2 3.43Å; Q447-L449 PolarHBondContact O-N 2.89Å
450	A	61.9	Low	62.6	Low	75 Å²	75	103 Å²	103	62%	0.62	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-53.5	135.3	-168.4	0	0	0	0	0	110.4	P448 R452	P448-A450 PolarHBondContact O-N 3.27Å; P448-A450 VanDerWaalsContact O-N 3.1Å; A450-R452 PolarHBondContact O-N 3.24Å
451	P	69.6	Low	63.9	Low	125 Å²	125	105.5 Å²	105.5	81%	0.812	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-56.2	134.9	-180	21.6	-31.3	0	0	0	110	N453	P451-N453 PolarHBondContact O-N 2.89Å
452	R	79.3	Confident	65.1	Low	52 Å²	52	100.9 Å²	100.9	20%	0.196	55%	0.549	C	S	.	.	P	Polyproline II helix	trans	-57.5	127.2	-178.8	178.4	-172	175.9	84	22.3	109.6	A450 K454 V458	A450-R452 PolarHBondContact O-N 3.24Å; R452-K454 PolarHBondContact O-N 3.45Å; R452-V458 VanDerWaalsContact NH2-CG2 3.3Å
453	N	81.6	Confident	66.6	Low	89 Å²	89	97 Å²	97	48%	0.476	53%	0.525	S	S	.	.			trans	-69.3	104.1	168.9	-171.4	-30.4	0	0	0	109.5	P451 T455 R456	P451-N453 PolarHBondContact O-N 2.89Å; N453-T455 PolarHBondContact O-N 2.87Å; N453-T455 PolarHBondContact OD1-N 2.72Å; N453-T455 PolarHBondContact OD1-OG1 2.86Å; N453-R456 HydrophobicContact CB-CG 4.39Å; N453-R456 PolarHBondContact O-N 3.39Å
454	K	86.4	Confident	67.5	Low	63 Å²	63	99.4 Å²	99.4	27%	0.274	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-18.1	-176.1	-65.8	-176.7	175.8	-176.5	0	113.9	E416 K417 E418 R452	E416-K454 HydrophobicContact CB-CB 3.85Å; E416-K454 HydrophobicContact CB-CD 4.4Å; E416-K454 HydrophobicContact CG-CB 3.97Å; K417-K454 PolarHBondContact N-O 2.88Å; E418-K454 IonicContact OE1-NZ 3.37Å; E418-K454 PolarHBondContact OE1-NZ 3.17Å; R452-K454 PolarHBondContact O-N 3.45Å
455	T	86.1	Confident	68.9	Low	15 Å²	15	99.6 Å²	99.6	9%	0.092	53%	0.526	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-16	-180	68.2	0	0	0	0	113.1	I388 Y389 L414 W415 E416 N453	I388-T455 CarbonylContact C-O 3.6Å; I388-T455 WeakPolarHBondContact CA-O 3.44Å; Y389-T455 PolarHBondContact N-O 3.43Å; L414-T455 HydrophobicContact CB-CG2 3.79Å; L414-T455 HydrophobicContact CD1-CG2 4.46Å; W415-T455 WeakPolarHBondContact O-CA 3.32Å; E416-T455 HydrophobicContact CG-CG2 3.73Å; N453-T455 PolarHBondContact O-N 2.87Å; N453-T455 PolarHBondContact OD1-N 2.72Å; N453-T455 PolarHBondContact OD1-OG1 2.86Å
456	R	85.9	Confident	70.5	Confident	82 Å²	82	98 Å²	98	31%	0.309	52%	0.518	S	S	.	.	B	Isolated β-bridge	trans	-80.6	143.6	176.6	-75.4	-168.3	167.1	-131.8	-8.9	112	E386 G387 I388 Y389 N453 V458	E386-R456 IonicContact OE1-NH1 3.28Å; E386-R456 PolarHBondContact OE1-NH1 3.33Å; E386-R456 IonicContact OE2-CZ 3.35Å; E386-R456 IonicContact OE2-NH1 2.68Å; E386-R456 PolarHBondContact OE2-NH1 2.85Å; E386-R456 IonicContact OE2-NH2 3.34Å; G387-R456 WeakPolarHBondContact O-CA 3.46Å; I388-R456 HydrophobicContact CG2-CG 4.46Å; Y389-R456 WeakPolarHBondContact CE2-O 3.32Å; N453-R456 HydrophobicContact CB-CG 4.39Å; N453-R456 PolarHBondContact O-N 3.39Å; R456-V458 PolarHBondContact O-N 3.11Å
457	V	85.5	Confident	71.9	Confident	36 Å²	36	92 Å²	92	22%	0.218	50%	0.495	C	S	.	.			trans	-58.6	131.9	176.5	172.7	0	0	0	0	109.8	G387 Y389 A400 I402 S459	G387-V457 VanDerWaalsContact C-CG2 3.43Å; G387-V457 PolarHBondContact O-N 2.91Å; Y389-V457 HydrophobicContact CD1-CG2 4.26Å; Y389-V457 HydrophobicContact CE1-CG2 4Å; Y389-V457 HydrophobicContact CE2-CG2 4.49Å; A400-V457 HydrophobicContact CB-CG2 3.78Å; I402-V457 HydrophobicContact CG2-CG2 4.28Å; V457-S459 PolarHBondContact O-N 3.1Å; V457-S459 VanDerWaalsContact O-N 3.14Å
458	V	83.8	Confident	73.3	Confident	42 Å²	42	87.9 Å²	87.9	26%	0.255	48%	0.48	S	S	.	.			trans	-72.6	106.6	-179.9	-170.7	0	0	0	0	109.6	Y389 K417 L419 L427 R452 R456	Y389-V458 HydrophobicContact CE2-CG2 4.38Å; Y389-V458 PolarHBondContact OH-N 2.86Å; K417-V458 HydrophobicContact CD-CG2 4.05Å; L419-V458 HydrophobicContact CD1-CG1 4.13Å; L419-V458 HydrophobicContact CD1-CG2 3.96Å; L427-V458 HydrophobicContact CD1-CG1 3.7Å; L427-V458 HydrophobicContact CD2-CG1 4.49Å; R452-V458 VanDerWaalsContact NH2-CG2 3.3Å; R456-V458 PolarHBondContact O-N 3.11Å
459	S	77.7	Confident	74.6	Confident	89 Å²	89	87.6 Å²	87.6	62%	0.622	47%	0.468	S	S	*	.			trans	-105.1	144	168.7	58.3	0	0	0	0	110.6	V457	V457-S459 PolarHBondContact O-N 3.1Å; V457-S459 VanDerWaalsContact O-N 3.14Å
460	Y	76.2	Confident	75.4	Confident	112 Å²	112	84.9 Å²	84.9	44%	0.439	46%	0.456	S	S	.	.			trans	-136.1	125.7	173.6	-179.1	-112.8	0	0	0	108.8	L427 V462 V468	L427-Y460 HydrophobicContact CD2-CD2 3.61Å; L427-Y460 HydrophobicContact CD2-CE2 4.5Å; L427-Y460 HydrophobicContact CD2-CG 4.12Å; Y460-V462 HydrophobicContact CD1-CG2 4.33Å; Y460-V462 PolarHBondContact O-N 2.89Å; Y460-V468 HydrophobicContact CD1-CG2 4.07Å; Y460-V468 HydrophobicContact CE1-CG2 3.8Å
461	R	71.9	Confident	75.7	Confident	238 Å²	238	86.5 Å²	86.5	90%	0.898	45%	0.447	S	S	*	.			trans	-80.2	112.3	174.4	-66.9	-176.2	-169.6	159.8	2.9	108	P463	R461-P463 VanDerWaalsContact O-CD 3.28Å; R461-P463 WeakPolarHBondContact O-CD 3.34Å
462	V	71.5	Confident	75.8	Confident	73 Å²	73	81.8 Å²	81.8	44%	0.442	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-70.5	120.5	175.1	-177.6	0	0	0	0	108.3	Y460 A466 V468	Y460-V462 HydrophobicContact CD1-CG2 4.33Å; Y460-V462 PolarHBondContact O-N 2.89Å; V462-A466 HydrophobicContact CG1-CB 4.12Å; V462-A466 WeakPolarHBondContact CG1-O 3.38Å; V462-V468 HydrophobicContact CG1-CG2 4.12Å; V462-V468 HydrophobicContact CG2-CB 4.21Å; V462-V468 HydrophobicContact CG2-CG2 3.82Å
463	P	70.7	Confident	75.4	Confident	17 Å²	17	88.7 Å²	88.7	11%	0.11	44%	0.443	C	S	.	.	P	Polyproline II helix	trans	-60.4	158.1	178.5	-25.5	35.2	0	0	0	113.2	P433 R461 N465 A466	P433-P463 HydrophobicContact CG-CG 4.47Å; R461-P463 VanDerWaalsContact O-CD 3.28Å; R461-P463 WeakPolarHBondContact O-CD 3.34Å; P463-N465 PolarHBondContact O-N 2.93Å; P463-A466 HydrophobicContact CB-CB 4.03Å; P463-A466 HydrophobicContact CG-CB 4.29Å; P463-A466 WeakPolarHBondContact O-CB 3.37Å; P463-A466 PolarHBondContact O-N 2.81Å; P463-A466 VanDerWaalsContact O-N 3.09Å
464	H	62.8	Low	74.9	Confident	158 Å²	158	94 Å²	94	73%	0.731	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	132.4	173	-67.5	84.2	0	0	0	109.7	A466	H464-A466 VanDerWaalsContact C-N 3.3Å; H464-A466 PolarHBondContact O-N 2.84Å
465	N	70.9	Confident	74.1	Confident	165 Å²	165	96.6 Å²	96.6	88%	0.882	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	66	18.7	-173.5	-55.3	-40.5	0	0	0	116.1	P463	P463-N465 PolarHBondContact O-N 2.93Å
466	A	71.2	Confident	73.3	Confident	49 Å²	49	103.8 Å²	103.8	41%	0.405	50%	0.499	S	S	.	.			trans	-107.6	155.2	169.7	0	0	0	0	0	111.6	V462 P463 H464	V462-A466 HydrophobicContact CG1-CB 4.12Å; V462-A466 WeakPolarHBondContact CG1-O 3.38Å; P463-A466 HydrophobicContact CB-CB 4.03Å; P463-A466 HydrophobicContact CG-CB 4.29Å; P463-A466 WeakPolarHBondContact O-CB 3.37Å; P463-A466 PolarHBondContact O-N 2.81Å; P463-A466 VanDerWaalsContact O-N 3.09Å; H464-A466 VanDerWaalsContact C-N 3.3Å; H464-A466 PolarHBondContact O-N 2.84Å
467	A	70.9	Confident	72.1	Confident	59 Å²	59	108 Å²	108	49%	0.488	52%	0.515	S	S	.	.			trans	-126.7	137.1	170.9	0	0	0	0	0	109.2	F496	A467-F496 HydrophobicContact CB-CZ 4.14Å
468	V	72.9	Confident	70.8	Confident	66 Å²	66	109.5 Å²	109.5	40%	0.4	53%	0.531	S	S	.	.			trans	-119.1	128.9	177.1	178.9	0	0	0	0	109.1	Y460 V462 V470	Y460-V468 HydrophobicContact CD1-CG2 4.07Å; Y460-V468 HydrophobicContact CE1-CG2 3.8Å; V462-V468 HydrophobicContact CG1-CG2 4.12Å; V462-V468 HydrophobicContact CG2-CB 4.21Å; V462-V468 HydrophobicContact CG2-CG2 3.82Å; V468-V470 HydrophobicContact CG1-CG2 4.12Å
469	Q	72.7	Confident	69.2	Low	119 Å²	119	113.6 Å²	113.6	56%	0.556	54%	0.542	S	S	*	.			trans	-91.5	124.2	173.2	-170.7	178.9	36.7	0	0	109.8	F496	Q469-F496 HydrophobicContact CB-CE2 4.26Å; Q469-F496 HydrophobicContact CB-CZ 4.36Å
470	V	73.1	Confident	67.7	Low	59 Å²	59	117 Å²	117	36%	0.358	55%	0.547	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	129.6	175.7	-177.1	0	0	0	0	109.6	V468 R479 F481	V468-V470 HydrophobicContact CG1-CG2 4.12Å; V470-R479 PolarHBondContact O-N 2.94Å; V470-F481 HydrophobicContact CG2-CE2 4.27Å
471	Y	69.7	Low	66	Low	108 Å²	108	118.6 Å²	118.6	42%	0.424	56%	0.557	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-111.3	124.3	175.6	-164.6	-99.6	0	0	0	110.6	Y473 K476 A478	Y471-Y473 HydrophobicContact CD1-CD1 4.01Å; Y471-Y473 HydrophobicContact CD1-CD2 4.16Å; Y471-Y473 HydrophobicContact CD1-CE1 4.11Å; Y471-Y473 HydrophobicContact CD1-CE2 4.25Å; Y471-Y473 HydrophobicContact CD1-CG 4.04Å; Y471-Y473 HydrophobicContact CE1-CD1 4.29Å; Y471-Y473 WeakPolarHBondContact O-CD2 3.3Å; Y471-Y473 PolarHBondContact O-N 2.98Å; Y471-K476 WeakPolarHBondContact OH-CA 3.4Å; Y471-K476 PolarHBondContact OH-O 2.8Å; Y471-A478 HydrophobicContact CD2-CB 4.2Å
472	D	71.5	Confident	64.2	Low	27 Å²	27	116 Å²	116	14%	0.144	56%	0.555	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-84.6	107.4	169.8	-168.9	-33.9	0	0	0	109.5	R474 E475 K476 R477 R479	D472-R474 VanDerWaalsContact C-N 3.34Å; D472-R474 PolarHBondContact O-N 3.47Å; D472-R474 PolarHBondContact OD1-N 2.96Å; D472-E475 HydrophobicContact CB-CB 4.33Å; D472-E475 PolarHBondContact OD1-N 3.37Å; D472-K476 VanDerWaalsContact O-CA 3.23Å; D472-K476 WeakPolarHBondContact O-CA 3.46Å; D472-K476 PolarHBondContact O-N 3.21Å; D472-R477 PolarHBondContact N-O 2.92Å; D472-R477 PolarHBondContact O-N 2.8Å; D472-R479 HydrophobicContact CB-CG 4.46Å; D472-R479 IonicContact OD2-CZ 3.72Å; D472-R479 IonicContact OD2-NE 3.89Å; D472-R479 PolarHBondContact OD2-NE 3.29Å; D472-R479 IonicContact OD2-NH2 3.81Å; D472-R479 PolarHBondContact OD2-NH2 3.38Å
473	Y	71.3	Confident	62.6	Low	196 Å²	196	118.3 Å²	118.3	77%	0.769	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	-25.4	-178.7	-72.7	-90.3	0	0	0	113.8	Y471	Y471-Y473 HydrophobicContact CD1-CD1 4.01Å; Y471-Y473 HydrophobicContact CD1-CD2 4.16Å; Y471-Y473 HydrophobicContact CD1-CE1 4.11Å; Y471-Y473 HydrophobicContact CD1-CE2 4.25Å; Y471-Y473 HydrophobicContact CD1-CG 4.04Å; Y471-Y473 HydrophobicContact CE1-CD1 4.29Å; Y471-Y473 WeakPolarHBondContact O-CD2 3.3Å; Y471-Y473 PolarHBondContact O-N 2.98Å
474	R	70.9	Confident	61	Low	200 Å²	200	125.2 Å²	125.2	76%	0.755	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	-43.1	178.2	-78.1	178.8	65.6	176.2	-0.2	111.1	D472	D472-R474 VanDerWaalsContact C-N 3.34Å; D472-R474 PolarHBondContact O-N 3.47Å; D472-R474 PolarHBondContact OD1-N 2.96Å
475	E	69.3	Low	60.3	Low	118 Å²	118	123.4 Å²	123.4	55%	0.551	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90	-6	-179.3	-63.1	-171.9	176	0	0	113.6	D472 R477	D472-E475 HydrophobicContact CB-CB 4.33Å; D472-E475 PolarHBondContact OD1-N 3.37Å; E475-R477 PolarHBondContact O-N 3.46Å
476	K	70.1	Confident	59.3	Low	166 Å²	166	126.1 Å²	126.1	72%	0.722	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	53.5	33.8	-176.4	-61.2	-177.2	-180	179.2	0	113.6	Y471 D472	Y471-K476 WeakPolarHBondContact OH-CA 3.4Å; Y471-K476 PolarHBondContact OH-O 2.8Å; D472-K476 VanDerWaalsContact O-CA 3.23Å; D472-K476 WeakPolarHBondContact O-CA 3.46Å; D472-K476 PolarHBondContact O-N 3.21Å
477	R	59.6	Low	58.5	Low	171 Å²	171	133 Å²	133	65%	0.645	62%	0.619	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-115.6	130.7	-178	-74.5	177.6	176.9	-172.3	-1.5	110.5	D472 E475 R479	D472-R477 PolarHBondContact N-O 2.92Å; D472-R477 PolarHBondContact O-N 2.8Å; E475-R477 PolarHBondContact O-N 3.46Å; R477-R479 PolarHBondContact O-N 3.47Å
478	A	58.5	Low	58.1	Low	67 Å²	67	133.2 Å²	133.2	55%	0.554	61%	0.613	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-72.3	116.8	162.7	0	0	0	0	0	107.4	Y471	Y471-A478 HydrophobicContact CD2-CB 4.2Å
479	R	50.8	Low	57.7	Low	129 Å²	129	135 Å²	135	49%	0.487	63%	0.626	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-83	126.6	179	-65.2	-175.3	177.9	-161.2	-1.8	108.3	V470 D472 R477	V470-R479 PolarHBondContact O-N 2.94Å; D472-R479 HydrophobicContact CB-CG 4.46Å; D472-R479 IonicContact OD2-CZ 3.72Å; D472-R479 IonicContact OD2-NE 3.89Å; D472-R479 PolarHBondContact OD2-NE 3.29Å; D472-R479 IonicContact OD2-NH2 3.81Å; D472-R479 PolarHBondContact OD2-NH2 3.38Å; R477-R479 PolarHBondContact O-N 3.47Å
480	H	45.1	Very low	57.2	Low	159 Å²	159	136.5 Å²	136.5	74%	0.736	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-92.4	145.7	164.5	85.1	3.2	0	0	0	109
481	F	41.5	Very low	56.8	Low	147 Å²	147	139.5 Å²	139.5	65%	0.645	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-100	146.5	164.2	-72.9	-84.1	0	0	0	108.6	V470 V483	V470-F481 HydrophobicContact CG2-CE2 4.27Å; F481-V483 PolarHBondContact O-N 2.82Å
482	E	32.9	Very low	56.6	Low	182 Å²	182	137.4 Å²	137.4	85%	0.85	64%	0.641	S	S	*	*			trans	-58.4	111	177.2	-81.5	179.3	152.4	0	0	110
483	V	38.1	Very low	56.4	Low	122 Å²	122	138.3 Å²	138.3	74%	0.739	65%	0.653	S	S	*	*			trans	-113.5	126.6	165.6	-176.3	0	0	0	0	106	F481 D485	F481-V483 PolarHBondContact O-N 2.82Å; V483-D485 PolarHBondContact O-N 3.38Å
484	N	38.3	Very low	56.3	Low	163 Å²	163	134.7 Å²	134.7	87%	0.872	64%	0.641	S	S	*	*	S	Bend	trans	-60.4	-7.4	-163.6	-75	-31.7	0	0	0	117
485	D	47.7	Very low	56.4	Low	119 Å²	119	129.7 Å²	129.7	64%	0.636	63%	0.629	S	S	*	*	S	Bend	trans	-167.9	122.3	162	-130.6	-24.1	0	0	0	111.5	V483	V483-D485 PolarHBondContact O-N 3.38Å
486	R	49.7	Very low	56.6	Low	223 Å²	223	128.3 Å²	128.3	84%	0.842	62%	0.621	S	S	*	*			trans	-179.1	119.8	146.7	-99.7	165.6	-170.3	-170.9	3.4	110.4	D488	R486-D488 PolarHBondContact O-N 2.82Å
487	K	53.8	Low	56.9	Low	192 Å²	192	124 Å²	124	84%	0.835	61%	0.611	S	S	*	*			trans	-86.9	23.5	-153	-79	-179.1	175.6	173.9	0	118.3
488	D	62.4	Low	57.8	Low	65 Å²	65	116.8 Å²	116.8	35%	0.348	59%	0.587	S	S	.	*			trans	-152.8	117.4	174.1	-162.9	-16.3	0	0	0	113.7	R486 Q490 E491 T492	R486-D488 PolarHBondContact O-N 2.82Å; D488-Q490 PolarHBondContact O-N 2.82Å; D488-Q490 WeakPolarHBondContact OD1-CB 3.46Å; D488-Q490 PolarHBondContact OD1-N 2.84Å; D488-E491 HydrophobicContact CB-CB 3.87Å; D488-E491 PolarHBondContact O-N 3.3Å; D488-T492 PolarHBondContact O-N 2.88Å; D488-T492 VanDerWaalsContact O-N 3.1Å; D488-T492 PolarHBondContact O-OG1 3.32Å
489	P	64.3	Low	58.5	Low	104 Å²	104	120 Å²	120	68%	0.675	60%	0.602	S	S	*	*	H	α-helix	trans	-57	-29.1	172.8	-23.8	33.4	0	0	0	113.7	A493	P489-A493 PolarHBondContact O-N 2.82Å
490	Q	63	Low	59.8	Low	149 Å²	149	118.7 Å²	118.7	70%	0.696	60%	0.604	S	S	*	*	H	α-helix	trans	-77.5	-35.8	179.2	-63.5	-173.3	0.3	0	0	112.3	D488 T492 A493 K494	D488-Q490 PolarHBondContact O-N 2.82Å; D488-Q490 WeakPolarHBondContact OD1-CB 3.46Å; D488-Q490 PolarHBondContact OD1-N 2.84Å; Q490-T492 VanDerWaalsContact C-N 3.33Å; Q490-A493 PolarHBondContact O-N 3.46Å; Q490-K494 PolarHBondContact O-N 2.98Å
491	E	64.3	Low	61.4	Low	122 Å²	122	116 Å²	116	57%	0.57	59%	0.591	S	S	*	*	H	α-helix	trans	-70.4	-33.1	175	-163.3	174.8	-155.1	0	0	111.4	D488 A493 K494	D488-E491 HydrophobicContact CB-CB 3.87Å; D488-E491 PolarHBondContact O-N 3.3Å; E491-A493 VanDerWaalsContact C-N 3.33Å; E491-A493 PolarHBondContact O-N 2.96Å; E491-K494 WeakPolarHBondContact O-CB 3.28Å; E491-K494 PolarHBondContact O-N 3.39Å; E491-K494 VanDerWaalsContact O-N 3.14Å
492	T	66.4	Low	63.2	Low	64 Å²	64	112.6 Å²	112.6	39%	0.393	58%	0.582	S	S	.	*	H	α-helix	trans	-68.1	-33.7	174.1	-49	0	0	0	0	111.9	D488 Q490 K494 L495	D488-T492 PolarHBondContact O-N 2.88Å; D488-T492 VanDerWaalsContact O-N 3.1Å; D488-T492 PolarHBondContact O-OG1 3.32Å; Q490-T492 VanDerWaalsContact C-N 3.33Å; T492-K494 VanDerWaalsContact C-N 3.32Å; T492-L495 HydrophobicContact CG2-CD1 4.29Å; T492-L495 WeakPolarHBondContact O-CB 3.34Å
493	A	66.7	Low	65.3	Low	47 Å²	47	105.2 Å²	105.2	39%	0.388	56%	0.555	S	S	.	*	H	α-helix	trans	-69.4	-28	172.1	0	0	0	0	0	112.7	P489 Q490 E491 L495 F496	P489-A493 PolarHBondContact O-N 2.82Å; Q490-A493 PolarHBondContact O-N 3.46Å; E491-A493 VanDerWaalsContact C-N 3.33Å; E491-A493 PolarHBondContact O-N 2.96Å; A493-L495 PolarHBondContact O-N 2.91Å; A493-F496 PolarHBondContact O-N 3.2Å
494	K	69.1	Low	67.1	Low	119 Å²	119	102.5 Å²	102.5	52%	0.517	54%	0.536	S	S	.	.	H	α-helix	trans	-62.3	-26.7	177.4	-72.1	178.8	-175.8	169	0	113.5	Q490 E491 T492 F496 S497	Q490-K494 PolarHBondContact O-N 2.98Å; E491-K494 WeakPolarHBondContact O-CB 3.28Å; E491-K494 PolarHBondContact O-N 3.39Å; E491-K494 VanDerWaalsContact O-N 3.14Å; T492-K494 VanDerWaalsContact C-N 3.32Å; K494-F496 PolarHBondContact O-N 3.06Å; K494-S497 WeakPolarHBondContact CA-OG 3.45Å; K494-S497 WeakPolarHBondContact O-CB 3.42Å; K494-S497 PolarHBondContact O-N 3.48Å; K494-S497 VanDerWaalsContact O-N 3.15Å; K494-S497 PolarHBondContact O-OG 2.94Å
495	L	72.2	Confident	69	Low	95 Å²	95	95.1 Å²	95.1	50%	0.497	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-31.3	174.1	-75	151.3	0	0	0	112.1	T492 A493	T492-L495 HydrophobicContact CG2-CD1 4.29Å; T492-L495 WeakPolarHBondContact O-CB 3.34Å; A493-L495 PolarHBondContact O-N 2.91Å
496	F	75.1	Confident	70.6	Confident	90 Å²	90	92.9 Å²	92.9	40%	0.395	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	8.4	-178.2	-56.5	-81.8	0	0	0	113.1	A467 Q469 A493 K494 V498	A467-F496 HydrophobicContact CB-CZ 4.14Å; Q469-F496 HydrophobicContact CB-CE2 4.26Å; Q469-F496 HydrophobicContact CB-CZ 4.36Å; A493-F496 PolarHBondContact O-N 3.2Å; K494-F496 PolarHBondContact O-N 3.06Å; F496-V498 VanDerWaalsContact C-N 3.31Å; F496-V498 PolarHBondContact O-N 2.8Å
497	S	76.1	Confident	72.3	Confident	74 Å²	74	89.7 Å²	89.7	52%	0.517	48%	0.483	S	S	.	.	S	Bend	trans	-66.2	-30.7	-179.8	-71.8	0	0	0	0	113.7	K494	K494-S497 WeakPolarHBondContact CA-OG 3.45Å; K494-S497 WeakPolarHBondContact O-CB 3.42Å; K494-S497 PolarHBondContact O-N 3.48Å; K494-S497 VanDerWaalsContact O-N 3.15Å; K494-S497 PolarHBondContact O-OG 2.94Å
498	V	77.8	Confident	73.5	Confident	21 Å²	21	82.1 Å²	82.1	13%	0.127	46%	0.456	C	S	.	.	S	Bend	trans	-104.7	110.2	179.8	-177.9	0	0	0	0	108.1	F496 D500 F501 D504 Q564 N565	F496-V498 VanDerWaalsContact C-N 3.31Å; F496-V498 PolarHBondContact O-N 2.8Å; V498-D500 VanDerWaalsContact C-N 3.33Å; V498-D500 PolarHBondContact O-N 2.73Å; V498-F501 HydrophobicContact CB-CB 4.4Å; V498-F501 HydrophobicContact CG1-CB 4.27Å; V498-D504 HydrophobicContact CG1-CB 4.35Å; V498-Q564 HydrophobicContact CG2-CB 4.01Å; V498-N565 HydrophobicContact CB-CB 4.18Å; V498-N565 HydrophobicContact CG2-CB 3.81Å
499	P	73.9	Confident	74.6	Confident	135 Å²	135	80.8 Å²	80.8	88%	0.877	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-38.4	-175.7	-23.7	32.9	0	0	0	113.6
500	D	78.6	Confident	75.4	Confident	100 Å²	100	77.4 Å²	77.4	54%	0.535	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.2	75.7	176	-178.2	13.3	0	0	0	110.3	V498 V502 G503 D504	V498-D500 VanDerWaalsContact C-N 3.33Å; V498-D500 PolarHBondContact O-N 2.73Å; D500-V502 PolarHBondContact O-N 2.86Å; D500-G503 PolarHBondContact O-N 3.1Å; D500-G503 PolarHBondContact OD1-N 3Å; D500-G503 WeakPolarHBondContact OD2-CA 3.5Å; D500-D504 PolarHBondContact O-N 2.8Å; D500-D504 VanDerWaalsContact O-N 3.1Å
501	F	78.3	Confident	76.4	Confident	103 Å²	103	73.8 Å²	73.8	45%	0.452	42%	0.421	S	S	.	.	H	α-helix	trans	-64.4	-29.2	-179	75.2	-84.6	0	0	0	113.2	V498 A505 N565 L567	V498-F501 HydrophobicContact CB-CB 4.4Å; V498-F501 HydrophobicContact CG1-CB 4.27Å; F501-A505 VanDerWaalsContact O-CB 3.31Å; F501-A505 WeakPolarHBondContact O-CB 3.11Å; F501-A505 PolarHBondContact O-N 3.36Å; F501-N565 WeakPolarHBondContact CB-ND2 3.38Å; F501-L567 HydrophobicContact CD2-CD1 4.02Å; F501-L567 HydrophobicContact CD2-CD2 4.15Å; F501-L567 HydrophobicContact CE2-CD1 4.25Å
502	V	77.8	Confident	77.3	Confident	75 Å²	75	73.8 Å²	73.8	46%	0.455	42%	0.415	S	S	.	.	H	α-helix	trans	-72.1	-50	178.1	179.3	0	0	0	0	109.6	D500 D504 A505 C506	D500-V502 PolarHBondContact O-N 2.86Å; V502-D504 PolarHBondContact O-N 2.91Å; V502-A505 PolarHBondContact O-N 2.9Å; V502-C506 WeakPolarHBondContact O-CB 3.27Å; V502-C506 PolarHBondContact O-N 2.85Å; V502-C506 PolarHBondContact O-SG 3.35Å
503	G	76.9	Confident	78.2	Confident	28 Å²	28	72 Å²	72	29%	0.289	41%	0.405	S	S	.	.	H	α-helix	trans	-60.4	-42.2	179.3	0	0	0	0	0	112.9	D500 C506 K507	D500-G503 PolarHBondContact O-N 3.1Å; D500-G503 PolarHBondContact OD1-N 3Å; D500-G503 WeakPolarHBondContact OD2-CA 3.5Å; G503-C506 PolarHBondContact O-N 2.95Å; G503-K507 VanDerWaalsContact O-CB 3.26Å; G503-K507 WeakPolarHBondContact O-CB 3.2Å; G503-K507 PolarHBondContact O-N 2.79Å
504	D	76.9	Confident	79.1	Confident	64 Å²	64	77.3 Å²	77.3	34%	0.342	41%	0.414	S	S	.	.	H	α-helix	trans	-65.5	-43.2	178	-165.2	53.3	0	0	0	112.1	V498 D500 V502 K507 A508	V498-D504 HydrophobicContact CG1-CB 4.35Å; D500-D504 PolarHBondContact O-N 2.8Å; D500-D504 VanDerWaalsContact O-N 3.1Å; V502-D504 PolarHBondContact O-N 2.91Å; D504-K507 PolarHBondContact O-N 2.9Å; D504-A508 PolarHBondContact O-N 2.91Å; D504-A508 VanDerWaalsContact O-N 3.12Å
505	A	78.3	Confident	79.7	Confident	8 Å²	8	74.2 Å²	74.2	7%	0.066	42%	0.416	C	S	.	.	H	α-helix	trans	-62.1	-47.6	175.4	0	0	0	0	0	112.2	F501 V502 K507 A508 I509 F562 L567	F501-A505 VanDerWaalsContact O-CB 3.31Å; F501-A505 WeakPolarHBondContact O-CB 3.11Å; F501-A505 PolarHBondContact O-N 3.36Å; V502-A505 PolarHBondContact O-N 2.9Å; A505-K507 VanDerWaalsContact C-N 3.33Å; A505-K507 PolarHBondContact O-N 2.89Å; A505-A508 PolarHBondContact O-N 2.82Å; A505-I509 WeakPolarHBondContact O-CB 3.39Å; A505-I509 VanDerWaalsContact O-CG1 3.29Å; A505-I509 WeakPolarHBondContact O-CG1 3.5Å; A505-I509 PolarHBondContact O-N 3.4Å; A505-F562 HydrophobicContact CB-CE2 3.97Å; A505-F562 HydrophobicContact CB-CZ 3.94Å; A505-L567 HydrophobicContact CB-CD2 3.52Å
506	C	82.2	Confident	80.2	Confident	72 Å²	72	70.9 Å²	70.9	49%	0.486	40%	0.403	S	S	.	.	H	α-helix	trans	-61.9	-39.6	177.5	-72.9	0	0	0	0	112.1	V502 G503 A508 I509 A510	V502-C506 WeakPolarHBondContact O-CB 3.27Å; V502-C506 PolarHBondContact O-N 2.85Å; V502-C506 PolarHBondContact O-SG 3.35Å; G503-C506 PolarHBondContact O-N 2.95Å; C506-A508 PolarHBondContact O-N 3.05Å; C506-I509 PolarHBondContact O-N 2.87Å; C506-A510 WeakPolarHBondContact O-CB 3.3Å; C506-A510 PolarHBondContact O-N 3.08Å
507	K	83.6	Confident	80.7	Confident	157 Å²	157	68.4 Å²	68.4	68%	0.683	40%	0.395	S	S	*	.	H	α-helix	trans	-62.4	-44	178.3	-173	177.5	-178.1	-179.4	0	111.7	G503 D504 A505 S511	G503-K507 VanDerWaalsContact O-CB 3.26Å; G503-K507 WeakPolarHBondContact O-CB 3.2Å; G503-K507 PolarHBondContact O-N 2.79Å; D504-K507 PolarHBondContact O-N 2.9Å; A505-K507 VanDerWaalsContact C-N 3.33Å; A505-K507 PolarHBondContact O-N 2.89Å; K507-S511 PolarHBondContact O-N 2.83Å
508	A	80.6	Confident	81	Confident	32 Å²	32	69.3 Å²	69.3	26%	0.264	41%	0.407	S	S	.	.	H	α-helix	trans	-65.4	-46.4	176.3	0	0	0	0	0	112.1	D504 A505 C506 S511 R512 F562	D504-A508 PolarHBondContact O-N 2.91Å; D504-A508 VanDerWaalsContact O-N 3.12Å; A505-A508 PolarHBondContact O-N 2.82Å; C506-A508 PolarHBondContact O-N 3.05Å; A508-S511 PolarHBondContact O-N 3.5Å; A508-R512 PolarHBondContact O-N 3.29Å; A508-F562 HydrophobicContact CB-CE1 3.78Å; A508-F562 HydrophobicContact CB-CZ 4.02Å
509	I	84.2	Confident	81.3	Confident	37 Å²	37	73 Å²	73	19%	0.19	43%	0.434	C	S	.	.	H	α-helix	trans	-60.5	-49.1	177.4	-72.1	172.7	0	0	0	111	A505 C506 S511 R512 V513 V537 V569	A505-I509 WeakPolarHBondContact O-CB 3.39Å; A505-I509 VanDerWaalsContact O-CG1 3.29Å; A505-I509 WeakPolarHBondContact O-CG1 3.5Å; A505-I509 PolarHBondContact O-N 3.4Å; C506-I509 PolarHBondContact O-N 2.87Å; I509-S511 VanDerWaalsContact C-N 3.27Å; I509-S511 PolarHBondContact O-N 2.71Å; I509-R512 PolarHBondContact O-N 2.82Å; I509-R512 VanDerWaalsContact O-N 3.08Å; I509-V513 HydrophobicContact CG2-CG2 4.41Å; I509-V513 WeakPolarHBondContact O-CG2 3.38Å; I509-V513 PolarHBondContact O-N 3.37Å; I509-V537 HydrophobicContact CD1-CG1 4.47Å; I509-V537 HydrophobicContact CG1-CG1 3.97Å; I509-V537 HydrophobicContact CG2-CG1 4.41Å; I509-V537 HydrophobicContact CG2-CG2 3.77Å; I509-V569 HydrophobicContact CD1-CG1 4.4Å; I509-V569 HydrophobicContact CD1-CG2 4.31Å
510	A	81.1	Confident	81.8	Confident	34 Å²	34	68.8 Å²	68.8	28%	0.281	41%	0.405	S	S	.	.	H	α-helix	trans	-61.1	-36.6	-178.5	0	0	0	0	0	112.1	C506 R514	C506-A510 WeakPolarHBondContact O-CB 3.3Å; C506-A510 PolarHBondContact O-N 3.08Å; A510-R514 WeakPolarHBondContact O-CB 3.36Å; A510-R514 WeakPolarHBondContact O-CG 3.39Å; A510-R514 PolarHBondContact O-N 3.27Å
511	S	84.3	Confident	82.1	Confident	73 Å²	73	68.7 Å²	68.7	51%	0.51	41%	0.408	S	S	.	.	H	α-helix	trans	-62.5	-42.7	174.7	-165.7	0	0	0	0	112.4	K507 A508 I509 G515	K507-S511 PolarHBondContact O-N 2.83Å; A508-S511 PolarHBondContact O-N 3.5Å; I509-S511 VanDerWaalsContact C-N 3.27Å; I509-S511 PolarHBondContact O-N 2.71Å; S511-G515 PolarHBondContact O-N 3.46Å
512	R	83.7	Confident	82.2	Confident	122 Å²	122	68.8 Å²	68.8	46%	0.46	41%	0.409	S	S	.	.	H	α-helix	trans	-66.4	-44.7	178.7	-67.3	-179.8	-174.1	-178.6	3.3	112	A508 I509 G515 A516 A536 V537	A508-R512 PolarHBondContact O-N 3.29Å; I509-R512 PolarHBondContact O-N 2.82Å; I509-R512 VanDerWaalsContact O-N 3.08Å; R512-G515 PolarHBondContact O-N 2.84Å; R512-A516 PolarHBondContact O-N 2.8Å; R512-A536 WeakPolarHBondContact CB-O 3.25Å; R512-V537 PolarHBondContact NH1-O 3.35Å
513	V	85.9	Confident	82.2	Confident	27 Å²	27	69.5 Å²	69.5	16%	0.164	41%	0.41	C	S	.	.	H	α-helix	trans	-62.8	-48.9	178.5	173.3	0	0	0	0	111.4	I509 G515 A516 V517 I533 V537	I509-V513 HydrophobicContact CG2-CG2 4.41Å; I509-V513 WeakPolarHBondContact O-CG2 3.38Å; I509-V513 PolarHBondContact O-N 3.37Å; V513-G515 VanDerWaalsContact C-N 3.27Å; V513-G515 PolarHBondContact O-N 3.21Å; V513-A516 PolarHBondContact O-N 2.79Å; V513-A516 VanDerWaalsContact O-N 3.16Å; V513-V517 HydrophobicContact CG1-CG2 3.95Å; V513-V517 WeakPolarHBondContact O-CG2 3.36Å; V513-V517 PolarHBondContact O-N 3.45Å; V513-I533 HydrophobicContact CG1-CD1 4.47Å; V513-I533 HydrophobicContact CG1-CG1 3.93Å; V513-I533 HydrophobicContact CG2-CG2 3.85Å; V513-V537 HydrophobicContact CG2-CG2 3.63Å
514	R	84.3	Confident	82.4	Confident	157 Å²	157	71.2 Å²	71.2	59%	0.592	41%	0.413	S	S	*	.	H	α-helix	trans	-57.2	-40.9	179.2	-76.5	-171	-60	-100.3	-1.1	112.4	A510 A518	A510-R514 WeakPolarHBondContact O-CB 3.36Å; A510-R514 WeakPolarHBondContact O-CG 3.39Å; A510-R514 PolarHBondContact O-N 3.27Å; R514-A518 PolarHBondContact O-N 2.97Å
515	G	83.1	Confident	82.7	Confident	54 Å²	54	69.5 Å²	69.5	56%	0.557	40%	0.402	S	S	*	.	H	α-helix	trans	-62.4	-41.8	177.7	0	0	0	0	0	113.3	S511 R512 V513	S511-G515 PolarHBondContact O-N 3.46Å; R512-G515 PolarHBondContact O-N 2.84Å; V513-G515 VanDerWaalsContact C-N 3.27Å; V513-G515 PolarHBondContact O-N 3.21Å
516	A	81.7	Confident	82.8	Confident	26 Å²	26	74.1 Å²	74.1	22%	0.215	42%	0.422	C	S	.	.	H	α-helix	trans	-74.9	-43.1	-179.6	0	0	0	0	0	113.1	R512 V513 A518 S519 A536	R512-A516 PolarHBondContact O-N 2.8Å; V513-A516 PolarHBondContact O-N 2.79Å; V513-A516 VanDerWaalsContact O-N 3.16Å; A516-A518 VanDerWaalsContact C-N 3.28Å; A516-A518 PolarHBondContact O-N 3.38Å; A516-S519 PolarHBondContact O-N 2.64Å; A516-S519 VanDerWaalsContact O-N 3.12Å; A516-S519 PolarHBondContact O-OG 3.39Å; A516-A536 HydrophobicContact CB-CB 3.4Å; A516-A536 VanDerWaalsContact CB-CB 3.4Å
517	V	85.2	Confident	82.6	Confident	38 Å²	38	77.4 Å²	77.4	23%	0.23	43%	0.428	C	S	.	.	H	α-helix	trans	-65.9	-32	-176.8	176.1	0	0	0	0	111.9	V513 S519 V520 F525 I532	V513-V517 HydrophobicContact CG1-CG2 3.95Å; V513-V517 WeakPolarHBondContact O-CG2 3.36Å; V513-V517 PolarHBondContact O-N 3.45Å; V517-S519 PolarHBondContact O-N 2.74Å; V517-V520 PolarHBondContact O-N 3.09Å; V517-F525 HydrophobicContact CB-CE2 4.32Å; V517-F525 HydrophobicContact CG1-CD1 4.16Å; V517-F525 HydrophobicContact CG1-CD2 4.05Å; V517-F525 HydrophobicContact CG1-CE1 4.03Å; V517-F525 HydrophobicContact CG1-CE2 3.97Å; V517-F525 HydrophobicContact CG1-CG 4.16Å; V517-F525 HydrophobicContact CG1-CZ 3.95Å; V517-F525 HydrophobicContact CG2-CD2 4.04Å; V517-F525 HydrophobicContact CG2-CE2 3.38Å; V517-F525 HydrophobicContact CG2-CZ 3.71Å; V517-I532 HydrophobicContact CG2-CG2 4.43Å
518	A	83.4	Confident	82.6	Confident	93 Å²	93	72.9 Å²	72.9	77%	0.769	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-15.9	176	0	0	0	0	0	114	R514 A516	R514-A518 PolarHBondContact O-N 2.97Å; A516-A518 VanDerWaalsContact C-N 3.28Å; A516-A518 PolarHBondContact O-N 3.38Å
519	S	82.9	Confident	82.6	Confident	99 Å²	99	72.5 Å²	72.5	69%	0.692	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-0.3	-179.4	72.1	0	0	0	0	114.9	A516 V517	A516-S519 PolarHBondContact O-N 2.64Å; A516-S519 VanDerWaalsContact O-N 3.12Å; A516-S519 PolarHBondContact O-OG 3.39Å; V517-S519 PolarHBondContact O-N 2.74Å
520	V	84.6	Confident	82.3	Confident	46 Å²	46	73.2 Å²	73.2	28%	0.279	42%	0.418	S	S	.	.	S	Bend	trans	-122.5	153.8	-174.3	-173.8	0	0	0	0	111.1	V517 D524 F525 I532	V517-V520 PolarHBondContact O-N 3.09Å; V520-D524 HydrophobicContact CG1-CB 3.91Å; V520-D524 WeakPolarHBondContact CG1-OD2 3.32Å; V520-F525 HydrophobicContact CG1-CB 4.42Å; V520-I532 HydrophobicContact CG1-CD1 4.02Å; V520-I532 HydrophobicContact CG2-CD1 4.43Å
521	T	85.3	Confident	82.2	Confident	97 Å²	97	79.4 Å²	79.4	60%	0.595	43%	0.434	S	S	*	.			trans	-77.8	157.4	176.7	67.5	0	0	0	0	112.4	D523 D524 F525	T521-D523 PolarHBondContact O-N 2.79Å; T521-D524 PolarHBondContact O-N 3.46Å; T521-D524 WeakPolarHBondContact OG1-CB 3.35Å; T521-F525 WeakPolarHBondContact O-CB 3.28Å; T521-F525 PolarHBondContact O-N 2.85Å
522	F	79.8	Confident	82.1	Confident	106 Å²	106	77 Å²	77	47%	0.465	42%	0.416	S	S	.	.	H	α-helix	trans	-61.9	-43.6	-175.7	177.8	-97.8	0	0	0	113.7	F525 H526 P579 L588	F522-F525 PolarHBondContact O-N 3.46Å; F522-H526 VanDerWaalsContact O-CB 3.26Å; F522-H526 WeakPolarHBondContact O-CB 3.23Å; F522-H526 PolarHBondContact O-N 2.95Å; F522-P579 HydrophobicContact CE2-CG 4.3Å; F522-P579 HydrophobicContact CZ-CG 4.18Å; F522-L588 HydrophobicContact CE1-CD1 3.98Å; F522-L588 HydrophobicContact CE1-CD2 4.49Å; F522-L588 HydrophobicContact CZ-CD1 3.62Å
523	D	79.3	Confident	82	Confident	90 Å²	90	72.1 Å²	72.1	48%	0.481	40%	0.398	S	S	.	.	H	α-helix	trans	-68.6	-40	-179.1	-175.9	60.5	0	0	0	112	T521 H526 K527	T521-D523 PolarHBondContact O-N 2.79Å; D523-H526 PolarHBondContact O-N 3Å; D523-K527 VanDerWaalsContact CG-NZ 3.34Å; D523-K527 WeakPolarHBondContact O-CG 3.29Å; D523-K527 PolarHBondContact O-N 3.12Å; D523-K527 VanDerWaalsContact OD1-CE 3.28Å; D523-K527 WeakPolarHBondContact OD1-CE 3.36Å; D523-K527 IonicContact OD1-NZ 3.11Å; D523-K527 PolarHBondContact OD1-NZ 3.25Å; D523-K527 WeakPolarHBondContact OD2-CE 3.4Å; D523-K527 IonicContact OD2-NZ 3.33Å; D523-K527 PolarHBondContact OD2-NZ 2.8Å
524	D	80.1	Confident	81.6	Confident	64 Å²	64	76.9 Å²	76.9	34%	0.342	41%	0.413	S	S	.	.	H	α-helix	trans	-67.7	-41	175.8	-173.8	32.4	0	0	0	111.2	V520 T521 K527 N528	V520-D524 HydrophobicContact CG1-CB 3.91Å; V520-D524 WeakPolarHBondContact CG1-OD2 3.32Å; T521-D524 PolarHBondContact O-N 3.46Å; T521-D524 WeakPolarHBondContact OG1-CB 3.35Å; D524-K527 PolarHBondContact O-N 2.98Å; D524-N528 VanDerWaalsContact O-CB 3.32Å; D524-N528 WeakPolarHBondContact O-CB 3.46Å; D524-N528 PolarHBondContact O-N 3.34Å; D524-N528 PolarHBondContact OD1-ND2 2.76Å
525	F	82.7	Confident	81.3	Confident	27 Å²	27	71 Å²	71	12%	0.118	40%	0.395	C	S	.	.	H	α-helix	trans	-64.8	-39.2	172.6	-175.4	-110.9	0	0	0	112.3	V517 V520 T521 F522 K527 N528 S529 I532 I533 V577	V517-F525 HydrophobicContact CB-CE2 4.32Å; V517-F525 HydrophobicContact CG1-CD1 4.16Å; V517-F525 HydrophobicContact CG1-CD2 4.05Å; V517-F525 HydrophobicContact CG1-CE1 4.03Å; V517-F525 HydrophobicContact CG1-CE2 3.97Å; V517-F525 HydrophobicContact CG1-CG 4.16Å; V517-F525 HydrophobicContact CG1-CZ 3.95Å; V517-F525 HydrophobicContact CG2-CD2 4.04Å; V517-F525 HydrophobicContact CG2-CE2 3.38Å; V517-F525 HydrophobicContact CG2-CZ 3.71Å; V520-F525 HydrophobicContact CG1-CB 4.42Å; T521-F525 WeakPolarHBondContact O-CB 3.28Å; T521-F525 PolarHBondContact O-N 2.85Å; F522-F525 PolarHBondContact O-N 3.46Å; F525-K527 VanDerWaalsContact C-N 3.3Å; F525-K527 PolarHBondContact O-N 2.75Å; F525-N528 PolarHBondContact O-N 2.85Å; F525-S529 WeakPolarHBondContact O-CA 3.38Å; F525-S529 WeakPolarHBondContact O-CB 3.13Å; F525-S529 PolarHBondContact O-N 2.62Å; F525-I532 HydrophobicContact CD2-CB 4.33Å; F525-I532 HydrophobicContact CD2-CD1 3.88Å; F525-I532 HydrophobicContact CD2-CG2 4.2Å; F525-I532 HydrophobicContact CE2-CB 4.44Å; F525-I532 HydrophobicContact CE2-CG2 4.28Å; F525-I533 HydrophobicContact CE2-CD1 4.25Å; F525-I533 HydrophobicContact CE2-CG1 4.17Å; F525-I533 HydrophobicContact CZ-CD1 4.03Å; F525-I533 HydrophobicContact CZ-CG1 4.39Å; F525-V577 HydrophobicContact CD1-CG1 4.24Å; F525-V577 HydrophobicContact CE1-CG1 3.48Å; F525-V577 VanDerWaalsContact CE1-CG1 3.48Å; F525-V577 HydrophobicContact CZ-CG1 4.17Å
526	H	79.9	Confident	81.3	Confident	105 Å²	105	69.4 Å²	69.4	49%	0.486	38%	0.376	S	S	.	.	H	α-helix	trans	-65.1	-33.8	178.8	-171.9	59.4	0	0	0	112.4	F522 D523	F522-H526 VanDerWaalsContact O-CB 3.26Å; F522-H526 WeakPolarHBondContact O-CB 3.23Å; F522-H526 PolarHBondContact O-N 2.95Å; D523-H526 PolarHBondContact O-N 3Å
527	K	79.7	Confident	81.2	Confident	141 Å²	141	68.2 Å²	68.2	61%	0.613	37%	0.367	S	S	*	.	H	α-helix	trans	-83.8	-33.6	177.1	-69.1	168.9	-178.3	163.7	0	113.6	D523 D524 F525	D523-K527 VanDerWaalsContact CG-NZ 3.34Å; D523-K527 WeakPolarHBondContact O-CG 3.29Å; D523-K527 PolarHBondContact O-N 3.12Å; D523-K527 VanDerWaalsContact OD1-CE 3.28Å; D523-K527 WeakPolarHBondContact OD1-CE 3.36Å; D523-K527 IonicContact OD1-NZ 3.11Å; D523-K527 PolarHBondContact OD1-NZ 3.25Å; D523-K527 WeakPolarHBondContact OD2-CE 3.4Å; D523-K527 IonicContact OD2-NZ 3.33Å; D523-K527 PolarHBondContact OD2-NZ 2.8Å; D524-K527 PolarHBondContact O-N 2.98Å; F525-K527 VanDerWaalsContact C-N 3.3Å; F525-K527 PolarHBondContact O-N 2.75Å
528	N	82.2	Confident	80.9	Confident	62 Å²	62	67.1 Å²	67.1	33%	0.332	36%	0.359	S	S	.	.	H	α-helix	trans	-120.8	18.3	-169.7	-64.8	-52.5	0	0	0	115	D524 F525 A530 R531 I532	D524-N528 VanDerWaalsContact O-CB 3.32Å; D524-N528 WeakPolarHBondContact O-CB 3.46Å; D524-N528 PolarHBondContact O-N 3.34Å; D524-N528 PolarHBondContact OD1-ND2 2.76Å; F525-N528 PolarHBondContact O-N 2.85Å; N528-A530 VanDerWaalsContact C-N 3.35Å; N528-A530 PolarHBondContact O-N 2.86Å; N528-R531 PolarHBondContact O-N 2.82Å; N528-R531 VanDerWaalsContact O-N 3.12Å; N528-I532 HydrophobicContact CB-CD1 4.13Å; N528-I532 PolarHBondContact O-N 3.27Å
529	S	81.7	Confident	80.4	Confident	24 Å²	24	64.1 Å²	64.1	17%	0.168	34%	0.337	C	S	.	.	H	α-helix	trans	-48.8	-47.6	-173.7	52.2	0	0	0	0	114.5	F525 R531 I532 I533	F525-S529 WeakPolarHBondContact O-CA 3.38Å; F525-S529 WeakPolarHBondContact O-CB 3.13Å; F525-S529 PolarHBondContact O-N 2.62Å; S529-R531 VanDerWaalsContact C-N 3.31Å; S529-R531 PolarHBondContact O-N 2.9Å; S529-I532 PolarHBondContact O-N 2.85Å; S529-I533 WeakPolarHBondContact O-CG1 3.43Å; S529-I533 PolarHBondContact O-N 3Å
530	A	78.1	Confident	79.6	Confident	52 Å²	52	65 Å²	65	43%	0.43	33%	0.328	S	S	.	.	H	α-helix	trans	-58.2	-40.9	-178	0	0	0	0	0	112.8	N528 R534	N528-A530 VanDerWaalsContact C-N 3.35Å; N528-A530 PolarHBondContact O-N 2.86Å; A530-R534 WeakPolarHBondContact O-CB 3.38Å; A530-R534 PolarHBondContact O-N 2.81Å
531	R	79.3	Confident	78.3	Confident	165 Å²	165	68 Å²	68	62%	0.623	34%	0.339	S	S	*	.	H	α-helix	trans	-71	-44.8	179.8	-173.3	176.7	66.7	148.8	0.7	111.1	N528 S529 R534 T535	N528-R531 PolarHBondContact O-N 2.82Å; N528-R531 VanDerWaalsContact O-N 3.12Å; S529-R531 VanDerWaalsContact C-N 3.31Å; S529-R531 PolarHBondContact O-N 2.9Å; R531-R534 PolarHBondContact O-N 2.76Å; R531-T535 PolarHBondContact O-N 3.3Å; R531-T535 VanDerWaalsContact O-N 3.12Å; R531-T535 PolarHBondContact O-OG1 2.95Å; R531-T535 VanDerWaalsContact O-OG1 3.06Å
532	I	81	Confident	76.6	Confident	23 Å²	23	70.1 Å²	70.1	12%	0.118	35%	0.352	C	S	.	.	H	α-helix	trans	-64.6	-44.5	-175.9	-65.2	164.2	0	0	0	111.1	V517 V520 F525 N528 S529 T535 A536	V517-I532 HydrophobicContact CG2-CG2 4.43Å; V520-I532 HydrophobicContact CG1-CD1 4.02Å; V520-I532 HydrophobicContact CG2-CD1 4.43Å; F525-I532 HydrophobicContact CD2-CB 4.33Å; F525-I532 HydrophobicContact CD2-CD1 3.88Å; F525-I532 HydrophobicContact CD2-CG2 4.2Å; F525-I532 HydrophobicContact CE2-CB 4.44Å; F525-I532 HydrophobicContact CE2-CG2 4.28Å; N528-I532 HydrophobicContact CB-CD1 4.13Å; N528-I532 PolarHBondContact O-N 3.27Å; S529-I532 PolarHBondContact O-N 2.85Å; I532-T535 PolarHBondContact O-N 2.99Å; I532-A536 WeakPolarHBondContact O-CB 3.45Å; I532-A536 PolarHBondContact O-N 2.82Å; I532-A536 VanDerWaalsContact O-N 3.08Å
533	I	82.4	Confident	75	Confident	19 Å²	19	69.6 Å²	69.6	10%	0.097	36%	0.362	C	S	.	.	H	α-helix	trans	-66.1	-44.4	179.4	-71	169.9	0	0	0	111.1	V513 F525 S529 T535 A536 V537 V572 V574	V513-I533 HydrophobicContact CG1-CD1 4.47Å; V513-I533 HydrophobicContact CG1-CG1 3.93Å; V513-I533 HydrophobicContact CG2-CG2 3.85Å; F525-I533 HydrophobicContact CE2-CD1 4.25Å; F525-I533 HydrophobicContact CE2-CG1 4.17Å; F525-I533 HydrophobicContact CZ-CD1 4.03Å; F525-I533 HydrophobicContact CZ-CG1 4.39Å; S529-I533 WeakPolarHBondContact O-CG1 3.43Å; S529-I533 PolarHBondContact O-N 3Å; I533-T535 VanDerWaalsContact C-N 3.33Å; I533-T535 PolarHBondContact O-N 3.21Å; I533-A536 WeakPolarHBondContact O-CB 3.41Å; I533-A536 PolarHBondContact O-N 3.39Å; I533-A536 VanDerWaalsContact O-N 3.17Å; I533-V537 HydrophobicContact CG2-CG2 4.44Å; I533-V537 WeakPolarHBondContact O-CG2 3.47Å; I533-V537 PolarHBondContact O-N 2.83Å; I533-V572 HydrophobicContact CG2-CG1 4.03Å; I533-V574 HydrophobicContact CB-CG2 3.68Å; I533-V574 HydrophobicContact CD1-CB 4.31Å; I533-V574 HydrophobicContact CD1-CG1 3.73Å; I533-V574 HydrophobicContact CD1-CG2 3.52Å; I533-V574 HydrophobicContact CG1-CG2 4.16Å; I533-V574 HydrophobicContact CG2-CG2 3.66Å
534	R	77.8	Confident	73.4	Confident	127 Å²	127	75.3 Å²	75.3	48%	0.479	39%	0.386	S	S	.	.	H	α-helix	trans	-59	-45.5	178.9	-171.5	178.1	-65.7	176.9	-2.2	111.5	A530 R531 A536 V537 F538	A530-R534 WeakPolarHBondContact O-CB 3.38Å; A530-R534 PolarHBondContact O-N 2.81Å; R531-R534 PolarHBondContact O-N 2.76Å; R534-A536 VanDerWaalsContact C-N 3.34Å; R534-A536 PolarHBondContact O-N 3.48Å; R534-V537 PolarHBondContact O-N 3.5Å; R534-F538 HydrophobicContact CG-CD2 3.86Å; R534-F538 HydrophobicContact CG-CE2 3.96Å; R534-F538 VanDerWaalsContact O-CD2 3.24Å; R534-F538 WeakPolarHBondContact O-CD2 3.39Å; R534-F538 PolarHBondContact O-N 3.1Å
535	T	78.1	Confident	71.5	Confident	34 Å²	34	76.3 Å²	76.3	21%	0.209	40%	0.403	C	S	.	.	H	α-helix	trans	-63.7	-39.1	177.1	-56.3	0	0	0	0	112.2	R531 I532 I533 V537 G539 F540	R531-T535 PolarHBondContact O-N 3.3Å; R531-T535 VanDerWaalsContact O-N 3.12Å; R531-T535 PolarHBondContact O-OG1 2.95Å; R531-T535 VanDerWaalsContact O-OG1 3.06Å; I532-T535 PolarHBondContact O-N 2.99Å; I533-T535 VanDerWaalsContact C-N 3.33Å; I533-T535 PolarHBondContact O-N 3.21Å; T535-V537 PolarHBondContact O-N 3.33Å; T535-G539 PolarHBondContact O-N 2.82Å; T535-F540 HydrophobicContact CG2-CD1 4.39Å; T535-F540 HydrophobicContact CG2-CE1 3.66Å; T535-F540 HydrophobicContact CG2-CE2 4.04Å; T535-F540 HydrophobicContact CG2-CZ 3.45Å; T535-F540 VanDerWaalsContact CG2-CZ 3.45Å
536	A	82	Confident	69.4	Low	20 Å²	20	85.3 Å²	85.3	17%	0.165	44%	0.442	C	S	.	.	H	α-helix	trans	-64.1	-39.9	179	0	0	0	0	0	112.8	R512 A516 I532 I533 R534	R512-A536 WeakPolarHBondContact CB-O 3.25Å; A516-A536 HydrophobicContact CB-CB 3.4Å; A516-A536 VanDerWaalsContact CB-CB 3.4Å; I532-A536 WeakPolarHBondContact O-CB 3.45Å; I532-A536 PolarHBondContact O-N 2.82Å; I532-A536 VanDerWaalsContact O-N 3.08Å; I533-A536 WeakPolarHBondContact O-CB 3.41Å; I533-A536 PolarHBondContact O-N 3.39Å; I533-A536 VanDerWaalsContact O-N 3.17Å; R534-A536 VanDerWaalsContact C-N 3.34Å; R534-A536 PolarHBondContact O-N 3.48Å
537	V	80.4	Confident	67.9	Low	1 Å²	1	82.9 Å²	82.9	1%	0.006	45%	0.445	C	S	.	.	H	α-helix	trans	-74.7	-40.9	-175.6	178.4	0	0	0	0	112.2	I509 R512 V513 I533 R534 T535 V572	I509-V537 HydrophobicContact CD1-CG1 4.47Å; I509-V537 HydrophobicContact CG1-CG1 3.97Å; I509-V537 HydrophobicContact CG2-CG1 4.41Å; I509-V537 HydrophobicContact CG2-CG2 3.77Å; R512-V537 PolarHBondContact NH1-O 3.35Å; V513-V537 HydrophobicContact CG2-CG2 3.63Å; I533-V537 HydrophobicContact CG2-CG2 4.44Å; I533-V537 WeakPolarHBondContact O-CG2 3.47Å; I533-V537 PolarHBondContact O-N 2.83Å; R534-V537 PolarHBondContact O-N 3.5Å; T535-V537 PolarHBondContact O-N 3.33Å; V537-V572 HydrophobicContact CB-CG2 4.1Å; V537-V572 HydrophobicContact CG1-CG2 3.76Å; V537-V572 HydrophobicContact CG2-CG2 4.23Å
538	F	79.2	Confident	66.3	Low	15 Å²	15	82.8 Å²	82.8	7%	0.066	46%	0.459	C	S	.	.	H	α-helix	trans	-95.7	-22.9	-173.1	-59.8	-62.7	0	0	0	114.8	R534 R557 A560 V569 V572	R534-F538 HydrophobicContact CG-CD2 3.86Å; R534-F538 HydrophobicContact CG-CE2 3.96Å; R534-F538 VanDerWaalsContact O-CD2 3.24Å; R534-F538 WeakPolarHBondContact O-CD2 3.39Å; R534-F538 PolarHBondContact O-N 3.1Å; F538-R557 HydrophobicContact CB-CB 4.26Å; F538-R557 WeakPolarHBondContact CB-O 3.41Å; F538-R557 WeakPolarHBondContact CG-O 3.43Å; F538-A560 HydrophobicContact CD1-CB 4.06Å; F538-A560 HydrophobicContact CE1-CB 4.23Å; F538-V569 HydrophobicContact CE1-CG1 4.22Å; F538-V569 WeakPolarHBondContact CE1-O 3.44Å; F538-V569 HydrophobicContact CZ-CG1 4.34Å; F538-V572 HydrophobicContact CE2-CB 4.25Å; F538-V572 HydrophobicContact CE2-CG2 3.95Å; F538-V572 HydrophobicContact CZ-CB 4.39Å; F538-V572 HydrophobicContact CZ-CG2 3.71Å
539	G	72.2	Confident	64.7	Low	30 Å²	30	86.8 Å²	86.8	31%	0.309	48%	0.481	S	S	.	.			trans	75	176.5	-176.2	0	0	0	0	0	113.6	T535 P556 R557	T535-G539 PolarHBondContact O-N 2.82Å; G539-P556 CarbonylContact O-C 3.6Å; G539-P556 WeakPolarHBondContact O-CA 3.39Å; G539-R557 PolarHBondContact O-N 2.97Å
540	F	65.8	Low	63.2	Low	116 Å²	116	90 Å²	90	51%	0.509	52%	0.517	S	S	.	.	B	Isolated β-bridge	trans	-94	152.3	178.6	-63.8	-75.4	0	0	0	112.9	T535 R555	T535-F540 HydrophobicContact CG2-CD1 4.39Å; T535-F540 HydrophobicContact CG2-CE1 3.66Å; T535-F540 HydrophobicContact CG2-CE2 4.04Å; T535-F540 HydrophobicContact CG2-CZ 3.45Å; T535-F540 VanDerWaalsContact CG2-CZ 3.45Å; F540-R555 CarbonylContact C-O 3.55Å; F540-R555 WeakPolarHBondContact CA-O 3.32Å
541	E	58.1	Low	61.4	Low	109 Å²	109	96 Å²	96	51%	0.509	54%	0.538	S	S	.	.			trans	-76.7	126.9	161.1	-77.2	-172.6	145.7	0	0	110.8	S543 R555 R557	E541-S543 PolarHBondContact O-N 3.41Å; E541-R555 PolarHBondContact N-O 2.86Å; E541-R557 HydrophobicContact CG-CG 4.05Å
542	T	49.9	Very low	59.6	Low	142 Å²	142	92.9 Å²	92.9	87%	0.871	55%	0.548	S	S	*	.			trans	-79.5	96.6	166.3	41.2	0	0	0	0	109.2
543	S	45.9	Very low	57.9	Low	96 Å²	96	100 Å²	100	67%	0.671	59%	0.586	S	S	*	*			trans	-124.8	113.5	170.4	174.1	0	0	0	0	109.9	E541 A545	E541-S543 PolarHBondContact O-N 3.41Å; S543-A545 VanDerWaalsContact C-N 3.33Å; S543-A545 PolarHBondContact O-N 2.97Å; S543-A545 VanDerWaalsContact O-N 3.1Å
544	E	45.1	Very low	56.4	Low	209 Å²	209	102.6 Å²	102.6	98%	0.977	61%	0.606	S	S	*	*			trans	-79.1	61.3	-179.1	-67.1	-174	143.6	0	0	113.1
545	A	39.6	Very low	55.3	Low	86 Å²	86	105.9 Å²	105.9	71%	0.711	62%	0.618	S	S	*	*			trans	-104.6	108.1	175.7	0	0	0	0	0	112.2	S543	S543-A545 VanDerWaalsContact C-N 3.33Å; S543-A545 PolarHBondContact O-N 2.97Å; S543-A545 VanDerWaalsContact O-N 3.1Å
546	K	39.4	Very low	54.4	Low	216 Å²	216	106.6 Å²	106.6	94%	0.939	62%	0.623	S	S	*	*			trans	-76.6	124.1	173.5	-76.2	177.8	176.3	175.1	0	111.3
547	G	48.4	Very low	53.7	Low	53 Å²	53	112.4 Å²	112.4	55%	0.546	64%	0.641	S	S	.	*			trans	-108.4	167.3	166.9	0	0	0	0	0	112.5	D549	G547-D549 VanDerWaalsContact C-N 3.34Å; G547-D549 PolarHBondContact O-N 3.2Å
548	P	46.3	Very low	53	Low	139 Å²	139	119.1 Å²	119.1	90%	0.903	68%	0.677	S	S	*	*	S	Bend	trans	-71.2	-18.6	-159.3	-16.1	30	0	0	0	116.2
549	D	47.9	Very low	52.8	Low	147 Å²	147	123.9 Å²	123.9	79%	0.786	70%	0.699	S	S	*	*	S	Bend	trans	-114.3	117.2	175.3	-67.4	-36.8	0	0	0	107.7	G547 M551	G547-D549 VanDerWaalsContact C-N 3.34Å; G547-D549 PolarHBondContact O-N 3.2Å; D549-M551 VanDerWaalsContact C-N 3.25Å; D549-M551 PolarHBondContact O-N 3.44Å
550	G	49.5	Very low	53	Low	91 Å²	91	123 Å²	123	94%	0.938	69%	0.689	S	S	*	*	S	Bend	trans	-64.8	60.5	-165.6	0	0	0	0	0	117.5
551	M	41.9	Very low	53.6	Low	177 Å²	177	121.6 Å²	121.6	87%	0.872	69%	0.69	S	S	*	*			trans	-125.5	120.2	164.3	-76.7	-169.6	177.8	0	0	110.3	D549	D549-M551 VanDerWaalsContact C-N 3.25Å; D549-M551 PolarHBondContact O-N 3.44Å
552	A	41.3	Very low	54.6	Low	100 Å²	100	117.9 Å²	117.9	83%	0.826	67%	0.672	S	S	*	*			trans	-83.7	133.7	174.8	0	0	0	0	0	111
553	L	45.5	Very low	55.7	Low	173 Å²	173	116.7 Å²	116.7	91%	0.906	67%	0.666	S	S	*	*			trans	-116	108.5	170.5	-97.1	134.7	0	0	0	109.4
554	S	49.9	Very low	57.1	Low	74 Å²	74	118.1 Å²	118.1	52%	0.517	66%	0.663	S	S	.	*	P	Polyproline II helix	trans	-84.7	134.1	175.9	-52.4	0	0	0	0	111.3
555	R	55.8	Low	58.6	Low	195 Å²	195	109 Å²	109	74%	0.736	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-92.1	144.2	175.4	-73.7	-175.2	178.8	-178.3	0.1	111.8	F540 E541	F540-R555 CarbonylContact C-O 3.55Å; F540-R555 WeakPolarHBondContact CA-O 3.32Å; E541-R555 PolarHBondContact N-O 2.86Å
556	P	59.3	Low	60.2	Low	50 Å²	50	107.3 Å²	107.3	33%	0.325	61%	0.612	S	S	.	*	B	Isolated β-bridge	trans	-70.7	153	173.8	-15.5	30.2	0	0	0	113.1	G539	G539-P556 CarbonylContact O-C 3.6Å; G539-P556 WeakPolarHBondContact O-CA 3.39Å
557	R	65.3	Low	62	Low	142 Å²	142	99.2 Å²	99.2	54%	0.536	58%	0.579	S	S	.	*	P	Polyproline II helix	trans	-71.5	156.8	168.3	-69.4	-178.2	174.2	176.8	-1	111.3	F538 G539 E541	F538-R557 HydrophobicContact CB-CB 4.26Å; F538-R557 WeakPolarHBondContact CB-O 3.41Å; F538-R557 WeakPolarHBondContact CG-O 3.43Å; G539-R557 PolarHBondContact O-N 2.97Å; E541-R557 HydrophobicContact CG-CG 4.05Å
558	D	66.8	Low	63.5	Low	141 Å²	141	100 Å²	100	75%	0.754	57%	0.572	S	S	*	*	S	Bend	trans	-91.5	-19.4	-176	-65.7	-24.5	0	0	0	114.7
559	Q	75.6	Confident	65.1	Low	115 Å²	115	94.5 Å²	94.5	54%	0.537	54%	0.536	S	S	.	.			trans	-149.7	154.7	-176.7	63.6	-178.2	9.5	0	0	113.9	V568 V569	Q559-V568 HydrophobicContact CB-CG1 4.27Å; Q559-V569 CarbonylContact C-O 3.49Å; Q559-V569 WeakPolarHBondContact CA-O 3.33Å
560	A	75.4	Confident	66.4	Low	11 Å²	11	91.5 Å²	91.5	9%	0.091	53%	0.527	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	128.6	174.3	0	0	0	0	0	110.8	F538 V569	F538-A560 HydrophobicContact CD1-CB 4.06Å; F538-A560 HydrophobicContact CE1-CB 4.23Å; A560-V569 HydrophobicContact CB-CB 4.38Å; A560-V569 PolarHBondContact N-O 3.36Å; A560-V569 PolarHBondContact O-N 2.8Å
561	V	78.1	Confident	67.8	Low	88 Å²	88	90.4 Å²	90.4	53%	0.533	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	132.7	-175.8	-177.2	0	0	0	0	110.9	V568	V561-V568 HydrophobicContact CG1-CG2 4.33Å; V561-V568 HydrophobicContact CG2-CG1 4.29Å; V561-V568 HydrophobicContact CG2-CG2 4.2Å
562	F	78.7	Confident	69.6	Low	30 Å²	30	83.2 Å²	83.2	13%	0.132	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	107.6	171.8	-66.5	-92.5	0	0	0	109.7	A505 A508 Q564 N565 G566 L567 V569	A505-F562 HydrophobicContact CB-CE2 3.97Å; A505-F562 HydrophobicContact CB-CZ 3.94Å; A508-F562 HydrophobicContact CB-CE1 3.78Å; A508-F562 HydrophobicContact CB-CZ 4.02Å; F562-Q564 VanDerWaalsContact C-N 3.26Å; F562-Q564 PolarHBondContact O-N 3.04Å; F562-N565 PolarHBondContact O-OD1 3.01Å; F562-G566 WeakPolarHBondContact O-CA 3.18Å; F562-G566 PolarHBondContact O-N 3.17Å; F562-G566 VanDerWaalsContact O-N 3.08Å; F562-L567 HydrophobicContact CB-CB 4.14Å; F562-L567 HydrophobicContact CD2-CB 4.33Å; F562-L567 HydrophobicContact CD2-CD2 3.99Å; F562-L567 HydrophobicContact CD2-CG 4.27Å; F562-L567 HydrophobicContact CE2-CD2 4.39Å; F562-L567 PolarHBondContact N-O 2.78Å; F562-L567 PolarHBondContact O-N 2.69Å; F562-V569 HydrophobicContact CD2-CG2 4.45Å; F562-V569 HydrophobicContact CE2-CG2 3.85Å
563	P	74.6	Confident	71.4	Confident	117 Å²	117	83.9 Å²	83.9	76%	0.76	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-11.9	-169.9	28.2	-35.2	0	0	0	114.5
564	Q	74	Confident	73	Confident	127 Å²	127	77.7 Å²	77.7	59%	0.593	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-33.3	-172.6	-62.9	172.7	10.8	0	0	113.4	V498 F562	V498-Q564 HydrophobicContact CG2-CB 4.01Å; F562-Q564 VanDerWaalsContact C-N 3.26Å; F562-Q564 PolarHBondContact O-N 3.04Å
565	N	76.2	Confident	74.4	Confident	16 Å²	16	83.1 Å²	83.1	9%	0.086	45%	0.447	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.2	1.3	179.7	57.1	0.3	0	0	0	112.7	V498 F501 F562 L567	V498-N565 HydrophobicContact CB-CB 4.18Å; V498-N565 HydrophobicContact CG2-CB 3.81Å; F501-N565 WeakPolarHBondContact CB-ND2 3.38Å; F562-N565 PolarHBondContact O-OD1 3.01Å; N565-L567 VanDerWaalsContact C-N 3.27Å; N565-L567 PolarHBondContact O-N 3.26Å; N565-L567 VanDerWaalsContact OD1-CB 3.28Å; N565-L567 WeakPolarHBondContact OD1-CB 3.27Å; N565-L567 PolarHBondContact OD1-N 3.19Å; N565-L567 VanDerWaalsContact OD1-N 3.09Å
566	G	73.6	Confident	75.5	Confident	52 Å²	52	78.3 Å²	78.3	54%	0.536	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.1	14.2	-177.6	0	0	0	0	0	114.4	F562 V568	F562-G566 WeakPolarHBondContact O-CA 3.18Å; F562-G566 PolarHBondContact O-N 3.17Å; F562-G566 VanDerWaalsContact O-N 3.08Å; G566-V568 PolarHBondContact O-N 2.96Å
567	L	78.4	Confident	76.5	Confident	45 Å²	45	78.7 Å²	78.7	24%	0.236	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	129.5	179.7	179.2	74	0	0	0	110.7	F501 A505 F562 N565	F501-L567 HydrophobicContact CD2-CD1 4.02Å; F501-L567 HydrophobicContact CD2-CD2 4.15Å; F501-L567 HydrophobicContact CE2-CD1 4.25Å; A505-L567 HydrophobicContact CB-CD2 3.52Å; F562-L567 HydrophobicContact CB-CB 4.14Å; F562-L567 HydrophobicContact CD2-CB 4.33Å; F562-L567 HydrophobicContact CD2-CD2 3.99Å; F562-L567 HydrophobicContact CD2-CG 4.27Å; F562-L567 HydrophobicContact CE2-CD2 4.39Å; F562-L567 PolarHBondContact N-O 2.78Å; F562-L567 PolarHBondContact O-N 2.69Å; N565-L567 VanDerWaalsContact C-N 3.27Å; N565-L567 PolarHBondContact O-N 3.26Å; N565-L567 VanDerWaalsContact OD1-CB 3.28Å; N565-L567 WeakPolarHBondContact OD1-CB 3.27Å; N565-L567 PolarHBondContact OD1-N 3.19Å; N565-L567 VanDerWaalsContact OD1-N 3.09Å
568	V	79.1	Confident	77.2	Confident	69 Å²	69	78.5 Å²	78.5	42%	0.418	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	124.4	176.4	-176.1	0	0	0	0	109.2	Q559 V561 G566	Q559-V568 HydrophobicContact CB-CG1 4.27Å; V561-V568 HydrophobicContact CG1-CG2 4.33Å; V561-V568 HydrophobicContact CG2-CG1 4.29Å; V561-V568 HydrophobicContact CG2-CG2 4.2Å; G566-V568 PolarHBondContact O-N 2.96Å
569	V	79.3	Confident	77.8	Confident	24 Å²	24	73.1 Å²	73.1	15%	0.145	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	109.1	171	179.7	0	0	0	0	107.3	I509 F538 Q559 A560 F562 V572	I509-V569 HydrophobicContact CD1-CG1 4.4Å; I509-V569 HydrophobicContact CD1-CG2 4.31Å; F538-V569 HydrophobicContact CE1-CG1 4.22Å; F538-V569 WeakPolarHBondContact CE1-O 3.44Å; F538-V569 HydrophobicContact CZ-CG1 4.34Å; Q559-V569 CarbonylContact C-O 3.49Å; Q559-V569 WeakPolarHBondContact CA-O 3.33Å; A560-V569 HydrophobicContact CB-CB 4.38Å; A560-V569 PolarHBondContact N-O 3.36Å; A560-V569 PolarHBondContact O-N 2.8Å; F562-V569 HydrophobicContact CD2-CG2 4.45Å; F562-V569 HydrophobicContact CE2-CG2 3.85Å; V569-V572 HydrophobicContact CG1-CG2 4.14Å
570	S	76.9	Confident	78.1	Confident	84 Å²	84	74.3 Å²	74.3	59%	0.587	44%	0.438	S	S	*	.			trans	-89.6	-27	-176.2	51.8	0	0	0	0	113.8
571	S	77.9	Confident	78.4	Confident	69 Å²	69	77.9 Å²	77.9	48%	0.483	46%	0.455	S	S	.	.			trans	-152.5	159.2	177.1	63.5	0	0	0	0	110.8
572	V	80	Confident	78.3	Confident	26 Å²	26	78.3 Å²	78.3	16%	0.158	45%	0.451	C	S	.	.			trans	-129.3	120.5	171.8	177.3	0	0	0	0	108.3	I533 V537 F538 V569	I533-V572 HydrophobicContact CG2-CG1 4.03Å; V537-V572 HydrophobicContact CB-CG2 4.1Å; V537-V572 HydrophobicContact CG1-CG2 3.76Å; V537-V572 HydrophobicContact CG2-CG2 4.23Å; F538-V572 HydrophobicContact CE2-CB 4.25Å; F538-V572 HydrophobicContact CE2-CG2 3.95Å; F538-V572 HydrophobicContact CZ-CB 4.39Å; F538-V572 HydrophobicContact CZ-CG2 3.71Å; V569-V572 HydrophobicContact CG1-CG2 4.14Å
573	D	78.9	Confident	78.4	Confident	113 Å²	113	86.2 Å²	86.2	60%	0.604	48%	0.48	S	S	*	.			trans	-106.5	121.9	176.9	-66.2	-31.6	0	0	0	109.9	Q575	D573-Q575 PolarHBondContact O-N 3.21Å
574	V	79.2	Confident	78.4	Confident	43 Å²	43	83.3 Å²	83.3	26%	0.261	46%	0.46	S	S	.	.			trans	-85.9	99.6	177.7	-176.8	0	0	0	0	108.1	I533 V577	I533-V574 HydrophobicContact CB-CG2 3.68Å; I533-V574 HydrophobicContact CD1-CB 4.31Å; I533-V574 HydrophobicContact CD1-CG1 3.73Å; I533-V574 HydrophobicContact CD1-CG2 3.52Å; I533-V574 HydrophobicContact CG1-CG2 4.16Å; I533-V574 HydrophobicContact CG2-CG2 3.66Å; V574-V577 HydrophobicContact CG1-CG2 3.51Å
575	Q	78.6	Confident	78.5	Confident	189 Å²	189	81 Å²	81	88%	0.883	45%	0.446	S	S	*	.			trans	-77.6	-42.3	-176.7	-63.9	-175.8	-3.9	0	0	112.5	D573	D573-Q575 PolarHBondContact O-N 3.21Å
576	S	79.4	Confident	78.7	Confident	94 Å²	94	82.8 Å²	82.8	66%	0.657	46%	0.456	S	S	*	.			trans	-148.2	149.5	-178.7	63.7	0	0	0	0	111.8
577	V	80.4	Confident	78.9	Confident	57 Å²	57	82.6 Å²	82.6	35%	0.345	45%	0.449	S	S	.	.			trans	-138.6	116.4	175.2	-179.4	0	0	0	0	107.9	F525 V574	F525-V577 HydrophobicContact CD1-CG1 4.24Å; F525-V577 HydrophobicContact CE1-CG1 3.48Å; F525-V577 VanDerWaalsContact CE1-CG1 3.48Å; F525-V577 HydrophobicContact CZ-CG1 4.17Å; V574-V577 HydrophobicContact CG1-CG2 3.51Å
578	E	79.8	Confident	78.8	Confident	138 Å²	138	83.1 Å²	83.1	65%	0.645	45%	0.452	S	S	*	.			trans	-126.2	143.3	-177	-65.9	-171.2	178.1	0	0	112.1
579	P	80.2	Confident	78.6	Confident	29 Å²	29	84.6 Å²	84.6	19%	0.188	45%	0.454	C	S	.	.			trans	-65	134.7	169.8	-17	29.5	0	0	0	111.4	F522 T584 R585 L588	F522-P579 HydrophobicContact CE2-CG 4.3Å; F522-P579 HydrophobicContact CZ-CG 4.18Å; P579-T584 HydrophobicContact CB-CG2 4.15Å; P579-R585 PolarHBondContact O-NE 2.88Å; P579-R585 PolarHBondContact O-NH2 3.06Å; P579-L588 HydrophobicContact CG-CD1 3.57Å
580	V	81.6	Confident	78.5	Confident	140 Å²	140	90 Å²	90	85%	0.848	47%	0.472	S	S	*	.	S	Bend	trans	-77.1	-39.1	176.9	-178.4	0	0	0	0	111.5	Q582	V580-Q582 PolarHBondContact O-N 2.82Å
581	D	81	Confident	78.5	Confident	86 Å²	86	89.9 Å²	89.9	46%	0.46	47%	0.471	S	S	.	.	S	Bend	trans	-74.6	121.6	179	175.7	37.7	0	0	0	111.1	R583 T584 R585	D581-R583 VanDerWaalsContact C-N 3.25Å; D581-R583 PolarHBondContact O-N 2.86Å; D581-R583 PolarHBondContact OD1-N 3.04Å; D581-R583 WeakPolarHBondContact OD2-CB 3.36Å; D581-T584 WeakPolarHBondContact O-CB 3.33Å; D581-T584 PolarHBondContact O-N 2.89Å; D581-T584 VanDerWaalsContact O-N 3.12Å; D581-T584 PolarHBondContact OD2-N 3.09Å; D581-T584 PolarHBondContact OD2-OG1 2.8Å; D581-R585 PolarHBondContact O-N 3.1Å
582	Q	76.4	Confident	78.4	Confident	97 Å²	97	90.2 Å²	90.2	45%	0.453	47%	0.47	S	S	.	.	H	α-helix	trans	-59	-37.9	-178.8	-167.6	64.3	33	0	0	111.3	V580 T584 R585 D586	V580-Q582 PolarHBondContact O-N 2.82Å; Q582-T584 VanDerWaalsContact C-N 3.3Å; Q582-T584 PolarHBondContact O-N 3.23Å; Q582-R585 WeakPolarHBondContact O-CB 3.33Å; Q582-R585 PolarHBondContact O-N 3.42Å; Q582-D586 PolarHBondContact NE2-OD1 2.81Å; Q582-D586 VanDerWaalsContact NE2-OD1 3.12Å; Q582-D586 WeakPolarHBondContact O-CB 3.48Å; Q582-D586 PolarHBondContact O-N 2.92Å
583	R	80	Confident	78.1	Confident	195 Å²	195	94.3 Å²	94.3	74%	0.736	49%	0.488	S	S	*	.	H	α-helix	trans	-65.7	-35	179.9	-170.9	179.8	-179.8	179.3	0.6	112.3	D581 A587	D581-R583 VanDerWaalsContact C-N 3.25Å; D581-R583 PolarHBondContact O-N 2.86Å; D581-R583 PolarHBondContact OD1-N 3.04Å; D581-R583 WeakPolarHBondContact OD2-CB 3.36Å; R583-A587 WeakPolarHBondContact O-CB 3.37Å; R583-A587 PolarHBondContact O-N 2.96Å
584	T	76.1	Confident	77.8	Confident	56 Å²	56	94 Å²	94	34%	0.344	49%	0.485	S	S	.	.	H	α-helix	trans	-72.8	-41.5	176.8	-56	0	0	0	0	110.4	P579 D581 Q582 A587 L588	P579-T584 HydrophobicContact CB-CG2 4.15Å; D581-T584 WeakPolarHBondContact O-CB 3.33Å; D581-T584 PolarHBondContact O-N 2.89Å; D581-T584 VanDerWaalsContact O-N 3.12Å; D581-T584 PolarHBondContact OD2-N 3.09Å; D581-T584 PolarHBondContact OD2-OG1 2.8Å; Q582-T584 VanDerWaalsContact C-N 3.3Å; Q582-T584 PolarHBondContact O-N 3.23Å; T584-A587 PolarHBondContact O-N 2.85Å; T584-L588 HydrophobicContact CG2-CD1 4.09Å; T584-L588 WeakPolarHBondContact O-CD1 3.37Å; T584-L588 PolarHBondContact O-N 3.09Å
585	R	76.4	Confident	77.5	Confident	78 Å²	78	94.6 Å²	94.6	29%	0.294	50%	0.495	S	S	.	.	H	α-helix	trans	-59.1	-47.4	170.9	-170	-177.8	-60.5	169.5	-3.1	111.3	P579 D581 Q582 A587 L588 Q589	P579-R585 PolarHBondContact O-NE 2.88Å; P579-R585 PolarHBondContact O-NH2 3.06Å; D581-R585 PolarHBondContact O-N 3.1Å; Q582-R585 WeakPolarHBondContact O-CB 3.33Å; Q582-R585 PolarHBondContact O-N 3.42Å; R585-A587 VanDerWaalsContact C-N 3.26Å; R585-A587 PolarHBondContact O-N 2.82Å; R585-L588 CarbonylContact O-C 3.52Å; R585-L588 PolarHBondContact O-N 3.14Å; R585-Q589 WeakPolarHBondContact O-CA 3.3Å; R585-Q589 WeakPolarHBondContact O-CB 3.3Å; R585-Q589 PolarHBondContact O-N 3.44Å
586	D	78.9	Confident	76.9	Confident	54 Å²	54	89.8 Å²	89.8	29%	0.289	48%	0.475	S	S	.	.	H	α-helix	trans	-64.2	-31.7	178.4	-60.9	-21.7	0	0	0	111.8	Q582 R590	Q582-D586 PolarHBondContact NE2-OD1 2.81Å; Q582-D586 VanDerWaalsContact NE2-OD1 3.12Å; Q582-D586 WeakPolarHBondContact O-CB 3.48Å; Q582-D586 PolarHBondContact O-N 2.92Å; D586-R590 VanDerWaalsContact O-CB 3.29Å; D586-R590 WeakPolarHBondContact O-CB 3.33Å; D586-R590 VanDerWaalsContact O-CG 3.22Å; D586-R590 WeakPolarHBondContact O-CG 3.33Å; D586-R590 PolarHBondContact O-N 2.87Å; D586-R590 PolarHBondContact O-NE 3.49Å
587	A	77.9	Confident	76.5	Confident	48 Å²	48	89.9 Å²	89.9	40%	0.397	47%	0.465	S	S	.	.	H	α-helix	trans	-70.3	-45.5	175.2	0	0	0	0	0	112	R583 T584 R585 Q589 R590 S591	R583-A587 WeakPolarHBondContact O-CB 3.37Å; R583-A587 PolarHBondContact O-N 2.96Å; T584-A587 PolarHBondContact O-N 2.85Å; R585-A587 VanDerWaalsContact C-N 3.26Å; R585-A587 PolarHBondContact O-N 2.82Å; A587-Q589 VanDerWaalsContact C-N 3.33Å; A587-R590 PolarHBondContact O-N 3.26Å; A587-S591 PolarHBondContact O-N 2.96Å
588	L	76.3	Confident	75.9	Confident	56 Å²	56	93.1 Å²	93.1	29%	0.293	48%	0.479	S	S	.	.	H	α-helix	trans	-64.4	-39.8	172.6	-78.1	149.9	0	0	0	111.3	F522 P579 T584 R585 S591 V592	F522-L588 HydrophobicContact CE1-CD1 3.98Å; F522-L588 HydrophobicContact CE1-CD2 4.49Å; F522-L588 HydrophobicContact CZ-CD1 3.62Å; P579-L588 HydrophobicContact CG-CD1 3.57Å; T584-L588 HydrophobicContact CG2-CD1 4.09Å; T584-L588 WeakPolarHBondContact O-CD1 3.37Å; T584-L588 PolarHBondContact O-N 3.09Å; R585-L588 CarbonylContact O-C 3.52Å; R585-L588 PolarHBondContact O-N 3.14Å; L588-S591 CarbonylContact O-C 3.55Å; L588-S591 WeakPolarHBondContact O-CB 3.48Å; L588-S591 PolarHBondContact O-N 2.79Å; L588-V592 WeakPolarHBondContact O-CG2 3.32Å; L588-V592 PolarHBondContact O-N 3.49Å
589	Q	74.6	Confident	75.5	Confident	101 Å²	101	90.5 Å²	90.5	47%	0.472	47%	0.472	S	S	.	.	H	α-helix	trans	-70.8	-35.9	179.1	-171.4	159.6	-8	0	0	111.3	R585 A587 S591 V592 Q593	R585-Q589 WeakPolarHBondContact O-CA 3.3Å; R585-Q589 WeakPolarHBondContact O-CB 3.3Å; R585-Q589 PolarHBondContact O-N 3.44Å; A587-Q589 VanDerWaalsContact C-N 3.33Å; Q589-S591 VanDerWaalsContact C-N 3.32Å; Q589-V592 PolarHBondContact O-N 2.82Å; Q589-Q593 WeakPolarHBondContact O-CA 3.38Å; Q589-Q593 WeakPolarHBondContact O-CB 3.22Å; Q589-Q593 PolarHBondContact O-N 2.79Å
590	R	78.4	Confident	75.1	Confident	136 Å²	136	92.1 Å²	92.1	51%	0.513	48%	0.482	S	S	.	.	H	α-helix	trans	-62.2	-40.9	167.8	-80.3	-176.6	-65	-93.1	-2.7	111.4	D586 A587 Q593 L594	D586-R590 VanDerWaalsContact O-CB 3.29Å; D586-R590 WeakPolarHBondContact O-CB 3.33Å; D586-R590 VanDerWaalsContact O-CG 3.22Å; D586-R590 WeakPolarHBondContact O-CG 3.33Å; D586-R590 PolarHBondContact O-N 2.87Å; D586-R590 PolarHBondContact O-NE 3.49Å; A587-R590 PolarHBondContact O-N 3.26Å; R590-Q593 PolarHBondContact O-N 2.95Å; R590-L594 WeakPolarHBondContact O-CB 3.38Å; R590-L594 WeakPolarHBondContact O-CD1 3.16Å; R590-L594 WeakPolarHBondContact O-CG 3.41Å; R590-L594 PolarHBondContact O-N 2.9Å
591	S	76.6	Confident	74.7	Confident	82 Å²	82	89.7 Å²	89.7	57%	0.573	46%	0.464	S	S	*	.	H	α-helix	trans	-63.7	-43.5	176.4	-168.9	0	0	0	0	112.1	A587 L588 Q589 A595	A587-S591 PolarHBondContact O-N 2.96Å; L588-S591 CarbonylContact O-C 3.55Å; L588-S591 WeakPolarHBondContact O-CB 3.48Å; L588-S591 PolarHBondContact O-N 2.79Å; Q589-S591 VanDerWaalsContact C-N 3.32Å; S591-A595 PolarHBondContact O-N 2.72Å
592	V	75	Confident	74.3	Confident	76 Å²	76	89.7 Å²	89.7	46%	0.461	47%	0.47	S	S	.	.	H	α-helix	trans	-73.2	-38.2	177.4	170.9	0	0	0	0	111.2	L588 Q589 A595 I596	L588-V592 WeakPolarHBondContact O-CG2 3.32Å; L588-V592 PolarHBondContact O-N 3.49Å; Q589-V592 PolarHBondContact O-N 2.82Å; V592-A595 CarbonylContact O-C 3.54Å; V592-A595 WeakPolarHBondContact O-CB 3.43Å; V592-A595 PolarHBondContact O-N 2.83Å; V592-A595 VanDerWaalsContact O-N 3.13Å; V592-I596 HydrophobicContact CG1-CD1 3.47Å; V592-I596 VanDerWaalsContact CG1-CD1 3.47Å; V592-I596 HydrophobicContact CG1-CG1 4.04Å; V592-I596 WeakPolarHBondContact O-CB 3.39Å; V592-I596 VanDerWaalsContact O-CG1 3.28Å; V592-I596 WeakPolarHBondContact O-CG1 3.41Å; V592-I596 PolarHBondContact O-N 2.84Å
593	Q	74.6	Confident	74	Confident	112 Å²	112	92.1 Å²	92.1	52%	0.523	48%	0.482	S	S	.	.	H	α-helix	trans	-67.5	-37.9	178.3	-176.8	155.6	3.9	0	0	111	Q589 R590 A595 I596 E597	Q589-Q593 WeakPolarHBondContact O-CA 3.38Å; Q589-Q593 WeakPolarHBondContact O-CB 3.22Å; Q589-Q593 PolarHBondContact O-N 2.79Å; R590-Q593 PolarHBondContact O-N 2.95Å; Q593-A595 VanDerWaalsContact C-N 3.33Å; Q593-I596 PolarHBondContact O-N 3.5Å; Q593-E597 WeakPolarHBondContact O-CA 3.23Å; Q593-E597 WeakPolarHBondContact O-CB 3.41Å; Q593-E597 PolarHBondContact O-N 3.36Å
594	L	72.8	Confident	73.6	Confident	106 Å²	106	87.9 Å²	87.9	56%	0.555	47%	0.471	S	S	*	.	H	α-helix	trans	-62.5	-42.6	169.4	-73.5	167.3	0	0	0	111.1	R590 I598	R590-L594 WeakPolarHBondContact O-CB 3.38Å; R590-L594 WeakPolarHBondContact O-CD1 3.16Å; R590-L594 WeakPolarHBondContact O-CG 3.41Å; R590-L594 PolarHBondContact O-N 2.9Å; L594-I598 WeakPolarHBondContact O-CB 3.42Å; L594-I598 VanDerWaalsContact O-CD1 3.24Å; L594-I598 WeakPolarHBondContact O-CD1 3.5Å; L594-I598 WeakPolarHBondContact O-CG1 3.47Å; L594-I598 PolarHBondContact O-N 2.82Å; L594-I598 VanDerWaalsContact O-N 3.15Å
595	A	72.1	Confident	73.2	Confident	57 Å²	57	87.8 Å²	87.8	47%	0.471	48%	0.476	S	S	.	.	H	α-helix	trans	-67	-37.3	177.7	0	0	0	0	0	113.1	S591 V592 Q593 T599	S591-A595 PolarHBondContact O-N 2.72Å; V592-A595 CarbonylContact O-C 3.54Å; V592-A595 WeakPolarHBondContact O-CB 3.43Å; V592-A595 PolarHBondContact O-N 2.83Å; V592-A595 VanDerWaalsContact O-N 3.13Å; Q593-A595 VanDerWaalsContact C-N 3.33Å; A595-T599 WeakPolarHBondContact O-CG2 3.24Å; A595-T599 PolarHBondContact O-N 3.35Å; A595-T599 PolarHBondContact O-OG1 3.5Å
596	I	66.6	Low	72.9	Confident	88 Å²	88	87.1 Å²	87.1	45%	0.451	49%	0.487	S	S	.	.	H	α-helix	trans	-76.6	-43.3	177.6	-68.5	174.8	0	0	0	110.4	V592 Q593 I598 T599 T600	V592-I596 HydrophobicContact CG1-CD1 3.47Å; V592-I596 VanDerWaalsContact CG1-CD1 3.47Å; V592-I596 HydrophobicContact CG1-CG1 4.04Å; V592-I596 WeakPolarHBondContact O-CB 3.39Å; V592-I596 VanDerWaalsContact O-CG1 3.28Å; V592-I596 WeakPolarHBondContact O-CG1 3.41Å; V592-I596 PolarHBondContact O-N 2.84Å; Q593-I596 PolarHBondContact O-N 3.5Å; I596-I598 PolarHBondContact O-N 3.32Å; I596-T599 WeakPolarHBondContact CA-OG1 3.35Å; I596-T599 CarbonylContact O-C 3.59Å; I596-T599 WeakPolarHBondContact O-CA 3.43Å; I596-T599 PolarHBondContact O-N 2.89Å; I596-T599 PolarHBondContact O-OG1 3.49Å; I596-T600 VanDerWaalsContact CG2-OG1 3.26Å; I596-T600 WeakPolarHBondContact CG2-OG1 3.3Å; I596-T600 VanDerWaalsContact O-CB 3.28Å; I596-T600 WeakPolarHBondContact O-CB 3.42Å; I596-T600 PolarHBondContact O-N 2.9Å; I596-T600 PolarHBondContact O-OG1 3.29Å
597	E	71.8	Confident	72.5	Confident	96 Å²	96	87.4 Å²	87.4	45%	0.449	50%	0.496	S	S	.	.	H	α-helix	trans	-58.7	-37.4	177.8	-178	171.1	-169.8	0	0	111.1	Q593 N601	Q593-E597 WeakPolarHBondContact O-CA 3.23Å; Q593-E597 WeakPolarHBondContact O-CB 3.41Å; Q593-E597 PolarHBondContact O-N 3.36Å; E597-N601 WeakPolarHBondContact CG-ND2 3.47Å; E597-N601 WeakPolarHBondContact O-CB 3.36Å; E597-N601 PolarHBondContact O-N 2.81Å; E597-N601 PolarHBondContact O-ND2 2.84Å; E597-N601 VanDerWaalsContact O-ND2 3.16Å
598	I	66	Low	72.2	Confident	125 Å²	125	90.8 Å²	90.8	64%	0.641	50%	0.502	S	S	*	.	H	α-helix	trans	-63.3	-41.4	172.3	-68	165.1	0	0	0	111.5	L594 I596	L594-I598 WeakPolarHBondContact O-CB 3.42Å; L594-I598 VanDerWaalsContact O-CD1 3.24Å; L594-I598 WeakPolarHBondContact O-CD1 3.5Å; L594-I598 WeakPolarHBondContact O-CG1 3.47Å; L594-I598 PolarHBondContact O-N 2.82Å; L594-I598 VanDerWaalsContact O-N 3.15Å; I596-I598 PolarHBondContact O-N 3.32Å
599	T	72	Confident	72.1	Confident	83 Å²	83	94.7 Å²	94.7	51%	0.509	52%	0.519	S	S	.	.	H	α-helix	trans	-81.8	-34.2	-179.2	57.4	0	0	0	0	113.4	A595 I596 S602 Q603	A595-T599 WeakPolarHBondContact O-CG2 3.24Å; A595-T599 PolarHBondContact O-N 3.35Å; A595-T599 PolarHBondContact O-OG1 3.5Å; I596-T599 WeakPolarHBondContact CA-OG1 3.35Å; I596-T599 CarbonylContact O-C 3.59Å; I596-T599 WeakPolarHBondContact O-CA 3.43Å; I596-T599 PolarHBondContact O-N 2.89Å; I596-T599 PolarHBondContact O-OG1 3.49Å; T599-S602 WeakPolarHBondContact O-CB 3.31Å; T599-S602 PolarHBondContact O-N 3.38Å; T599-Q603 PolarHBondContact O-N 3.01Å
600	T	72	Confident	72.1	Confident	62 Å²	62	94.3 Å²	94.3	38%	0.38	52%	0.517	S	S	.	.	H	α-helix	trans	-72.8	-44.8	177.1	-59.4	0	0	0	0	111.3	I596 S602 Q603 E604	I596-T600 VanDerWaalsContact CG2-OG1 3.26Å; I596-T600 WeakPolarHBondContact CG2-OG1 3.3Å; I596-T600 VanDerWaalsContact O-CB 3.28Å; I596-T600 WeakPolarHBondContact O-CB 3.42Å; I596-T600 PolarHBondContact O-N 2.9Å; I596-T600 PolarHBondContact O-OG1 3.29Å; T600-S602 PolarHBondContact O-N 3.26Å; T600-Q603 PolarHBondContact O-N 3.08Å; T600-Q603 VanDerWaalsContact O-N 3.12Å; T600-E604 WeakPolarHBondContact O-CB 3.31Å; T600-E604 PolarHBondContact O-N 2.7Å
601	N	73.9	Confident	71.8	Confident	90 Å²	90	90.4 Å²	90.4	48%	0.481	51%	0.514	S	S	.	.	H	α-helix	trans	-59.8	-32.7	174.1	-74.7	-26.2	0	0	0	111.2	E597 A605	E597-N601 WeakPolarHBondContact CG-ND2 3.47Å; E597-N601 WeakPolarHBondContact O-CB 3.36Å; E597-N601 PolarHBondContact O-N 2.81Å; E597-N601 PolarHBondContact O-ND2 2.84Å; E597-N601 VanDerWaalsContact O-ND2 3.16Å; N601-A605 WeakPolarHBondContact O-CB 3.39Å; N601-A605 PolarHBondContact O-N 2.86Å
602	S	71.2	Confident	71.9	Confident	85 Å²	85	92 Å²	92	59%	0.594	51%	0.512	S	S	*	.	H	α-helix	trans	-70.4	-45	174.1	-177	0	0	0	0	112.7	T599 T600	T599-S602 WeakPolarHBondContact O-CB 3.31Å; T599-S602 PolarHBondContact O-N 3.38Å; T600-S602 PolarHBondContact O-N 3.26Å
603	Q	71.7	Confident	71.9	Confident	148 Å²	148	95.1 Å²	95.1	69%	0.692	52%	0.516	S	S	*	.	H	α-helix	trans	-74.5	-37.4	178.2	-81.4	-161.7	-14.4	0	0	114.1	T599 T600 A606 A607	T599-Q603 PolarHBondContact O-N 3.01Å; T600-Q603 PolarHBondContact O-N 3.08Å; T600-Q603 VanDerWaalsContact O-N 3.12Å; Q603-A606 PolarHBondContact O-N 2.82Å; Q603-A607 WeakPolarHBondContact O-CB 3.29Å; Q603-A607 PolarHBondContact O-N 2.94Å
604	E	70.8	Confident	72.1	Confident	107 Å²	107	94.1 Å²	94.1	50%	0.5	51%	0.513	S	S	.	.	H	α-helix	trans	-64.3	-43.7	179.4	-176.6	-176.8	165.3	0	0	110.6	T600 A606 A607 K608	T600-E604 WeakPolarHBondContact O-CB 3.31Å; T600-E604 PolarHBondContact O-N 2.7Å; E604-A606 VanDerWaalsContact C-N 3.29Å; E604-A606 PolarHBondContact O-N 2.83Å; E604-A607 PolarHBondContact O-N 2.91Å; E604-K608 WeakPolarHBondContact O-CB 3.22Å; E604-K608 PolarHBondContact O-N 2.85Å
605	A	67.7	Low	72.3	Confident	54 Å²	54	93.7 Å²	93.7	45%	0.446	51%	0.508	S	S	.	.	H	α-helix	trans	-57.1	-45.7	174.1	0	0	0	0	0	111	N601 H609	N601-A605 WeakPolarHBondContact O-CB 3.39Å; N601-A605 PolarHBondContact O-N 2.86Å; A605-H609 PolarHBondContact O-CD2 3.1Å; A605-H609 PolarHBondContact O-N 2.86Å
606	A	69.8	Low	72.6	Confident	64 Å²	64	97.4 Å²	97.4	53%	0.529	52%	0.516	S	S	.	.	H	α-helix	trans	-67.2	-46.3	178.7	0	0	0	0	0	112.8	Q603 E604 H609 E610	Q603-A606 PolarHBondContact O-N 2.82Å; E604-A606 VanDerWaalsContact C-N 3.29Å; E604-A606 PolarHBondContact O-N 2.83Å; A606-H609 PolarHBondContact O-N 3.3Å; A606-E610 PolarHBondContact O-N 2.81Å; A606-E610 VanDerWaalsContact O-N 3.15Å
607	A	70.1	Confident	73.3	Confident	59 Å²	59	97.7 Å²	97.7	49%	0.488	52%	0.516	S	S	.	.	H	α-helix	trans	-68.5	-36.7	-178.5	0	0	0	0	0	112.6	Q603 E604 E610 A611	Q603-A607 WeakPolarHBondContact O-CB 3.29Å; Q603-A607 PolarHBondContact O-N 2.94Å; E604-A607 PolarHBondContact O-N 2.91Å; A607-E610 PolarHBondContact O-N 3.03Å; A607-A611 WeakPolarHBondContact O-CB 3.32Å; A607-A611 PolarHBondContact O-N 2.81Å
608	K	73.3	Confident	73.6	Confident	119 Å²	119	95.6 Å²	95.6	52%	0.517	52%	0.515	S	S	.	.	H	α-helix	trans	-64.7	-39.6	177.3	-173.2	174.7	-176.7	173.6	0	111.8	E604 Q612	E604-K608 WeakPolarHBondContact O-CB 3.22Å; E604-K608 PolarHBondContact O-N 2.85Å; K608-Q612 WeakPolarHBondContact O-CB 3.28Å; K608-Q612 VanDerWaalsContact O-CG 3.27Å; K608-Q612 WeakPolarHBondContact O-CG 3.41Å; K608-Q612 PolarHBondContact O-N 3Å
609	H	72.8	Confident	74.2	Confident	139 Å²	139	97 Å²	97	64%	0.644	51%	0.512	S	S	*	.	H	α-helix	trans	-67.3	-40.3	174.4	-78.7	-60.7	0	0	0	112.4	A605 A606 R613	A605-H609 PolarHBondContact O-CD2 3.1Å; A605-H609 PolarHBondContact O-N 2.86Å; A606-H609 PolarHBondContact O-N 3.3Å; H609-R613 PolarHBondContact O-N 3.38Å
610	E	75.6	Confident	74.7	Confident	92 Å²	92	95 Å²	95	43%	0.43	51%	0.508	S	S	.	.	H	α-helix	trans	-67.4	-43.6	177	-159.2	78.4	-165.3	0	0	111.7	A606 A607 R613 L614	A606-E610 PolarHBondContact O-N 2.81Å; A606-E610 VanDerWaalsContact O-N 3.15Å; A607-E610 PolarHBondContact O-N 3.03Å; E610-R613 WeakPolarHBondContact O-CB 3.15Å; E610-R613 PolarHBondContact O-N 3.38Å; E610-R613 IonicContact OE1-CZ 3.74Å; E610-R613 IonicContact OE1-NH1 2.82Å; E610-R613 PolarHBondContact OE1-NH1 3.27Å; E610-R613 IonicContact OE1-NH2 3.22Å; E610-R613 PolarHBondContact OE1-NH2 2.93Å; E610-R613 IonicContact OE2-NH1 2.85Å; E610-R613 PolarHBondContact OE2-NH1 2.83Å; E610-L614 HydrophobicContact CG-CD1 4.38Å; E610-L614 PolarHBondContact O-N 3.14Å
611	A	72.4	Confident	75.2	Confident	55 Å²	55	99.3 Å²	99.3	46%	0.455	52%	0.517	S	S	.	.	H	α-helix	trans	-66.8	-41.7	-180	0	0	0	0	0	112.3	A607 R613 L614 E615	A607-A611 WeakPolarHBondContact O-CB 3.32Å; A607-A611 PolarHBondContact O-N 2.81Å; A611-R613 VanDerWaalsContact C-N 3.26Å; A611-R613 PolarHBondContact O-N 2.87Å; A611-L614 PolarHBondContact O-N 2.99Å; A611-E615 WeakPolarHBondContact O-CB 3.48Å; A611-E615 PolarHBondContact O-N 2.87Å
612	Q	77.1	Confident	75.5	Confident	115 Å²	115	100.5 Å²	100.5	54%	0.537	52%	0.523	S	S	.	.	H	α-helix	trans	-62.4	-34.9	175.7	-76	177.8	-12.6	0	0	112.2	K608 Q616	K608-Q612 WeakPolarHBondContact O-CB 3.28Å; K608-Q612 VanDerWaalsContact O-CG 3.27Å; K608-Q612 WeakPolarHBondContact O-CG 3.41Å; K608-Q612 PolarHBondContact O-N 3Å; Q612-Q616 WeakPolarHBondContact O-CB 3.39Å; Q612-Q616 PolarHBondContact O-N 2.88Å
613	R	76.6	Confident	75.9	Confident	142 Å²	142	102.6 Å²	102.6	54%	0.536	52%	0.523	S	S	.	.	H	α-helix	trans	-67.4	-46.6	175	-164.9	-174	76.6	-141.9	-4.3	111.6	H609 E610 A611 Q616 E617	H609-R613 PolarHBondContact O-N 3.38Å; E610-R613 WeakPolarHBondContact O-CB 3.15Å; E610-R613 PolarHBondContact O-N 3.38Å; E610-R613 IonicContact OE1-CZ 3.74Å; E610-R613 IonicContact OE1-NH1 2.82Å; E610-R613 PolarHBondContact OE1-NH1 3.27Å; E610-R613 IonicContact OE1-NH2 3.22Å; E610-R613 PolarHBondContact OE1-NH2 2.93Å; E610-R613 IonicContact OE2-NH1 2.85Å; E610-R613 PolarHBondContact OE2-NH1 2.83Å; A611-R613 VanDerWaalsContact C-N 3.26Å; A611-R613 PolarHBondContact O-N 2.87Å; R613-Q616 PolarHBondContact O-N 3.36Å; R613-E617 PolarHBondContact O-N 3.33Å; R613-E617 VanDerWaalsContact O-N 3.15Å
614	L	78.2	Confident	76.3	Confident	91 Å²	91	104.4 Å²	104.4	48%	0.476	52%	0.524	S	S	.	.	H	α-helix	trans	-68.4	-40.9	179.6	-74.7	167.9	0	0	0	112.8	E610 A611 Q616 E617 A618	E610-L614 HydrophobicContact CG-CD1 4.38Å; E610-L614 PolarHBondContact O-N 3.14Å; A611-L614 PolarHBondContact O-N 2.99Å; L614-Q616 VanDerWaalsContact C-N 3.32Å; L614-Q616 PolarHBondContact O-N 3.24Å; L614-E617 PolarHBondContact O-N 2.78Å; L614-A618 VanDerWaalsContact O-CB 3.27Å; L614-A618 WeakPolarHBondContact O-CB 3.47Å; L614-A618 PolarHBondContact O-N 2.83Å
615	E	76.3	Confident	76.9	Confident	96 Å²	96	104.6 Å²	104.6	45%	0.449	53%	0.525	S	S	.	.	H	α-helix	trans	-60.5	-42.7	175.9	-177.5	78.9	-160.8	0	0	110.7	A611 A618 R619	A611-E615 WeakPolarHBondContact O-CB 3.48Å; A611-E615 PolarHBondContact O-N 2.87Å; E615-A618 PolarHBondContact O-N 3.48Å; E615-R619 WeakPolarHBondContact O-CB 3.46Å; E615-R619 VanDerWaalsContact O-CG 3.32Å; E615-R619 WeakPolarHBondContact O-CG 3.35Å; E615-R619 PolarHBondContact O-N 2.81Å; E615-R619 IonicContact OE1-CZ 2.71Å; E615-R619 IonicContact OE1-NE 2.77Å; E615-R619 PolarHBondContact OE1-NE 3.45Å; E615-R619 IonicContact OE1-NH2 3.21Å; E615-R619 PolarHBondContact OE1-NH2 3.39Å
616	Q	78.6	Confident	77.7	Confident	136 Å²	136	107.8 Å²	107.8	64%	0.636	53%	0.528	S	S	*	.	H	α-helix	trans	-67.6	-39	178.8	-168.3	65.9	5.1	0	0	112	Q612 R613 L614 G620	Q612-Q616 WeakPolarHBondContact O-CB 3.39Å; Q612-Q616 PolarHBondContact O-N 2.88Å; R613-Q616 PolarHBondContact O-N 3.36Å; L614-Q616 VanDerWaalsContact C-N 3.32Å; L614-Q616 PolarHBondContact O-N 3.24Å; Q616-G620 PolarHBondContact O-N 2.88Å; Q616-G620 VanDerWaalsContact O-N 3.1Å
617	E	80.8	Confident	78.3	Confident	94 Å²	94	109.6 Å²	109.6	44%	0.439	53%	0.528	S	S	.	.	H	α-helix	trans	-66.7	-44.5	174.3	-169.2	-170.5	153.2	0	0	111.7	R613 L614 G620 R621	R613-E617 PolarHBondContact O-N 3.33Å; R613-E617 VanDerWaalsContact O-N 3.15Å; L614-E617 PolarHBondContact O-N 2.78Å; E617-G620 PolarHBondContact O-N 3.47Å; E617-R621 WeakPolarHBondContact O-CB 3.33Å; E617-R621 PolarHBondContact O-N 2.9Å; E617-R621 IonicContact OE1-CZ 3.35Å; E617-R621 IonicContact OE1-NH1 3.16Å; E617-R621 PolarHBondContact OE1-NH1 3.36Å; E617-R621 IonicContact OE1-NH2 2.73Å; E617-R621 PolarHBondContact OE1-NH2 2.8Å
618	A	78.3	Confident	79.1	Confident	52 Å²	52	111 Å²	111	43%	0.43	53%	0.527	S	S	.	.	H	α-helix	trans	-66.1	-43	-179.9	0	0	0	0	0	111.9	L614 E615 R621 L622	L614-A618 VanDerWaalsContact O-CB 3.27Å; L614-A618 WeakPolarHBondContact O-CB 3.47Å; L614-A618 PolarHBondContact O-N 2.83Å; E615-A618 PolarHBondContact O-N 3.48Å; A618-R621 PolarHBondContact O-N 2.83Å; A618-L622 VanDerWaalsContact O-CB 3.23Å; A618-L622 WeakPolarHBondContact O-CB 3.4Å; A618-L622 PolarHBondContact O-N 3.25Å
619	R	80.2	Confident	79.6	Confident	153 Å²	153	109.5 Å²	109.5	58%	0.577	53%	0.525	S	S	*	.	H	α-helix	trans	-61.6	-45.3	173.8	-75.7	-179	-173.9	-170.6	2.7	111.6	E615 R621 L622 E623	E615-R619 WeakPolarHBondContact O-CB 3.46Å; E615-R619 VanDerWaalsContact O-CG 3.32Å; E615-R619 WeakPolarHBondContact O-CG 3.35Å; E615-R619 PolarHBondContact O-N 2.81Å; E615-R619 IonicContact OE1-CZ 2.71Å; E615-R619 IonicContact OE1-NE 2.77Å; E615-R619 PolarHBondContact OE1-NE 3.45Å; E615-R619 IonicContact OE1-NH2 3.21Å; E615-R619 PolarHBondContact OE1-NH2 3.39Å; R619-R621 VanDerWaalsContact C-N 3.33Å; R619-R621 PolarHBondContact O-N 3.5Å; R619-L622 PolarHBondContact O-N 2.87Å; R619-E623 VanDerWaalsContact O-CB 3.24Å; R619-E623 WeakPolarHBondContact O-CB 3.15Å; R619-E623 PolarHBondContact O-N 3.46Å
620	G	82.1	Confident	80.1	Confident	41 Å²	41	107.9 Å²	107.9	42%	0.423	52%	0.518	S	S	.	.	H	α-helix	trans	-61.6	-39.2	175.7	0	0	0	0	0	113.1	Q616 E617 R624	Q616-G620 PolarHBondContact O-N 2.88Å; Q616-G620 VanDerWaalsContact O-N 3.1Å; E617-G620 PolarHBondContact O-N 3.47Å; G620-R624 WeakPolarHBondContact O-CB 3.27Å; G620-R624 PolarHBondContact O-N 2.89Å
621	R	82.5	Confident	80.5	Confident	153 Å²	153	105.7 Å²	105.7	58%	0.577	51%	0.512	S	S	*	.	H	α-helix	trans	-70.6	-43.5	177.1	-171.1	178.4	-79.6	123.7	2.3	111.9	E617 A618 R619 R624 Q625	E617-R621 WeakPolarHBondContact O-CB 3.33Å; E617-R621 PolarHBondContact O-N 2.9Å; E617-R621 IonicContact OE1-CZ 3.35Å; E617-R621 IonicContact OE1-NH1 3.16Å; E617-R621 PolarHBondContact OE1-NH1 3.36Å; E617-R621 IonicContact OE1-NH2 2.73Å; E617-R621 PolarHBondContact OE1-NH2 2.8Å; A618-R621 PolarHBondContact O-N 2.83Å; R619-R621 VanDerWaalsContact C-N 3.33Å; R619-R621 PolarHBondContact O-N 3.5Å; R621-R624 PolarHBondContact O-N 2.94Å; R621-Q625 WeakPolarHBondContact O-CB 3.26Å; R621-Q625 PolarHBondContact O-N 3.26Å
622	L	79.2	Confident	81	Confident	116 Å²	116	108.8 Å²	108.8	61%	0.607	52%	0.517	S	S	*	.	H	α-helix	trans	-68.8	-40.5	-179.8	-172.6	146.6	0	0	0	111.8	A618 R619 R624 Q625 K626	A618-L622 VanDerWaalsContact O-CB 3.23Å; A618-L622 WeakPolarHBondContact O-CB 3.4Å; A618-L622 PolarHBondContact O-N 3.25Å; R619-L622 PolarHBondContact O-N 2.87Å; L622-R624 VanDerWaalsContact C-N 3.35Å; L622-Q625 PolarHBondContact O-N 2.92Å; L622-K626 VanDerWaalsContact O-CB 3.3Å; L622-K626 WeakPolarHBondContact O-CB 3.4Å; L622-K626 PolarHBondContact O-N 3.44Å
623	E	80.5	Confident	81.3	Confident	129 Å²	129	106.1 Å²	106.1	60%	0.603	52%	0.515	S	S	*	.	H	α-helix	trans	-65.6	-40.9	176.2	-168	170.2	-158.2	0	0	111	R619 Q625 K626 I627	R619-E623 VanDerWaalsContact O-CB 3.24Å; R619-E623 WeakPolarHBondContact O-CB 3.15Å; R619-E623 PolarHBondContact O-N 3.46Å; E623-Q625 PolarHBondContact O-N 3.13Å; E623-K626 PolarHBondContact O-N 3.29Å; E623-I627 HydrophobicContact CG-CD1 4.47Å; E623-I627 VanDerWaalsContact O-CG1 3.28Å; E623-I627 WeakPolarHBondContact O-CG1 3.2Å; E623-I627 PolarHBondContact O-N 2.81Å
624	R	80.3	Confident	81.6	Confident	185 Å²	185	104.1 Å²	104.1	70%	0.698	51%	0.511	S	S	*	.	H	α-helix	trans	-61.5	-43.4	171.8	-173.6	177.5	-176.5	167.3	1.5	112.1	G620 R621 L622 I627 L628	G620-R624 WeakPolarHBondContact O-CB 3.27Å; G620-R624 PolarHBondContact O-N 2.89Å; R621-R624 PolarHBondContact O-N 2.94Å; L622-R624 VanDerWaalsContact C-N 3.35Å; R624-I627 PolarHBondContact O-N 3.08Å; R624-L628 HydrophobicContact CG-CD1 4.49Å; R624-L628 WeakPolarHBondContact O-CG 3.35Å; R624-L628 PolarHBondContact O-N 2.69Å
625	Q	81.9	Confident	82	Confident	111 Å²	111	106.2 Å²	106.2	52%	0.519	52%	0.517	S	S	.	.	H	α-helix	trans	-67.1	-42.5	178.7	-169.5	162.5	6.1	0	0	111.6	R621 L622 E623 I627 L628 D629	R621-Q625 WeakPolarHBondContact O-CB 3.26Å; R621-Q625 PolarHBondContact O-N 3.26Å; L622-Q625 PolarHBondContact O-N 2.92Å; E623-Q625 PolarHBondContact O-N 3.13Å; Q625-I627 VanDerWaalsContact C-N 3.29Å; Q625-I627 PolarHBondContact O-N 3.22Å; Q625-L628 WeakPolarHBondContact O-CA 3.23Å; Q625-L628 WeakPolarHBondContact O-CB 3.37Å; Q625-L628 PolarHBondContact O-N 3.21Å; Q625-D629 VanDerWaalsContact O-CG 3.27Å; Q625-D629 PolarHBondContact O-N 3.05Å
626	K	84.8	Confident	82.4	Confident	121 Å²	121	104.4 Å²	104.4	53%	0.526	52%	0.518	S	S	.	.	H	α-helix	trans	-59.6	-39.4	174.1	-172.5	176.9	-178.2	-180	0	112.1	L622 E623 Q630	L622-K626 VanDerWaalsContact O-CB 3.3Å; L622-K626 WeakPolarHBondContact O-CB 3.4Å; L622-K626 PolarHBondContact O-N 3.44Å; E623-K626 PolarHBondContact O-N 3.29Å; K626-Q630 VanDerWaalsContact O-CB 3.24Å; K626-Q630 WeakPolarHBondContact O-CB 3.49Å; K626-Q630 WeakPolarHBondContact O-CG 3.43Å; K626-Q630 PolarHBondContact O-N 2.78Å
627	I	83.3	Confident	82.7	Confident	103 Å²	103	104.7 Å²	104.7	53%	0.528	51%	0.513	S	S	.	.	H	α-helix	trans	-66.2	-39.8	174.3	-70	168.6	0	0	0	111	E623 R624 Q625 S631	E623-I627 HydrophobicContact CG-CD1 4.47Å; E623-I627 VanDerWaalsContact O-CG1 3.28Å; E623-I627 WeakPolarHBondContact O-CG1 3.2Å; E623-I627 PolarHBondContact O-N 2.81Å; R624-I627 PolarHBondContact O-N 3.08Å; Q625-I627 VanDerWaalsContact C-N 3.29Å; Q625-I627 PolarHBondContact O-N 3.22Å; I627-S631 VanDerWaalsContact O-CB 3.31Å; I627-S631 WeakPolarHBondContact O-CB 3.23Å; I627-S631 PolarHBondContact O-N 2.97Å
628	L	85.9	Confident	83.1	Confident	89 Å²	89	106.3 Å²	106.3	47%	0.466	52%	0.519	S	S	.	.	H	α-helix	trans	-64.3	-48.7	176.2	-71.5	169.7	0	0	0	111.3	R624 Q625 Q630 S631 E632	R624-L628 HydrophobicContact CG-CD1 4.49Å; R624-L628 WeakPolarHBondContact O-CG 3.35Å; R624-L628 PolarHBondContact O-N 2.69Å; Q625-L628 WeakPolarHBondContact O-CA 3.23Å; Q625-L628 WeakPolarHBondContact O-CB 3.37Å; Q625-L628 PolarHBondContact O-N 3.21Å; L628-Q630 VanDerWaalsContact C-N 3.35Å; L628-Q630 PolarHBondContact O-N 2.96Å; L628-S631 CarbonylContact O-C 3.57Å; L628-S631 WeakPolarHBondContact O-CA 3.35Å; L628-S631 WeakPolarHBondContact O-CB 3.48Å; L628-S631 PolarHBondContact O-N 2.84Å; L628-S631 PolarHBondContact O-OG 2.76Å; L628-E632 PolarHBondContact O-N 3.48Å
629	D	83.6	Confident	83.4	Confident	87 Å²	87	109.9 Å²	109.9	47%	0.465	53%	0.527	S	S	.	.	H	α-helix	trans	-61.6	-42.8	177.7	-63	-17.9	0	0	0	111.1	Q625 S631 E632 A633	Q625-D629 VanDerWaalsContact O-CG 3.27Å; Q625-D629 PolarHBondContact O-N 3.05Å; D629-S631 VanDerWaalsContact C-N 3.31Å; D629-S631 PolarHBondContact O-N 2.87Å; D629-E632 PolarHBondContact O-N 3.21Å; D629-A633 VanDerWaalsContact O-CB 3.29Å; D629-A633 WeakPolarHBondContact O-CB 3.46Å; D629-A633 PolarHBondContact O-N 2.99Å
630	Q	83.3	Confident	83.6	Confident	105 Å²	105	107.1 Å²	107.1	49%	0.491	52%	0.523	S	S	.	.	H	α-helix	trans	-63.1	-37.6	173.1	-76.3	176.4	-12.8	0	0	111.7	K626 L628 E634	K626-Q630 VanDerWaalsContact O-CB 3.24Å; K626-Q630 WeakPolarHBondContact O-CB 3.49Å; K626-Q630 WeakPolarHBondContact O-CG 3.43Å; K626-Q630 PolarHBondContact O-N 2.78Å; L628-Q630 VanDerWaalsContact C-N 3.35Å; L628-Q630 PolarHBondContact O-N 2.96Å; Q630-E634 VanDerWaalsContact O-CB 3.3Å; Q630-E634 WeakPolarHBondContact O-CB 3.48Å; Q630-E634 VanDerWaalsContact O-CG 3.28Å; Q630-E634 WeakPolarHBondContact O-CG 3.32Å; Q630-E634 PolarHBondContact O-N 3.39Å
631	S	84	Confident	83.9	Confident	45 Å²	45	109.4 Å²	109.4	32%	0.315	53%	0.525	S	S	.	.	H	α-helix	trans	-68	-36.4	176.9	84.7	0	0	0	0	112.5	I627 L628 D629 K635	I627-S631 VanDerWaalsContact O-CB 3.31Å; I627-S631 WeakPolarHBondContact O-CB 3.23Å; I627-S631 PolarHBondContact O-N 2.97Å; L628-S631 CarbonylContact O-C 3.57Å; L628-S631 WeakPolarHBondContact O-CA 3.35Å; L628-S631 WeakPolarHBondContact O-CB 3.48Å; L628-S631 PolarHBondContact O-N 2.84Å; L628-S631 PolarHBondContact O-OG 2.76Å; D629-S631 VanDerWaalsContact C-N 3.31Å; D629-S631 PolarHBondContact O-N 2.87Å; S631-K635 VanDerWaalsContact O-CG 3.28Å; S631-K635 WeakPolarHBondContact O-CG 3.34Å; S631-K635 PolarHBondContact O-N 3.01Å
632	E	84.3	Confident	84.1	Confident	121 Å²	121	106.8 Å²	106.8	57%	0.565	52%	0.519	S	S	*	.	H	α-helix	trans	-72.5	-42.3	176.1	-72.2	-176.3	178.5	0	0	111.1	L628 D629 E634 K635 A636	L628-E632 PolarHBondContact O-N 3.48Å; D629-E632 PolarHBondContact O-N 3.21Å; E632-E634 VanDerWaalsContact C-N 3.34Å; E632-E634 PolarHBondContact O-N 2.96Å; E632-K635 WeakPolarHBondContact O-CB 3.31Å; E632-K635 PolarHBondContact O-N 3.22Å; E632-A636 PolarHBondContact O-N 3.31Å
633	A	83.2	Confident	84.5	Confident	58 Å²	58	106.6 Å²	106.6	48%	0.479	52%	0.518	S	S	.	.	H	α-helix	trans	-60.1	-43.5	172.7	0	0	0	0	0	111.4	D629 A636 R637	D629-A633 VanDerWaalsContact O-CB 3.29Å; D629-A633 WeakPolarHBondContact O-CB 3.46Å; D629-A633 PolarHBondContact O-N 2.99Å; A633-A636 PolarHBondContact O-N 2.91Å; A633-R637 WeakPolarHBondContact O-CB 3.37Å; A633-R637 PolarHBondContact O-N 2.86Å
634	E	82.9	Confident	84.6	Confident	100 Å²	100	105.3 Å²	105.3	47%	0.467	51%	0.512	S	S	.	.	H	α-helix	trans	-69.6	-29.8	177	-74.5	-61.9	146.9	0	0	112.8	Q630 E632 R637 K638	Q630-E634 VanDerWaalsContact O-CB 3.3Å; Q630-E634 WeakPolarHBondContact O-CB 3.48Å; Q630-E634 VanDerWaalsContact O-CG 3.28Å; Q630-E634 WeakPolarHBondContact O-CG 3.32Å; Q630-E634 PolarHBondContact O-N 3.39Å; E632-E634 VanDerWaalsContact C-N 3.34Å; E632-E634 PolarHBondContact O-N 2.96Å; E634-R637 IonicContact OE1-NH1 2.76Å; E634-R637 PolarHBondContact OE1-NH1 2.74Å; E634-R637 VanDerWaalsContact OE1-NH1 3.15Å; E634-K638 WeakPolarHBondContact O-CB 3.42Å; E634-K638 PolarHBondContact O-N 3.14Å
635	K	86.9	Confident	85	Confident	136 Å²	136	99.2 Å²	99.2	59%	0.591	50%	0.502	S	S	*	.	H	α-helix	trans	-64.2	-49.5	170.1	-76.6	170.2	-173	171.6	0	111.6	S631 E632 R637 K638 E639	S631-K635 VanDerWaalsContact O-CG 3.28Å; S631-K635 WeakPolarHBondContact O-CG 3.34Å; S631-K635 PolarHBondContact O-N 3.01Å; E632-K635 WeakPolarHBondContact O-CB 3.31Å; E632-K635 PolarHBondContact O-N 3.22Å; K635-R637 VanDerWaalsContact C-N 3.33Å; K635-K638 WeakPolarHBondContact O-CB 3.4Å; K635-K638 PolarHBondContact O-N 3.12Å; K635-E639 PolarHBondContact O-N 2.79Å
636	A	83.3	Confident	85.2	Confident	57 Å²	57	99.2 Å²	99.2	47%	0.471	51%	0.505	S	S	.	.	H	α-helix	trans	-66	-37.4	177.3	0	0	0	0	0	111.8	E632 A633 K638 E639 L640	E632-A636 PolarHBondContact O-N 3.31Å; A633-A636 PolarHBondContact O-N 2.91Å; A636-K638 VanDerWaalsContact C-N 3.32Å; A636-K638 PolarHBondContact O-N 2.9Å; A636-E639 PolarHBondContact O-N 2.98Å; A636-L640 PolarHBondContact O-N 2.88Å
637	R	85.8	Confident	85.3	Confident	142 Å²	142	97.1 Å²	97.1	54%	0.536	51%	0.505	S	S	.	.	H	α-helix	trans	-64.4	-37.5	175.9	-168	179.5	-167.4	170.4	4.5	111.8	A633 E634 K635 L640 L641	A633-R637 WeakPolarHBondContact O-CB 3.37Å; A633-R637 PolarHBondContact O-N 2.86Å; E634-R637 IonicContact OE1-NH1 2.76Å; E634-R637 PolarHBondContact OE1-NH1 2.74Å; E634-R637 VanDerWaalsContact OE1-NH1 3.15Å; K635-R637 VanDerWaalsContact C-N 3.33Å; R637-L640 PolarHBondContact O-N 3.43Å; R637-L641 HydrophobicContact CG-CD1 4.14Å; R637-L641 HydrophobicContact CG-CG 4.45Å; R637-L641 WeakPolarHBondContact O-CB 3.38Å; R637-L641 VanDerWaalsContact O-CG 3.23Å; R637-L641 WeakPolarHBondContact O-CG 3.4Å; R637-L641 PolarHBondContact O-N 3.02Å
638	K	88.3	Confident	85.4	Confident	128 Å²	128	98.3 Å²	98.3	56%	0.557	51%	0.51	S	S	*	.	H	α-helix	trans	-60	-46.5	172.7	-178.6	-170.8	163.4	-171	0	111.2	E634 K635 A636 L641 E642	E634-K638 WeakPolarHBondContact O-CB 3.42Å; E634-K638 PolarHBondContact O-N 3.14Å; K635-K638 WeakPolarHBondContact O-CB 3.4Å; K635-K638 PolarHBondContact O-N 3.12Å; A636-K638 VanDerWaalsContact C-N 3.32Å; A636-K638 PolarHBondContact O-N 2.9Å; K638-L641 PolarHBondContact O-N 2.84Å; K638-E642 WeakPolarHBondContact CE-OE1 3.48Å; K638-E642 IonicContact NZ-OE1 3.4Å; K638-E642 WeakPolarHBondContact O-CG 3.3Å; K638-E642 PolarHBondContact O-N 3.09Å
639	E	85.9	Confident	85.5	Confident	128 Å²	128	96.5 Å²	96.5	60%	0.598	51%	0.507	S	S	*	.	H	α-helix	trans	-62.8	-42.3	177.5	-68	176.6	-177.7	0	0	111.9	K635 A636 E642 L643	K635-E639 PolarHBondContact O-N 2.79Å; A636-E639 PolarHBondContact O-N 2.98Å; E639-E642 PolarHBondContact O-N 2.7Å; E639-L643 WeakPolarHBondContact O-CG 3.35Å; E639-L643 PolarHBondContact O-N 2.89Å
640	L	83.7	Confident	85.7	Confident	95 Å²	95	97.3 Å²	97.3	50%	0.497	52%	0.515	S	S	.	.	H	α-helix	trans	-62.1	-44.6	174.9	-177.2	142.5	0	0	0	111.6	A636 R637 E642 L643 E644	A636-L640 PolarHBondContact O-N 2.88Å; R637-L640 PolarHBondContact O-N 3.43Å; L640-E642 VanDerWaalsContact C-N 3.32Å; L640-E642 PolarHBondContact O-N 2.81Å; L640-L643 PolarHBondContact O-N 3.5Å; L640-E644 HydrophobicContact CD2-CG 4.11Å; L640-E644 WeakPolarHBondContact O-CB 3.41Å; L640-E644 WeakPolarHBondContact O-CG 3.37Å; L640-E644 PolarHBondContact O-N 2.95Å
641	L	88	Confident	85.6	Confident	88 Å²	88	98.6 Å²	98.6	46%	0.461	52%	0.522	S	S	.	.	H	α-helix	trans	-65.3	-34	176.5	-74.9	170	0	0	0	112.4	R637 K638 A645	R637-L641 HydrophobicContact CG-CD1 4.14Å; R637-L641 HydrophobicContact CG-CG 4.45Å; R637-L641 WeakPolarHBondContact O-CB 3.38Å; R637-L641 VanDerWaalsContact O-CG 3.23Å; R637-L641 WeakPolarHBondContact O-CG 3.4Å; R637-L641 PolarHBondContact O-N 3.02Å; K638-L641 PolarHBondContact O-N 2.84Å; L641-A645 WeakPolarHBondContact O-CB 3.38Å; L641-A645 PolarHBondContact O-N 2.89Å
642	E	87.1	Confident	85.8	Confident	98 Å²	98	100.1 Å²	100.1	46%	0.458	53%	0.532	S	S	.	.	H	α-helix	trans	-65.5	-43.6	172.7	-76.8	176.5	-178.8	0	0	111.1	K638 E639 L640 A645 L646	K638-E642 WeakPolarHBondContact CE-OE1 3.48Å; K638-E642 IonicContact NZ-OE1 3.4Å; K638-E642 WeakPolarHBondContact O-CG 3.3Å; K638-E642 PolarHBondContact O-N 3.09Å; E639-E642 PolarHBondContact O-N 2.7Å; L640-E642 VanDerWaalsContact C-N 3.32Å; L640-E642 PolarHBondContact O-N 2.81Å; E642-A645 PolarHBondContact O-N 2.67Å; E642-L646 WeakPolarHBondContact O-CB 3.45Å; E642-L646 VanDerWaalsContact O-CG 3.26Å; E642-L646 WeakPolarHBondContact O-CG 3.4Å; E642-L646 PolarHBondContact O-N 3.21Å
643	L	86.7	Confident	86	Confident	113 Å²	113	98.5 Å²	98.5	59%	0.592	53%	0.531	S	S	*	.	H	α-helix	trans	-68.4	-39.2	176.2	-71.8	171.4	0	0	0	112.8	E639 L640 L646 S647	E639-L643 WeakPolarHBondContact O-CG 3.35Å; E639-L643 PolarHBondContact O-N 2.89Å; L640-L643 PolarHBondContact O-N 3.5Å; L643-L646 PolarHBondContact O-N 3.2Å; L643-S647 WeakPolarHBondContact O-CB 3.49Å; L643-S647 PolarHBondContact O-N 2.83Å; L643-S647 PolarHBondContact O-OG 3.23Å
644	E	83.7	Confident	86.3	Confident	101 Å²	101	97.5 Å²	97.5	47%	0.472	53%	0.525	S	S	.	.	H	α-helix	trans	-63.4	-45.2	172.7	-79.4	-175.7	164.1	0	0	110.6	L640 L646 S647 M648	L640-E644 HydrophobicContact CD2-CG 4.11Å; L640-E644 WeakPolarHBondContact O-CB 3.41Å; L640-E644 WeakPolarHBondContact O-CG 3.37Å; L640-E644 PolarHBondContact O-N 2.95Å; E644-L646 VanDerWaalsContact C-N 3.34Å; E644-L646 PolarHBondContact O-N 3.37Å; E644-S647 PolarHBondContact O-N 3.33Å; E644-M648 WeakPolarHBondContact O-CB 3.08Å; E644-M648 VanDerWaalsContact O-CG 3.29Å; E644-M648 WeakPolarHBondContact O-CG 3.41Å; E644-M648 PolarHBondContact O-N 2.92Å
645	A	87.6	Confident	86.4	Confident	58 Å²	58	96.9 Å²	96.9	48%	0.479	53%	0.529	S	S	.	.	H	α-helix	trans	-62.9	-40	176.4	0	0	0	0	0	112.1	L641 E642 A649	L641-A645 WeakPolarHBondContact O-CB 3.38Å; L641-A645 PolarHBondContact O-N 2.89Å; E642-A645 PolarHBondContact O-N 2.67Å; A645-A649 VanDerWaalsContact O-CB 3.23Å; A645-A649 WeakPolarHBondContact O-CB 3.41Å; A645-A649 PolarHBondContact O-N 3.06Å
646	L	87.9	Confident	86.3	Confident	111 Å²	111	93.1 Å²	93.1	58%	0.581	52%	0.523	S	S	*	.	H	α-helix	trans	-64.5	-42	173.4	-74.9	170.4	0	0	0	111.6	E642 L643 E644 A649 V650	E642-L646 WeakPolarHBondContact O-CB 3.45Å; E642-L646 VanDerWaalsContact O-CG 3.26Å; E642-L646 WeakPolarHBondContact O-CG 3.4Å; E642-L646 PolarHBondContact O-N 3.21Å; L643-L646 PolarHBondContact O-N 3.2Å; E644-L646 VanDerWaalsContact C-N 3.34Å; E644-L646 PolarHBondContact O-N 3.37Å; L646-A649 PolarHBondContact O-N 3.42Å; L646-V650 VanDerWaalsContact O-CG2 3.3Å; L646-V650 WeakPolarHBondContact O-CG2 3.07Å; L646-V650 PolarHBondContact O-N 3.22Å
647	S	85.2	Confident	86.6	Confident	76 Å²	76	96.3 Å²	96.3	53%	0.531	53%	0.526	S	S	.	.	H	α-helix	trans	-66.5	-44.9	178.5	-58.5	0	0	0	0	111.4	L643 E644 A649 V650 E651	L643-S647 WeakPolarHBondContact O-CB 3.49Å; L643-S647 PolarHBondContact O-N 2.83Å; L643-S647 PolarHBondContact O-OG 3.23Å; E644-S647 PolarHBondContact O-N 3.33Å; S647-A649 VanDerWaalsContact C-N 3.3Å; S647-A649 PolarHBondContact O-N 2.76Å; S647-V650 PolarHBondContact O-N 3.43Å; S647-E651 WeakPolarHBondContact O-CB 3.09Å; S647-E651 PolarHBondContact O-N 3.43Å
648	M	85.6	Confident	86.5	Confident	129 Å²	129	92.3 Å²	92.3	64%	0.635	52%	0.523	S	S	*	.	H	α-helix	trans	-62	-37.2	173.2	-72.9	179.4	66.8	0	0	111.8	E644 S652	E644-M648 WeakPolarHBondContact O-CB 3.08Å; E644-M648 VanDerWaalsContact O-CG 3.29Å; E644-M648 WeakPolarHBondContact O-CG 3.41Å; E644-M648 PolarHBondContact O-N 2.92Å; M648-S652 WeakPolarHBondContact O-CB 3.37Å; M648-S652 PolarHBondContact O-N 3.31Å
649	A	88	Confident	86.2	Confident	50 Å²	50	91.4 Å²	91.4	41%	0.413	52%	0.521	S	S	.	.	H	α-helix	trans	-67	-41.7	174.7	0	0	0	0	0	111.5	A645 L646 S647 T653	A645-A649 VanDerWaalsContact O-CB 3.23Å; A645-A649 WeakPolarHBondContact O-CB 3.41Å; A645-A649 PolarHBondContact O-N 3.06Å; L646-A649 PolarHBondContact O-N 3.42Å; S647-A649 VanDerWaalsContact C-N 3.3Å; S647-A649 PolarHBondContact O-N 2.76Å; A649-T653 VanDerWaalsContact O-CB 3.28Å; A649-T653 WeakPolarHBondContact O-CB 3.43Å; A649-T653 VanDerWaalsContact O-CG2 3.23Å; A649-T653 WeakPolarHBondContact O-CG2 3.38Å; A649-T653 PolarHBondContact O-N 3.06Å; A649-T653 PolarHBondContact O-OG1 3.48Å
650	V	87.8	Confident	86.2	Confident	104 Å²	104	87.9 Å²	87.9	63%	0.63	51%	0.514	S	S	*	.	H	α-helix	trans	-65.9	-40.8	175.4	171.4	0	0	0	0	111.3	L646 S647 T653 G654	L646-V650 VanDerWaalsContact O-CG2 3.3Å; L646-V650 WeakPolarHBondContact O-CG2 3.07Å; L646-V650 PolarHBondContact O-N 3.22Å; S647-V650 PolarHBondContact O-N 3.43Å; V650-T653 WeakPolarHBondContact CA-OG1 3.29Å; V650-T653 PolarHBondContact O-OG1 2.93Å; V650-G654 WeakPolarHBondContact O-CA 3.48Å; V650-G654 PolarHBondContact O-N 3.29Å
651	E	81.3	Confident	86.4	Confident	133 Å²	133	88.6 Å²	88.6	62%	0.621	52%	0.515	S	S	*	.	H	α-helix	trans	-66.8	-47.2	176.9	-173.3	179.7	-172.8	0	0	111.5	S647 G654 T655	S647-E651 WeakPolarHBondContact O-CB 3.09Å; S647-E651 PolarHBondContact O-N 3.43Å; E651-G654 PolarHBondContact O-N 3.01Å; E651-T655 WeakPolarHBondContact O-CB 3.47Å; E651-T655 VanDerWaalsContact O-CG2 3.29Å; E651-T655 WeakPolarHBondContact O-CG2 3.45Å; E651-T655 PolarHBondContact O-N 3.19Å; E651-T655 PolarHBondContact O-OG1 2.86Å
652	S	89.4	Confident	86.4	Confident	76 Å²	76	88.3 Å²	88.3	53%	0.531	52%	0.52	S	S	.	.	H	α-helix	trans	-64.4	-44.6	178	179.8	0	0	0	0	112	M648 T655 A656	M648-S652 WeakPolarHBondContact O-CB 3.37Å; M648-S652 PolarHBondContact O-N 3.31Å; S652-T655 PolarHBondContact O-OG1 2.86Å; S652-A656 VanDerWaalsContact O-CB 3.26Å; S652-A656 WeakPolarHBondContact O-CB 3.5Å; S652-A656 PolarHBondContact O-N 3.31Å
653	T	87.2	Confident	86.4	Confident	88 Å²	88	91.3 Å²	91.3	54%	0.54	53%	0.527	S	S	.	.	H	α-helix	trans	-70.1	-36.4	175.6	55.5	0	0	0	0	112	A649 V650 K657	A649-T653 VanDerWaalsContact O-CB 3.28Å; A649-T653 WeakPolarHBondContact O-CB 3.43Å; A649-T653 VanDerWaalsContact O-CG2 3.23Å; A649-T653 WeakPolarHBondContact O-CG2 3.38Å; A649-T653 PolarHBondContact O-N 3.06Å; A649-T653 PolarHBondContact O-OG1 3.48Å; V650-T653 WeakPolarHBondContact CA-OG1 3.29Å; V650-T653 PolarHBondContact O-OG1 2.93Å; T653-K657 WeakPolarHBondContact O-CA 3.48Å; T653-K657 WeakPolarHBondContact O-CB 3.41Å; T653-K657 PolarHBondContact O-N 2.82Å
654	G	88.9	Confident	86.4	Confident	36 Å²	36	88.9 Å²	88.9	37%	0.371	52%	0.523	S	S	.	.	H	α-helix	trans	-65.8	-45.7	177.4	0	0	0	0	0	112.5	V650 E651 A658	V650-G654 WeakPolarHBondContact O-CA 3.48Å; V650-G654 PolarHBondContact O-N 3.29Å; E651-G654 PolarHBondContact O-N 3.01Å; G654-A658 WeakPolarHBondContact O-CB 3.28Å; G654-A658 PolarHBondContact O-N 2.99Å
655	T	85.8	Confident	86.5	Confident	87 Å²	87	87.9 Å²	87.9	53%	0.534	52%	0.519	S	S	.	.	H	α-helix	trans	-64	-49.9	175.7	49.8	0	0	0	0	111.4	E651 S652 K657 A658 E659	E651-T655 WeakPolarHBondContact O-CB 3.47Å; E651-T655 VanDerWaalsContact O-CG2 3.29Å; E651-T655 WeakPolarHBondContact O-CG2 3.45Å; E651-T655 PolarHBondContact O-N 3.19Å; E651-T655 PolarHBondContact O-OG1 2.86Å; S652-T655 PolarHBondContact O-OG1 2.86Å; T655-K657 PolarHBondContact O-N 3.48Å; T655-A658 PolarHBondContact O-N 3.11Å; T655-E659 WeakPolarHBondContact O-CB 3.47Å; T655-E659 PolarHBondContact O-N 3.47Å
656	A	86.1	Confident	86.4	Confident	57 Å²	57	87.8 Å²	87.8	47%	0.471	52%	0.518	S	S	.	.	H	α-helix	trans	-63.5	-40.2	178	0	0	0	0	0	112.5	S652 A660	S652-A656 VanDerWaalsContact O-CB 3.26Å; S652-A656 WeakPolarHBondContact O-CB 3.5Å; S652-A656 PolarHBondContact O-N 3.31Å; A656-A660 WeakPolarHBondContact O-CB 3.45Å; A656-A660 PolarHBondContact O-N 2.66Å
657	K	89	Confident	86.5	Confident	125 Å²	125	85.1 Å²	85.1	54%	0.543	51%	0.512	S	S	.	.	H	α-helix	trans	-68.1	-45	177.2	-177.9	177.8	173.8	-177	0	111.4	T653 T655 E659 A660 E661	T653-K657 WeakPolarHBondContact O-CA 3.48Å; T653-K657 WeakPolarHBondContact O-CB 3.41Å; T653-K657 PolarHBondContact O-N 2.82Å; T655-K657 PolarHBondContact O-N 3.48Å; K657-E659 VanDerWaalsContact C-N 3.34Å; K657-E659 PolarHBondContact O-N 3.45Å; K657-A660 PolarHBondContact O-N 2.82Å; K657-E661 WeakPolarHBondContact CE-OE1 3.21Å; K657-E661 HydrophobicContact CG-CG 4.18Å; K657-E661 IonicContact NZ-OE1 2.85Å; K657-E661 VanDerWaalsContact O-CB 3.29Å; K657-E661 WeakPolarHBondContact O-CB 3.24Å; K657-E661 WeakPolarHBondContact O-CG 3.45Å; K657-E661 PolarHBondContact O-N 2.74Å
658	A	83.4	Confident	86.8	Confident	57 Å²	57	87 Å²	87	47%	0.471	51%	0.508	S	S	.	.	H	α-helix	trans	-62.6	-41.6	177.6	0	0	0	0	0	111.6	G654 T655 S662	G654-A658 WeakPolarHBondContact O-CB 3.28Å; G654-A658 PolarHBondContact O-N 2.99Å; T655-A658 PolarHBondContact O-N 3.11Å; A658-S662 WeakPolarHBondContact O-CB 3.21Å; A658-S662 PolarHBondContact O-N 2.64Å
659	E	81.6	Confident	86.8	Confident	110 Å²	110	85.6 Å²	85.6	51%	0.514	50%	0.502	S	S	.	.	H	α-helix	trans	-66.6	-42.8	175.5	-166.6	-172.3	157.6	0	0	111.6	T655 K657 R663	T655-E659 WeakPolarHBondContact O-CB 3.47Å; T655-E659 PolarHBondContact O-N 3.47Å; K657-E659 VanDerWaalsContact C-N 3.34Å; K657-E659 PolarHBondContact O-N 3.45Å; E659-R663 VanDerWaalsContact O-CB 3.29Å; E659-R663 WeakPolarHBondContact O-CB 3.37Å; E659-R663 PolarHBondContact O-N 3.27Å; E659-R663 IonicContact OE1-CZ 2.73Å; E659-R663 IonicContact OE1-NH1 3.23Å; E659-R663 IonicContact OE1-NH2 3.01Å; E659-R663 PolarHBondContact OE1-NH2 2.78Å
660	A	85.5	Confident	86.7	Confident	54 Å²	54	90.3 Å²	90.3	45%	0.446	52%	0.515	S	S	.	.	H	α-helix	trans	-66.9	-43.2	178	0	0	0	0	0	112.5	A656 K657 R663 A664	A656-A660 WeakPolarHBondContact O-CB 3.45Å; A656-A660 PolarHBondContact O-N 2.66Å; K657-A660 PolarHBondContact O-N 2.82Å; A660-R663 PolarHBondContact O-N 2.9Å; A660-A664 WeakPolarHBondContact O-CB 3.2Å; A660-A664 PolarHBondContact O-N 2.81Å
661	E	88.2	Confident	86.7	Confident	110 Å²	110	86.9 Å²	86.9	51%	0.514	50%	0.5	S	S	.	.	H	α-helix	trans	-65.7	-42.2	175.7	-74.8	179.7	167.2	0	0	110.9	K657 R663 A664 E665	K657-E661 WeakPolarHBondContact CE-OE1 3.21Å; K657-E661 HydrophobicContact CG-CG 4.18Å; K657-E661 IonicContact NZ-OE1 2.85Å; K657-E661 VanDerWaalsContact O-CB 3.29Å; K657-E661 WeakPolarHBondContact O-CB 3.24Å; K657-E661 WeakPolarHBondContact O-CG 3.45Å; K657-E661 PolarHBondContact O-N 2.74Å; E661-R663 PolarHBondContact O-N 2.88Å; E661-A664 PolarHBondContact O-N 2.83Å; E661-E665 WeakPolarHBondContact O-CB 3.39Å; E661-E665 PolarHBondContact O-N 2.95Å
662	S	88.5	Confident	87.1	Confident	81 Å²	81	85.6 Å²	85.6	57%	0.566	49%	0.494	S	S	*	.	H	α-helix	trans	-61.6	-44.7	174.6	179.8	0	0	0	0	111.9	A658 E665 A666	A658-S662 WeakPolarHBondContact O-CB 3.21Å; A658-S662 PolarHBondContact O-N 2.64Å; S662-E665 PolarHBondContact O-N 3.04Å; S662-A666 WeakPolarHBondContact O-CB 3.37Å; S662-A666 PolarHBondContact O-N 3.09Å
663	R	86.4	Confident	87	Confident	161 Å²	161	83.4 Å²	83.4	61%	0.608	48%	0.484	S	S	*	.	H	α-helix	trans	-67.2	-40.7	177.2	-172.9	177.3	-68.8	140.2	5.6	112.1	E659 A660 E661 A667	E659-R663 VanDerWaalsContact O-CB 3.29Å; E659-R663 WeakPolarHBondContact O-CB 3.37Å; E659-R663 PolarHBondContact O-N 3.27Å; E659-R663 IonicContact OE1-CZ 2.73Å; E659-R663 IonicContact OE1-NH1 3.23Å; E659-R663 IonicContact OE1-NH2 3.01Å; E659-R663 PolarHBondContact OE1-NH2 2.78Å; A660-R663 PolarHBondContact O-N 2.9Å; E661-R663 PolarHBondContact O-N 2.88Å; R663-A667 WeakPolarHBondContact O-CB 3.28Å; R663-A667 PolarHBondContact O-N 2.85Å
664	A	87.9	Confident	87	Confident	62 Å²	62	82.1 Å²	82.1	51%	0.512	48%	0.478	S	S	.	.	H	α-helix	trans	-66.2	-40.4	176.9	0	0	0	0	0	111.6	A660 E661 A667 R668	A660-A664 WeakPolarHBondContact O-CB 3.2Å; A660-A664 PolarHBondContact O-N 2.81Å; E661-A664 PolarHBondContact O-N 2.83Å; A664-A667 PolarHBondContact O-N 2.96Å; A664-R668 WeakPolarHBondContact O-CB 3.15Å; A664-R668 PolarHBondContact O-N 3.04Å
665	E	84.5	Confident	87.1	Confident	80 Å²	80	85 Å²	85	37%	0.374	49%	0.489	S	S	.	.	H	α-helix	trans	-68.9	-41.3	177.5	-175.7	60.3	-167	0	0	111.7	E661 S662 A667 R668 I669	E661-E665 WeakPolarHBondContact O-CB 3.39Å; E661-E665 PolarHBondContact O-N 2.95Å; S662-E665 PolarHBondContact O-N 3.04Å; E665-A667 VanDerWaalsContact C-N 3.35Å; E665-A667 PolarHBondContact O-N 2.9Å; E665-R668 WeakPolarHBondContact O-CB 3.28Å; E665-R668 PolarHBondContact O-N 2.73Å; E665-R668 IonicContact OE1-CZ 3.17Å; E665-R668 IonicContact OE1-NE 2.77Å; E665-R668 PolarHBondContact OE1-NE 3.02Å; E665-R668 IonicContact OE1-NH2 3.77Å; E665-R668 PolarHBondContact OE1-NH2 2.87Å; E665-R668 IonicContact OE2-CZ 3.88Å; E665-R668 IonicContact OE2-NE 3.57Å; E665-R668 PolarHBondContact OE2-NE 2.82Å; E665-R668 IonicContact OE2-NH2 2.86Å; E665-I669 HydrophobicContact CG-CD1 4.42Å; E665-I669 WeakPolarHBondContact O-CG1 3.44Å; E665-I669 PolarHBondContact O-N 2.81Å
666	A	86.7	Confident	87.1	Confident	56 Å²	56	86.1 Å²	86.1	46%	0.463	49%	0.491	S	S	.	.	H	α-helix	trans	-58.4	-46.7	171.5	0	0	0	0	0	111.4	S662 R668 I669 E670	S662-A666 WeakPolarHBondContact O-CB 3.37Å; S662-A666 PolarHBondContact O-N 3.09Å; A666-R668 VanDerWaalsContact C-N 3.33Å; A666-R668 PolarHBondContact O-N 2.99Å; A666-I669 PolarHBondContact O-N 2.93Å; A666-E670 WeakPolarHBondContact O-CB 3.35Å; A666-E670 PolarHBondContact O-N 3.45Å
667	A	89.1	Confident	87.2	Confident	56 Å²	56	89 Å²	89	46%	0.463	49%	0.494	S	S	.	.	H	α-helix	trans	-66.5	-32.3	176.4	0	0	0	0	0	112.8	R663 A664 E665 G671	R663-A667 WeakPolarHBondContact O-CB 3.28Å; R663-A667 PolarHBondContact O-N 2.85Å; A664-A667 PolarHBondContact O-N 2.96Å; E665-A667 VanDerWaalsContact C-N 3.35Å; E665-A667 PolarHBondContact O-N 2.9Å; A667-G671 PolarHBondContact O-N 3.02Å
668	R	91	Very high	87.2	Confident	116 Å²	116	85.8 Å²	85.8	44%	0.438	49%	0.491	S	S	.	.	H	α-helix	trans	-64.8	-47.2	174.6	-172.5	-176.5	73.3	85.6	-1.1	110.8	A664 E665 A666 G671 E672	A664-R668 WeakPolarHBondContact O-CB 3.15Å; A664-R668 PolarHBondContact O-N 3.04Å; E665-R668 WeakPolarHBondContact O-CB 3.28Å; E665-R668 PolarHBondContact O-N 2.73Å; E665-R668 IonicContact OE1-CZ 3.17Å; E665-R668 IonicContact OE1-NE 2.77Å; E665-R668 PolarHBondContact OE1-NE 3.02Å; E665-R668 IonicContact OE1-NH2 3.77Å; E665-R668 PolarHBondContact OE1-NH2 2.87Å; E665-R668 IonicContact OE2-CZ 3.88Å; E665-R668 IonicContact OE2-NE 3.57Å; E665-R668 PolarHBondContact OE2-NE 2.82Å; E665-R668 IonicContact OE2-NH2 2.86Å; A666-R668 VanDerWaalsContact C-N 3.33Å; A666-R668 PolarHBondContact O-N 2.99Å; R668-G671 PolarHBondContact O-N 3.43Å; R668-E672 IonicContact CZ-OE1 2.87Å; R668-E672 VanDerWaalsContact NH1-CD 3.26Å; R668-E672 IonicContact NH1-OE1 3.85Å; R668-E672 PolarHBondContact NH1-OE1 2.85Å; R668-E672 IonicContact NH1-OE2 3.73Å; R668-E672 PolarHBondContact NH1-OE2 3.3Å; R668-E672 VanDerWaalsContact NH1-OE2 3.17Å; R668-E672 WeakPolarHBondContact O-CB 3.49Å; R668-E672 WeakPolarHBondContact O-CG 3.47Å; R668-E672 PolarHBondContact O-N 3.47Å
669	I	87.5	Confident	87.4	Confident	99 Å²	99	89.5 Å²	89.5	51%	0.508	50%	0.497	S	S	.	.	H	α-helix	trans	-63.9	-43.1	177.4	-66.6	170.2	0	0	0	110.5	E665 A666 G671 E672 G673	E665-I669 HydrophobicContact CG-CD1 4.42Å; E665-I669 WeakPolarHBondContact O-CG1 3.44Å; E665-I669 PolarHBondContact O-N 2.81Å; A666-I669 PolarHBondContact O-N 2.93Å; I669-G671 VanDerWaalsContact C-N 3.35Å; I669-E672 PolarHBondContact O-N 3.29Å; I669-G673 PolarHBondContact O-N 2.8Å
670	E	84.6	Confident	87.7	Confident	149 Å²	149	89 Å²	89	70%	0.696	50%	0.497	S	S	*	.	H	α-helix	trans	-63.1	-41.8	175.4	-170.5	175.8	-171.9	0	0	111.6	A666 G673 S674	A666-E670 WeakPolarHBondContact O-CB 3.35Å; A666-E670 PolarHBondContact O-N 3.45Å; E670-G673 PolarHBondContact O-N 2.79Å; E670-S674 VanDerWaalsContact O-CB 3.3Å; E670-S674 WeakPolarHBondContact O-CB 3.33Å; E670-S674 PolarHBondContact O-N 3.09Å; E670-S674 PolarHBondContact O-OG 3.35Å
671	G	88.9	Confident	87.9	Confident	31 Å²	31	93.1 Å²	93.1	32%	0.32	51%	0.505	S	S	.	.	H	α-helix	trans	-61.2	-52.1	174.7	0	0	0	0	0	112.6	A667 R668 I669 G673 S674 V675	A667-G671 PolarHBondContact O-N 3.02Å; R668-G671 PolarHBondContact O-N 3.43Å; I669-G671 VanDerWaalsContact C-N 3.35Å; G671-G673 VanDerWaalsContact C-N 3.32Å; G671-G673 PolarHBondContact O-N 3.42Å; G671-S674 PolarHBondContact O-N 3.39Å; G671-S674 PolarHBondContact O-OG 3.43Å; G671-V675 WeakPolarHBondContact O-CG2 3.41Å; G671-V675 PolarHBondContact O-N 3.49Å
672	E	88.1	Confident	87.9	Confident	106 Å²	106	90.5 Å²	90.5	50%	0.495	50%	0.502	S	S	.	.	H	α-helix	trans	-60.9	-41.8	176.7	-73.8	175.2	-175.2	0	0	111.6	R668 I669 V675 L676	R668-E672 IonicContact CZ-OE1 2.87Å; R668-E672 VanDerWaalsContact NH1-CD 3.26Å; R668-E672 IonicContact NH1-OE1 3.85Å; R668-E672 PolarHBondContact NH1-OE1 2.85Å; R668-E672 IonicContact NH1-OE2 3.73Å; R668-E672 PolarHBondContact NH1-OE2 3.3Å; R668-E672 VanDerWaalsContact NH1-OE2 3.17Å; R668-E672 WeakPolarHBondContact O-CB 3.49Å; R668-E672 WeakPolarHBondContact O-CG 3.47Å; R668-E672 PolarHBondContact O-N 3.47Å; I669-E672 PolarHBondContact O-N 3.29Å; E672-V675 PolarHBondContact O-N 3.07Å; E672-L676 WeakPolarHBondContact O-CB 3.23Å; E672-L676 PolarHBondContact O-N 3.28Å
673	G	88.1	Confident	87.8	Confident	30 Å²	30	91.4 Å²	91.4	31%	0.309	50%	0.497	S	S	.	.	H	α-helix	trans	-61	-44.5	173.6	0	0	0	0	0	112.4	I669 E670 G671 L676 Q677	I669-G673 PolarHBondContact O-N 2.8Å; E670-G673 PolarHBondContact O-N 2.79Å; G671-G673 VanDerWaalsContact C-N 3.32Å; G671-G673 PolarHBondContact O-N 3.42Å; G673-L676 PolarHBondContact O-N 2.91Å; G673-Q677 WeakPolarHBondContact O-CB 3.3Å; G673-Q677 VanDerWaalsContact O-CG 3.28Å; G673-Q677 WeakPolarHBondContact O-CG 3.37Å; G673-Q677 PolarHBondContact O-N 3.03Å
674	S	88.1	Confident	87.7	Confident	61 Å²	61	86.5 Å²	86.5	43%	0.427	49%	0.491	S	S	.	.	H	α-helix	trans	-65	-39.4	178.4	76.7	0	0	0	0	112.3	E670 G671 Q677 A678	E670-S674 VanDerWaalsContact O-CB 3.3Å; E670-S674 WeakPolarHBondContact O-CB 3.33Å; E670-S674 PolarHBondContact O-N 3.09Å; E670-S674 PolarHBondContact O-OG 3.35Å; G671-S674 PolarHBondContact O-N 3.39Å; G671-S674 PolarHBondContact O-OG 3.43Å; S674-Q677 PolarHBondContact O-N 3.32Å; S674-A678 VanDerWaalsContact O-CB 3.23Å; S674-A678 WeakPolarHBondContact O-CB 3.45Å; S674-A678 PolarHBondContact O-N 2.84Å
675	V	89.5	Confident	87.9	Confident	98 Å²	98	88.3 Å²	88.3	59%	0.594	49%	0.492	S	S	*	.	H	α-helix	trans	-65.8	-43.7	175.5	171.1	0	0	0	0	110.6	G671 E672 A678 K679	G671-V675 WeakPolarHBondContact O-CG2 3.41Å; G671-V675 PolarHBondContact O-N 3.49Å; E672-V675 PolarHBondContact O-N 3.07Å; V675-A678 PolarHBondContact O-N 3.41Å; V675-K679 WeakPolarHBondContact O-CB 3.25Å; V675-K679 PolarHBondContact O-N 2.88Å
676	L	86.6	Confident	88.1	Confident	109 Å²	109	87 Å²	87	57%	0.571	49%	0.494	S	S	*	.	H	α-helix	trans	-66.8	-42.5	178.7	-167.5	132.5	0	0	0	111.4	E672 G673 K679 L680	E672-L676 WeakPolarHBondContact O-CB 3.23Å; E672-L676 PolarHBondContact O-N 3.28Å; G673-L676 PolarHBondContact O-N 2.91Å; L676-K679 PolarHBondContact O-N 2.79Å; L676-L680 HydrophobicContact CD2-CD1 3.69Å; L676-L680 HydrophobicContact CD2-CG 4.4Å; L676-L680 WeakPolarHBondContact O-CG 3.47Å; L676-L680 PolarHBondContact O-N 3.45Å
677	Q	88.2	Confident	88.2	Confident	118 Å²	118	90.2 Å²	90.2	55%	0.551	50%	0.503	S	S	*	.	H	α-helix	trans	-61.3	-43.9	172.4	-76.2	-179.8	10.3	0	0	112	G673 S674 K679 L680 K681	G673-Q677 WeakPolarHBondContact O-CB 3.3Å; G673-Q677 VanDerWaalsContact O-CG 3.28Å; G673-Q677 WeakPolarHBondContact O-CG 3.37Å; G673-Q677 PolarHBondContact O-N 3.03Å; S674-Q677 PolarHBondContact O-N 3.32Å; Q677-K679 VanDerWaalsContact C-N 3.32Å; Q677-K679 PolarHBondContact O-N 2.85Å; Q677-L680 PolarHBondContact O-N 2.88Å; Q677-K681 WeakPolarHBondContact O-CB 3.44Å; Q677-K681 WeakPolarHBondContact O-CG 3.48Å; Q677-K681 PolarHBondContact O-N 3.3Å
678	A	88.1	Confident	88	Confident	57 Å²	57	93.5 Å²	93.5	47%	0.471	51%	0.508	S	S	.	.	H	α-helix	trans	-63.4	-39.2	176.7	0	0	0	0	0	111.4	S674 V675 K681 A682	S674-A678 VanDerWaalsContact O-CB 3.23Å; S674-A678 WeakPolarHBondContact O-CB 3.45Å; S674-A678 PolarHBondContact O-N 2.84Å; V675-A678 PolarHBondContact O-N 3.41Å; A678-K681 PolarHBondContact O-N 2.8Å; A678-A682 VanDerWaalsContact O-CB 3.22Å; A678-A682 WeakPolarHBondContact O-CB 3.18Å; A678-A682 PolarHBondContact O-N 3.38Å
679	K	88.7	Confident	87.9	Confident	136 Å²	136	91.8 Å²	91.8	59%	0.591	51%	0.511	S	S	*	.	H	α-helix	trans	-65.7	-44.9	176	-169.8	175.2	-176.6	177.7	0	111.9	V675 L676 Q677 A682 Q683	V675-K679 WeakPolarHBondContact O-CB 3.25Å; V675-K679 PolarHBondContact O-N 2.88Å; L676-K679 PolarHBondContact O-N 2.79Å; Q677-K679 VanDerWaalsContact C-N 3.32Å; Q677-K679 PolarHBondContact O-N 2.85Å; K679-A682 PolarHBondContact O-N 3.09Å; K679-Q683 WeakPolarHBondContact O-CB 3.39Å; K679-Q683 VanDerWaalsContact O-CG 3.32Å; K679-Q683 WeakPolarHBondContact O-CG 3.34Å; K679-Q683 PolarHBondContact O-N 3.39Å
680	L	88.1	Confident	88.1	Confident	98 Å²	98	91.7 Å²	91.7	51%	0.513	51%	0.508	S	S	.	.	H	α-helix	trans	-65.9	-41.4	176.2	-71.8	174.2	0	0	0	111.7	L676 Q677 Q683 A684	L676-L680 HydrophobicContact CD2-CD1 3.69Å; L676-L680 HydrophobicContact CD2-CG 4.4Å; L676-L680 WeakPolarHBondContact O-CG 3.47Å; L676-L680 PolarHBondContact O-N 3.45Å; Q677-L680 PolarHBondContact O-N 2.88Å; L680-Q683 PolarHBondContact O-N 3.47Å; L680-A684 WeakPolarHBondContact O-CB 3.47Å; L680-A684 PolarHBondContact O-N 2.96Å
681	K	89.1	Confident	88.2	Confident	141 Å²	141	87.2 Å²	87.2	61%	0.613	50%	0.497	S	S	*	.	H	α-helix	trans	-62.8	-42.7	173.1	-79.1	-178.5	178.1	177.9	0	111.8	Q677 A678 Q683 A684 L685	Q677-K681 WeakPolarHBondContact O-CB 3.44Å; Q677-K681 WeakPolarHBondContact O-CG 3.48Å; Q677-K681 PolarHBondContact O-N 3.3Å; A678-K681 PolarHBondContact O-N 2.8Å; K681-Q683 VanDerWaalsContact C-N 3.33Å; K681-Q683 PolarHBondContact O-N 2.83Å; K681-A684 PolarHBondContact O-N 3.14Å; K681-L685 VanDerWaalsContact O-CB 3.3Å; K681-L685 WeakPolarHBondContact O-CB 3.4Å; K681-L685 VanDerWaalsContact O-CG 3.3Å; K681-L685 WeakPolarHBondContact O-CG 3.36Å; K681-L685 PolarHBondContact O-N 2.89Å
682	A	89	Confident	88.1	Confident	56 Å²	56	90.6 Å²	90.6	46%	0.463	50%	0.504	S	S	.	.	H	α-helix	trans	-64.1	-38.9	176.1	0	0	0	0	0	111.7	A678 K679 A686	A678-A682 VanDerWaalsContact O-CB 3.22Å; A678-A682 WeakPolarHBondContact O-CB 3.18Å; A678-A682 PolarHBondContact O-N 3.38Å; K679-A682 PolarHBondContact O-N 3.09Å; A682-A686 WeakPolarHBondContact O-CB 3.3Å; A682-A686 PolarHBondContact O-N 3.44Å
683	Q	85.6	Confident	88.2	Confident	100 Å²	100	89.7 Å²	89.7	47%	0.467	50%	0.502	S	S	.	.	H	α-helix	trans	-66.7	-43.8	173.9	-75.1	176.3	-15.7	0	0	112.1	K679 L680 K681 A686 I687	K679-Q683 WeakPolarHBondContact O-CB 3.39Å; K679-Q683 VanDerWaalsContact O-CG 3.32Å; K679-Q683 WeakPolarHBondContact O-CG 3.34Å; K679-Q683 PolarHBondContact O-N 3.39Å; L680-Q683 PolarHBondContact O-N 3.47Å; K681-Q683 VanDerWaalsContact C-N 3.33Å; K681-Q683 PolarHBondContact O-N 2.83Å; Q683-A686 PolarHBondContact O-N 3.43Å; Q683-I687 VanDerWaalsContact O-CG1 3.28Å; Q683-I687 WeakPolarHBondContact O-CG1 3.39Å; Q683-I687 PolarHBondContact O-N 2.97Å
684	A	85.1	Confident	88.1	Confident	58 Å²	58	93 Å²	93	48%	0.479	51%	0.51	S	S	.	.	H	α-helix	trans	-61.3	-48.1	175.9	0	0	0	0	0	111.2	L680 K681 A686 I687 E688	L680-A684 WeakPolarHBondContact O-CB 3.47Å; L680-A684 PolarHBondContact O-N 2.96Å; K681-A684 PolarHBondContact O-N 3.14Å; A684-A686 VanDerWaalsContact C-N 3.33Å; A684-A686 PolarHBondContact O-N 3.27Å; A684-I687 PolarHBondContact O-N 2.93Å; A684-E688 WeakPolarHBondContact O-CB 3.49Å; A684-E688 PolarHBondContact O-N 3.17Å
685	L	90.4	Very high	88.2	Confident	99 Å²	99	97.8 Å²	97.8	52%	0.518	52%	0.518	S	S	.	.	H	α-helix	trans	-62.9	-37.7	175.2	-75.1	167.4	0	0	0	111.9	K681 E688 T689	K681-L685 VanDerWaalsContact O-CB 3.3Å; K681-L685 WeakPolarHBondContact O-CB 3.4Å; K681-L685 VanDerWaalsContact O-CG 3.3Å; K681-L685 WeakPolarHBondContact O-CG 3.36Å; K681-L685 PolarHBondContact O-N 2.89Å; L685-E688 PolarHBondContact O-N 3.49Å; L685-T689 VanDerWaalsContact O-CB 3.29Å; L685-T689 WeakPolarHBondContact O-CB 3.44Å; L685-T689 VanDerWaalsContact O-CG2 3.22Å; L685-T689 WeakPolarHBondContact O-CG2 3.48Å; L685-T689 PolarHBondContact O-N 2.77Å; L685-T689 PolarHBondContact O-OG1 3.48Å
686	A	89.8	Confident	88.3	Confident	52 Å²	52	96.2 Å²	96.2	43%	0.43	51%	0.509	S	S	.	.	H	α-helix	trans	-65.1	-41.7	175.9	0	0	0	0	0	111.6	A682 Q683 A684 T689 E690	A682-A686 WeakPolarHBondContact O-CB 3.3Å; A682-A686 PolarHBondContact O-N 3.44Å; Q683-A686 PolarHBondContact O-N 3.43Å; A684-A686 VanDerWaalsContact C-N 3.33Å; A684-A686 PolarHBondContact O-N 3.27Å; A686-T689 WeakPolarHBondContact CA-OG1 3.48Å; A686-T689 PolarHBondContact O-OG1 3.4Å; A686-T689 VanDerWaalsContact O-OG1 3.13Å; A686-E690 WeakPolarHBondContact O-CB 3.5Å; A686-E690 PolarHBondContact O-N 3.44Å
687	I	87.9	Confident	88.4	Confident	124 Å²	124	96 Å²	96	64%	0.636	51%	0.505	S	S	*	.	H	α-helix	trans	-66.4	-44.4	176.4	-68.3	165.4	0	0	0	110.5	Q683 A684 E690 A691	Q683-I687 VanDerWaalsContact O-CG1 3.28Å; Q683-I687 WeakPolarHBondContact O-CG1 3.39Å; Q683-I687 PolarHBondContact O-N 2.97Å; A684-I687 PolarHBondContact O-N 2.93Å; I687-E690 PolarHBondContact O-N 2.87Å; I687-A691 WeakPolarHBondContact O-CB 3.13Å; I687-A691 PolarHBondContact O-N 2.89Å
688	E	86.3	Confident	88.4	Confident	125 Å²	125	97.3 Å²	97.3	58%	0.584	51%	0.509	S	S	*	.	H	α-helix	trans	-62.1	-48.1	177.9	-173.3	175.7	-167.4	0	0	111.4	A684 L685 A691 E692	A684-E688 WeakPolarHBondContact O-CB 3.49Å; A684-E688 PolarHBondContact O-N 3.17Å; L685-E688 PolarHBondContact O-N 3.49Å; E688-A691 PolarHBondContact O-N 3.06Å; E688-E692 WeakPolarHBondContact O-CB 3.39Å; E688-E692 PolarHBondContact O-N 2.91Å
689	T	89.1	Confident	88.5	Confident	80 Å²	80	97.9 Å²	97.9	49%	0.491	51%	0.507	S	S	.	.	H	α-helix	trans	-67.2	-36.5	178.5	52.1	0	0	0	0	112.7	L685 A686 E692 L693	L685-T689 VanDerWaalsContact O-CB 3.29Å; L685-T689 WeakPolarHBondContact O-CB 3.44Å; L685-T689 VanDerWaalsContact O-CG2 3.22Å; L685-T689 WeakPolarHBondContact O-CG2 3.48Å; L685-T689 PolarHBondContact O-N 2.77Å; L685-T689 PolarHBondContact O-OG1 3.48Å; A686-T689 WeakPolarHBondContact CA-OG1 3.48Å; A686-T689 PolarHBondContact O-OG1 3.4Å; A686-T689 VanDerWaalsContact O-OG1 3.13Å; T689-E692 PolarHBondContact O-N 3.27Å; T689-L693 VanDerWaalsContact O-CB 3.31Å; T689-L693 WeakPolarHBondContact O-CB 3.35Å; T689-L693 PolarHBondContact O-N 3.45Å
690	E	90.6	Very high	88.4	Confident	97 Å²	97	99 Å²	99	45%	0.453	51%	0.507	S	S	.	.	H	α-helix	trans	-66.3	-44	174.6	-178.4	60.6	-147.4	0	0	111.3	A686 I687 E692 L693 Q694	A686-E690 WeakPolarHBondContact O-CB 3.5Å; A686-E690 PolarHBondContact O-N 3.44Å; I687-E690 PolarHBondContact O-N 2.87Å; E690-E692 VanDerWaalsContact C-N 3.31Å; E690-E692 PolarHBondContact O-N 2.78Å; E690-L693 PolarHBondContact O-N 2.94Å; E690-Q694 VanDerWaalsContact O-CG 3.3Å; E690-Q694 WeakPolarHBondContact O-CG 3.48Å; E690-Q694 PolarHBondContact O-N 3.49Å; E690-Q694 PolarHBondContact OE1-NE2 2.85Å
691	A	86.7	Confident	88.4	Confident	55 Å²	55	100.5 Å²	100.5	46%	0.455	51%	0.511	S	S	.	.	H	α-helix	trans	-63.1	-39.2	174.8	0	0	0	0	0	111.6	I687 E688 Q694 R695	I687-A691 WeakPolarHBondContact O-CB 3.13Å; I687-A691 PolarHBondContact O-N 2.89Å; E688-A691 PolarHBondContact O-N 3.06Å; A691-Q694 PolarHBondContact O-N 3.38Å; A691-R695 WeakPolarHBondContact O-CB 3.28Å; A691-R695 PolarHBondContact O-N 2.97Å
692	E	87.4	Confident	88.4	Confident	102 Å²	102	99.7 Å²	99.7	48%	0.477	51%	0.513	S	S	.	.	H	α-helix	trans	-68.4	-40.6	176.5	-164.2	168.4	-151.6	0	0	111.9	E688 T689 E690 Q694 R695 V696	E688-E692 WeakPolarHBondContact O-CB 3.39Å; E688-E692 PolarHBondContact O-N 2.91Å; T689-E692 PolarHBondContact O-N 3.27Å; E690-E692 VanDerWaalsContact C-N 3.31Å; E690-E692 PolarHBondContact O-N 2.78Å; E692-Q694 PolarHBondContact O-N 2.65Å; E692-R695 WeakPolarHBondContact O-CB 3.49Å; E692-R695 PolarHBondContact O-N 3.25Å; E692-V696 VanDerWaalsContact O-CG2 3.3Å; E692-V696 WeakPolarHBondContact O-CG2 3.4Å; E692-V696 PolarHBondContact O-N 2.69Å
693	L	89.4	Confident	88.3	Confident	87 Å²	87	101.4 Å²	101.4	46%	0.455	51%	0.512	S	S	.	.	H	α-helix	trans	-60.3	-46	173.8	-169.1	95.2	0	0	0	111	T689 E690 R695 V696 Q697	T689-L693 VanDerWaalsContact O-CB 3.31Å; T689-L693 WeakPolarHBondContact O-CB 3.35Å; T689-L693 PolarHBondContact O-N 3.45Å; E690-L693 PolarHBondContact O-N 2.94Å; L693-R695 VanDerWaalsContact C-N 3.31Å; L693-R695 PolarHBondContact O-N 2.8Å; L693-V696 PolarHBondContact O-N 3.09Å; L693-Q697 HydrophobicContact CG-CG 4.49Å; L693-Q697 WeakPolarHBondContact O-CB 3.26Å; L693-Q697 WeakPolarHBondContact O-CG 3.36Å; L693-Q697 PolarHBondContact O-N 2.9Å
694	Q	86.7	Confident	88.5	Confident	100 Å²	100	102.1 Å²	102.1	47%	0.467	52%	0.518	S	S	.	.	H	α-helix	trans	-62.6	-39.3	177.3	-72.8	176.5	12.5	0	0	111.8	E690 A691 E692 K698	E690-Q694 VanDerWaalsContact O-CG 3.3Å; E690-Q694 WeakPolarHBondContact O-CG 3.48Å; E690-Q694 PolarHBondContact O-N 3.49Å; E690-Q694 PolarHBondContact OE1-NE2 2.85Å; A691-Q694 PolarHBondContact O-N 3.38Å; E692-Q694 PolarHBondContact O-N 2.65Å; Q694-K698 WeakPolarHBondContact O-CG 3.47Å; Q694-K698 PolarHBondContact O-N 3.1Å
695	R	90.8	Very high	88.7	Confident	161 Å²	161	104.1 Å²	104.1	61%	0.608	52%	0.524	S	S	*	.	H	α-helix	trans	-61.9	-48.4	173.7	-168	-174.7	74.6	113.5	-2.9	110.8	A691 E692 L693 K698 V699	A691-R695 WeakPolarHBondContact O-CB 3.28Å; A691-R695 PolarHBondContact O-N 2.97Å; E692-R695 WeakPolarHBondContact O-CB 3.49Å; E692-R695 PolarHBondContact O-N 3.25Å; L693-R695 VanDerWaalsContact C-N 3.31Å; L693-R695 PolarHBondContact O-N 2.8Å; R695-K698 PolarHBondContact O-N 2.87Å; R695-V699 VanDerWaalsContact O-CG2 3.32Å; R695-V699 WeakPolarHBondContact O-CG2 3.4Å; R695-V699 PolarHBondContact O-N 2.91Å
696	V	90.6	Very high	88.7	Confident	65 Å²	65	107 Å²	107	39%	0.394	53%	0.529	S	S	.	.	H	α-helix	trans	-65.3	-41.3	179.8	172.4	0	0	0	0	111.4	E692 L693 V699 R700	E692-V696 VanDerWaalsContact O-CG2 3.3Å; E692-V696 WeakPolarHBondContact O-CG2 3.4Å; E692-V696 PolarHBondContact O-N 2.69Å; L693-V696 PolarHBondContact O-N 3.09Å; V696-V699 PolarHBondContact O-N 2.92Å; V696-R700 HydrophobicContact CG1-CG 4.23Å; V696-R700 WeakPolarHBondContact O-CB 3.08Å; V696-R700 WeakPolarHBondContact O-CG 3.31Å; V696-R700 PolarHBondContact O-N 3.29Å
697	Q	89.1	Confident	88.6	Confident	104 Å²	104	107 Å²	107	49%	0.486	53%	0.529	S	S	.	.	H	α-helix	trans	-59.7	-48.2	176.1	-81.3	-178.7	-9	0	0	111.3	L693 V699 R700 E701	L693-Q697 HydrophobicContact CG-CG 4.49Å; L693-Q697 WeakPolarHBondContact O-CB 3.26Å; L693-Q697 WeakPolarHBondContact O-CG 3.36Å; L693-Q697 PolarHBondContact O-N 2.9Å; Q697-V699 VanDerWaalsContact C-N 3.34Å; Q697-V699 PolarHBondContact O-N 2.92Å; Q697-R700 PolarHBondContact O-N 3.36Å; Q697-E701 WeakPolarHBondContact O-CB 3.3Å; Q697-E701 WeakPolarHBondContact O-CG 3.4Å; Q697-E701 PolarHBondContact O-N 2.74Å
698	K	88.3	Confident	88.7	Confident	147 Å²	147	109.8 Å²	109.8	64%	0.639	53%	0.532	S	S	*	.	H	α-helix	trans	-61.8	-41	176.9	-74.6	-167.7	178.8	-177	0	112.6	Q694 R695 L702	Q694-K698 WeakPolarHBondContact O-CG 3.47Å; Q694-K698 PolarHBondContact O-N 3.1Å; R695-K698 PolarHBondContact O-N 2.87Å; K698-L702 VanDerWaalsContact O-CG 3.28Å; K698-L702 WeakPolarHBondContact O-CG 3.32Å; K698-L702 PolarHBondContact O-N 2.89Å
699	V	90.6	Very high	88.7	Confident	69 Å²	69	106.5 Å²	106.5	42%	0.418	53%	0.526	S	S	.	.	H	α-helix	trans	-62.4	-46.3	175.3	171.7	0	0	0	0	110.5	R695 V696 Q697 L702 E703	R695-V699 VanDerWaalsContact O-CG2 3.32Å; R695-V699 WeakPolarHBondContact O-CG2 3.4Å; R695-V699 PolarHBondContact O-N 2.91Å; V696-V699 PolarHBondContact O-N 2.92Å; Q697-V699 VanDerWaalsContact C-N 3.34Å; Q697-V699 PolarHBondContact O-N 2.92Å; V699-L702 PolarHBondContact O-N 2.93Å; V699-E703 WeakPolarHBondContact O-CG 3.46Å; V699-E703 PolarHBondContact O-N 2.7Å
700	R	86.6	Confident	88.8	Confident	158 Å²	158	106.7 Å²	106.7	60%	0.596	52%	0.521	S	S	*	.	H	α-helix	trans	-66.2	-38.9	178.8	-74	-59.8	-171.1	-174.4	1.6	112.9	V696 Q697 L702 E703 L704	V696-R700 HydrophobicContact CG1-CG 4.23Å; V696-R700 WeakPolarHBondContact O-CB 3.08Å; V696-R700 WeakPolarHBondContact O-CG 3.31Å; V696-R700 PolarHBondContact O-N 3.29Å; Q697-R700 PolarHBondContact O-N 3.36Å; R700-L702 VanDerWaalsContact C-N 3.35Å; R700-E703 VanDerWaalsContact CD-OE2 3.31Å; R700-E703 WeakPolarHBondContact CD-OE2 3.41Å; R700-E703 IonicContact CZ-OE2 2.66Å; R700-E703 IonicContact NE-OE2 2.65Å; R700-E703 IonicContact NH1-OE2 3.05Å; R700-E703 PolarHBondContact NH1-OE2 2.9Å; R700-E703 PolarHBondContact O-N 2.87Å; R700-L704 VanDerWaalsContact O-CB 3.3Å; R700-L704 WeakPolarHBondContact O-CB 3.27Å; R700-L704 PolarHBondContact O-N 3.4Å
701	E	87.7	Confident	88.7	Confident	130 Å²	130	107.2 Å²	107.2	61%	0.607	53%	0.527	S	S	*	.	H	α-helix	trans	-61	-44.8	174.1	-79.4	-175.9	162	0	0	111.3	Q697 L704 V705	Q697-E701 WeakPolarHBondContact O-CB 3.3Å; Q697-E701 WeakPolarHBondContact O-CG 3.4Å; Q697-E701 PolarHBondContact O-N 2.74Å; E701-L704 PolarHBondContact O-N 3.09Å; E701-V705 WeakPolarHBondContact O-CB 3.44Å; E701-V705 VanDerWaalsContact O-CG2 3.28Å; E701-V705 WeakPolarHBondContact O-CG2 3.35Å; E701-V705 PolarHBondContact O-N 2.87Å
702	L	88.1	Confident	88.8	Confident	125 Å²	125	111.2 Å²	111.2	65%	0.654	54%	0.536	S	S	*	.	H	α-helix	trans	-63.5	-43.2	176.1	-70.9	171	0	0	0	111.9	K698 V699 R700 L704 V705 Y706	K698-L702 VanDerWaalsContact O-CG 3.28Å; K698-L702 WeakPolarHBondContact O-CG 3.32Å; K698-L702 PolarHBondContact O-N 2.89Å; V699-L702 PolarHBondContact O-N 2.93Å; R700-L702 VanDerWaalsContact C-N 3.35Å; L702-L704 VanDerWaalsContact C-N 3.33Å; L702-L704 PolarHBondContact O-N 3.2Å; L702-V705 PolarHBondContact O-N 3.49Å; L702-Y706 WeakPolarHBondContact O-CB 3.27Å; L702-Y706 PolarHBondContact O-N 3.23Å
703	E	88.1	Confident	88.8	Confident	92 Å²	92	112.3 Å²	112.3	43%	0.43	54%	0.544	S	S	.	.	H	α-helix	trans	-61.6	-40.6	174.1	-76.5	-179.9	175.7	0	0	112.1	V699 R700 Y706 A707	V699-E703 WeakPolarHBondContact O-CG 3.46Å; V699-E703 PolarHBondContact O-N 2.7Å; R700-E703 VanDerWaalsContact CD-OE2 3.31Å; R700-E703 WeakPolarHBondContact CD-OE2 3.41Å; R700-E703 IonicContact CZ-OE2 2.66Å; R700-E703 IonicContact NE-OE2 2.65Å; R700-E703 IonicContact NH1-OE2 3.05Å; R700-E703 PolarHBondContact NH1-OE2 2.9Å; R700-E703 PolarHBondContact O-N 2.87Å; E703-Y706 PolarHBondContact O-N 3.14Å; E703-A707 VanDerWaalsContact O-CB 3.25Å; E703-A707 WeakPolarHBondContact O-CB 3.32Å; E703-A707 PolarHBondContact O-N 3.42Å
704	L	88.8	Confident	88.7	Confident	114 Å²	114	113.2 Å²	113.2	60%	0.597	55%	0.546	S	S	*	.	H	α-helix	trans	-69.3	-41	180	-144.8	170	0	0	0	110.8	R700 E701 L702 A707 R708	R700-L704 VanDerWaalsContact O-CB 3.3Å; R700-L704 WeakPolarHBondContact O-CB 3.27Å; R700-L704 PolarHBondContact O-N 3.4Å; E701-L704 PolarHBondContact O-N 3.09Å; L702-L704 VanDerWaalsContact C-N 3.33Å; L702-L704 PolarHBondContact O-N 3.2Å; L704-A707 PolarHBondContact O-N 2.95Å; L704-R708 VanDerWaalsContact O-CB 3.23Å; L704-R708 WeakPolarHBondContact O-CB 3.43Å; L704-R708 PolarHBondContact O-N 3.49Å
705	V	90.8	Very high	88.9	Confident	100 Å²	100	112.1 Å²	112.1	61%	0.606	55%	0.546	S	S	*	.	H	α-helix	trans	-61.3	-45.5	172.9	170.2	0	0	0	0	110.6	E701 L702 R708 A709	E701-V705 WeakPolarHBondContact O-CB 3.44Å; E701-V705 VanDerWaalsContact O-CG2 3.28Å; E701-V705 WeakPolarHBondContact O-CG2 3.35Å; E701-V705 PolarHBondContact O-N 2.87Å; L702-V705 PolarHBondContact O-N 3.49Å; V705-R708 PolarHBondContact O-N 2.86Å; V705-A709 WeakPolarHBondContact O-CB 3.22Å; V705-A709 PolarHBondContact O-N 2.9Å
706	Y	88.9	Confident	88.8	Confident	161 Å²	161	107 Å²	107	63%	0.631	54%	0.535	S	S	*	.	H	α-helix	trans	-61.8	-49	176.5	179.4	-99.6	0	0	0	111.8	L702 E703 R708 A709 Q710	L702-Y706 WeakPolarHBondContact O-CB 3.27Å; L702-Y706 PolarHBondContact O-N 3.23Å; E703-Y706 PolarHBondContact O-N 3.14Å; Y706-R708 VanDerWaalsContact C-N 3.33Å; Y706-R708 PolarHBondContact O-N 3.5Å; Y706-A709 PolarHBondContact O-N 2.83Å; Y706-Q710 WeakPolarHBondContact O-CB 3.31Å; Y706-Q710 PolarHBondContact O-N 2.97Å
707	A	88.9	Confident	88.7	Confident	52 Å²	52	110.5 Å²	110.5	43%	0.43	55%	0.545	S	S	.	.	H	α-helix	trans	-62.9	-38.6	178.9	0	0	0	0	0	111.9	E703 L704 Q710 L711	E703-A707 VanDerWaalsContact O-CB 3.25Å; E703-A707 WeakPolarHBondContact O-CB 3.32Å; E703-A707 PolarHBondContact O-N 3.42Å; L704-A707 PolarHBondContact O-N 2.95Å; A707-Q710 PolarHBondContact O-N 3.46Å; A707-L711 WeakPolarHBondContact O-CB 3.48Å; A707-L711 PolarHBondContact O-N 3.42Å
708	R	88.9	Confident	88.6	Confident	182 Å²	182	108.2 Å²	108.2	69%	0.687	54%	0.544	S	S	*	.	H	α-helix	trans	-65.1	-45.9	176.1	-167.8	-179.7	-148.8	154.5	6	111.5	L704 V705 Y706 Q710 L711 E712	L704-R708 VanDerWaalsContact O-CB 3.23Å; L704-R708 WeakPolarHBondContact O-CB 3.43Å; L704-R708 PolarHBondContact O-N 3.49Å; V705-R708 PolarHBondContact O-N 2.86Å; Y706-R708 VanDerWaalsContact C-N 3.33Å; Y706-R708 PolarHBondContact O-N 3.5Å; R708-Q710 VanDerWaalsContact C-N 3.32Å; R708-Q710 PolarHBondContact O-N 2.87Å; R708-L711 PolarHBondContact O-N 3.46Å; R708-E712 WeakPolarHBondContact O-CB 3.21Å; R708-E712 PolarHBondContact O-N 2.85Å
709	A	87.4	Confident	88.6	Confident	56 Å²	56	107.5 Å²	107.5	46%	0.463	54%	0.543	S	S	.	.	H	α-helix	trans	-63.6	-38.9	176.3	0	0	0	0	0	111.7	V705 Y706 L713	V705-A709 WeakPolarHBondContact O-CB 3.22Å; V705-A709 PolarHBondContact O-N 2.9Å; Y706-A709 PolarHBondContact O-N 2.83Å; A709-L713 VanDerWaalsContact O-CB 3.32Å; A709-L713 WeakPolarHBondContact O-CB 3.3Å; A709-L713 PolarHBondContact O-N 2.83Å
710	Q	89.8	Confident	88.3	Confident	83 Å²	83	109.9 Å²	109.9	39%	0.388	55%	0.55	S	S	.	.	H	α-helix	trans	-64.9	-44.7	174.9	-173.5	177.7	-10.9	0	0	111.6	Y706 A707 R708 L713 E714	Y706-Q710 WeakPolarHBondContact O-CB 3.31Å; Y706-Q710 PolarHBondContact O-N 2.97Å; A707-Q710 PolarHBondContact O-N 3.46Å; R708-Q710 VanDerWaalsContact C-N 3.32Å; R708-Q710 PolarHBondContact O-N 2.87Å; Q710-L713 WeakPolarHBondContact O-CB 3.5Å; Q710-L713 PolarHBondContact O-N 3.24Å; Q710-E714 PolarHBondContact NE2-OE1 2.89Å; Q710-E714 WeakPolarHBondContact O-CG 3.4Å; Q710-E714 PolarHBondContact O-N 3.43Å
711	L	88.9	Confident	88.3	Confident	109 Å²	109	107.2 Å²	107.2	57%	0.571	55%	0.546	S	S	*	.	H	α-helix	trans	-65.3	-41.7	178.3	-158.3	87.2	0	0	0	111.5	A707 R708 L713 E714 V715	A707-L711 WeakPolarHBondContact O-CB 3.48Å; A707-L711 PolarHBondContact O-N 3.42Å; R708-L711 PolarHBondContact O-N 3.46Å; L711-L713 VanDerWaalsContact C-N 3.3Å; L711-L713 PolarHBondContact O-N 3.23Å; L711-E714 PolarHBondContact O-N 3.47Å; L711-V715 WeakPolarHBondContact O-CB 3.35Å; L711-V715 VanDerWaalsContact O-CG2 3.31Å; L711-V715 WeakPolarHBondContact O-CG2 3.24Å; L711-V715 PolarHBondContact O-N 2.98Å
712	E	88.6	Confident	88.2	Confident	139 Å²	139	103.3 Å²	103.3	65%	0.65	54%	0.536	S	S	*	.	H	α-helix	trans	-63.6	-38.3	176.2	-171.3	168.6	-168.1	0	0	111.4	R708 S716	R708-E712 WeakPolarHBondContact O-CB 3.21Å; R708-E712 PolarHBondContact O-N 2.85Å; E712-S716 VanDerWaalsContact O-CB 3.22Å; E712-S716 WeakPolarHBondContact O-CB 3.48Å; E712-S716 PolarHBondContact O-N 2.88Å
713	L	88.8	Confident	88.2	Confident	124 Å²	124	104 Å²	104	65%	0.649	54%	0.536	S	S	*	.	H	α-helix	trans	-65.3	-42.2	172.5	-174.6	67.6	0	0	0	112	A709 Q710 L711 S716 K717	A709-L713 VanDerWaalsContact O-CB 3.32Å; A709-L713 WeakPolarHBondContact O-CB 3.3Å; A709-L713 PolarHBondContact O-N 2.83Å; Q710-L713 WeakPolarHBondContact O-CB 3.5Å; Q710-L713 PolarHBondContact O-N 3.24Å; L711-L713 VanDerWaalsContact C-N 3.3Å; L711-L713 PolarHBondContact O-N 3.23Å; L713-S716 PolarHBondContact O-N 3.49Å; L713-K717 VanDerWaalsContact O-CB 3.27Å; L713-K717 WeakPolarHBondContact O-CB 3.41Å; L713-K717 PolarHBondContact O-N 3.01Å
714	E	87.5	Confident	88.1	Confident	106 Å²	106	104.1 Å²	104.1	50%	0.495	54%	0.543	S	S	.	.	H	α-helix	trans	-64.3	-44.3	176.3	-77	178.7	-168.2	0	0	111.9	Q710 L711 K717 A718	Q710-E714 PolarHBondContact NE2-OE1 2.89Å; Q710-E714 WeakPolarHBondContact O-CG 3.4Å; Q710-E714 PolarHBondContact O-N 3.43Å; L711-E714 PolarHBondContact O-N 3.47Å; E714-K717 PolarHBondContact O-N 3.26Å; E714-A718 WeakPolarHBondContact O-CB 3.41Å; E714-A718 PolarHBondContact O-N 3.1Å
715	V	89.6	Confident	87.9	Confident	78 Å²	78	105.2 Å²	105.2	47%	0.473	55%	0.545	S	S	.	.	H	α-helix	trans	-62.9	-47.1	174.8	171.1	0	0	0	0	110.4	L711 K717 A718 Q719	L711-V715 WeakPolarHBondContact O-CB 3.35Å; L711-V715 VanDerWaalsContact O-CG2 3.31Å; L711-V715 WeakPolarHBondContact O-CG2 3.24Å; L711-V715 PolarHBondContact O-N 2.98Å; V715-K717 VanDerWaalsContact C-N 3.34Å; V715-K717 PolarHBondContact O-N 3.5Å; V715-A718 PolarHBondContact O-N 3Å; V715-Q719 WeakPolarHBondContact O-CB 3.48Å; V715-Q719 PolarHBondContact O-N 3.17Å
716	S	89.5	Confident	87.6	Confident	53 Å²	53	105.1 Å²	105.1	37%	0.371	54%	0.544	S	S	.	.	H	α-helix	trans	-59	-45.4	177.8	-173.6	0	0	0	0	111.6	E712 L713 Q719 Q720	E712-S716 VanDerWaalsContact O-CB 3.22Å; E712-S716 WeakPolarHBondContact O-CB 3.48Å; E712-S716 PolarHBondContact O-N 2.88Å; L713-S716 PolarHBondContact O-N 3.49Å; S716-Q719 PolarHBondContact O-N 2.83Å; S716-Q720 WeakPolarHBondContact O-CB 3.2Å; S716-Q720 VanDerWaalsContact O-CG 3.28Å; S716-Q720 WeakPolarHBondContact O-CG 3.37Å; S716-Q720 PolarHBondContact O-N 2.79Å
717	K	88.9	Confident	87.5	Confident	138 Å²	138	103.9 Å²	103.9	60%	0.6	54%	0.542	S	S	*	.	H	α-helix	trans	-61	-48.2	175.2	-179.3	-177	177.4	-176.5	0	111.7	L713 E714 V715 Q719 Q720 L721	L713-K717 VanDerWaalsContact O-CB 3.27Å; L713-K717 WeakPolarHBondContact O-CB 3.41Å; L713-K717 PolarHBondContact O-N 3.01Å; E714-K717 PolarHBondContact O-N 3.26Å; V715-K717 VanDerWaalsContact C-N 3.34Å; V715-K717 PolarHBondContact O-N 3.5Å; K717-Q719 VanDerWaalsContact C-N 3.33Å; K717-Q719 PolarHBondContact O-N 3.19Å; K717-Q720 PolarHBondContact O-N 3.43Å; K717-L721 HydrophobicContact CG-CD1 4.13Å; K717-L721 WeakPolarHBondContact O-CB 3.41Å; K717-L721 VanDerWaalsContact O-CG 3.27Å; K717-L721 WeakPolarHBondContact O-CG 3.4Å; K717-L721 PolarHBondContact O-N 3.09Å
718	A	86.8	Confident	87.3	Confident	57 Å²	57	107.6 Å²	107.6	47%	0.471	55%	0.549	S	S	.	.	H	α-helix	trans	-64	-39.5	179.4	0	0	0	0	0	111.7	E714 V715 L721 A722	E714-A718 WeakPolarHBondContact O-CB 3.41Å; E714-A718 PolarHBondContact O-N 3.1Å; V715-A718 PolarHBondContact O-N 3Å; A718-L721 PolarHBondContact O-N 2.95Å; A718-A722 VanDerWaalsContact O-CB 3.24Å; A718-A722 WeakPolarHBondContact O-CB 3.22Å; A718-A722 PolarHBondContact O-N 3.45Å
719	Q	87	Confident	86.9	Confident	131 Å²	131	105.4 Å²	105.4	61%	0.612	55%	0.545	S	S	*	.	H	α-helix	trans	-68.1	-42.2	178.8	-167.4	160.6	0.8	0	0	111.6	V715 S716 K717 A722 E723	V715-Q719 WeakPolarHBondContact O-CB 3.48Å; V715-Q719 PolarHBondContact O-N 3.17Å; S716-Q719 PolarHBondContact O-N 2.83Å; K717-Q719 VanDerWaalsContact C-N 3.33Å; K717-Q719 PolarHBondContact O-N 3.19Å; Q719-A722 PolarHBondContact O-N 3.19Å; Q719-E723 VanDerWaalsContact O-CB 3.3Å; Q719-E723 WeakPolarHBondContact O-CB 3.02Å; Q719-E723 PolarHBondContact O-N 2.68Å
720	Q	85.1	Confident	86.8	Confident	120 Å²	120	108.7 Å²	108.7	56%	0.561	55%	0.548	S	S	*	.	H	α-helix	trans	-63.8	-42.8	173.1	-73.2	176.3	4.8	0	0	112.1	S716 K717 E723 V724	S716-Q720 WeakPolarHBondContact O-CB 3.2Å; S716-Q720 VanDerWaalsContact O-CG 3.28Å; S716-Q720 WeakPolarHBondContact O-CG 3.37Å; S716-Q720 PolarHBondContact O-N 2.79Å; K717-Q720 PolarHBondContact O-N 3.43Å; Q720-E723 PolarHBondContact O-N 2.89Å; Q720-V724 VanDerWaalsContact O-CG2 3.27Å; Q720-V724 WeakPolarHBondContact O-CG2 3.48Å; Q720-V724 PolarHBondContact O-N 2.94Å
721	L	87.1	Confident	86.5	Confident	101 Å²	101	110.3 Å²	110.3	53%	0.529	56%	0.556	S	S	.	*	H	α-helix	trans	-64.3	-43.9	176	-72.9	173.9	0	0	0	111.6	K717 A718 V724 E725	K717-L721 HydrophobicContact CG-CD1 4.13Å; K717-L721 WeakPolarHBondContact O-CB 3.41Å; K717-L721 VanDerWaalsContact O-CG 3.27Å; K717-L721 WeakPolarHBondContact O-CG 3.4Å; K717-L721 PolarHBondContact O-N 3.09Å; A718-L721 PolarHBondContact O-N 2.95Å; L721-V724 PolarHBondContact O-N 2.94Å; L721-E725 PolarHBondContact O-N 2.8Å
722	A	85.1	Confident	85.9	Confident	48 Å²	48	109.4 Å²	109.4	40%	0.397	55%	0.55	S	S	.	.	H	α-helix	trans	-64	-39.8	176.2	0	0	0	0	0	111.7	A718 Q719 V724 E725 V726	A718-A722 VanDerWaalsContact O-CB 3.24Å; A718-A722 WeakPolarHBondContact O-CB 3.22Å; A718-A722 PolarHBondContact O-N 3.45Å; Q719-A722 PolarHBondContact O-N 3.19Å; A722-V724 VanDerWaalsContact C-N 3.35Å; A722-E725 PolarHBondContact O-N 3.01Å; A722-V726 WeakPolarHBondContact O-CB 3.32Å; A722-V726 VanDerWaalsContact O-CG2 3.28Å; A722-V726 WeakPolarHBondContact O-CG2 3.48Å; A722-V726 PolarHBondContact O-N 3.31Å
723	E	88.1	Confident	85.3	Confident	139 Å²	139	104.9 Å²	104.9	65%	0.65	53%	0.532	S	S	*	.	H	α-helix	trans	-65.9	-38.8	176.4	-169.2	169.5	-166.4	0	0	111.6	Q719 Q720 K727	Q719-E723 VanDerWaalsContact O-CB 3.3Å; Q719-E723 WeakPolarHBondContact O-CB 3.02Å; Q719-E723 PolarHBondContact O-N 2.68Å; Q720-E723 PolarHBondContact O-N 2.89Å; E723-K727 WeakPolarHBondContact O-CB 3.18Å; E723-K727 PolarHBondContact O-N 3.39Å
724	V	85.9	Confident	84.9	Confident	95 Å²	95	104.9 Å²	104.9	58%	0.576	53%	0.528	S	S	*	.	H	α-helix	trans	-63.6	-42.7	171.1	170.3	0	0	0	0	111.3	Q720 L721 A722 K727 K728	Q720-V724 VanDerWaalsContact O-CG2 3.27Å; Q720-V724 WeakPolarHBondContact O-CG2 3.48Å; Q720-V724 PolarHBondContact O-N 2.94Å; L721-V724 PolarHBondContact O-N 2.94Å; A722-V724 VanDerWaalsContact C-N 3.35Å; V724-K727 PolarHBondContact O-N 3.38Å; V724-K728 VanDerWaalsContact O-CB 3.31Å; V724-K728 WeakPolarHBondContact O-CB 3.39Å; V724-K728 PolarHBondContact O-N 3.19Å
725	E	83.9	Confident	84.4	Confident	138 Å²	138	104 Å²	104	65%	0.645	54%	0.54	S	S	*	.	H	α-helix	trans	-65.3	-44	176	-79.8	-171.2	161.6	0	0	112.5	L721 A722 K727 K728 F729	L721-E725 PolarHBondContact O-N 2.8Å; A722-E725 PolarHBondContact O-N 3.01Å; E725-K727 VanDerWaalsContact C-N 3.3Å; E725-K727 PolarHBondContact O-N 2.56Å; E725-K728 PolarHBondContact O-N 3.08Å; E725-F729 VanDerWaalsContact O-CB 3.26Å; E725-F729 WeakPolarHBondContact O-CB 3.33Å; E725-F729 PolarHBondContact O-N 2.81Å
726	V	85.9	Confident	83.6	Confident	97 Å²	97	104.8 Å²	104.8	59%	0.588	54%	0.54	S	S	*	.	H	α-helix	trans	-61.5	-42.1	174.6	169.5	0	0	0	0	110	A722 F729 K730	A722-V726 WeakPolarHBondContact O-CB 3.32Å; A722-V726 VanDerWaalsContact O-CG2 3.28Å; A722-V726 WeakPolarHBondContact O-CG2 3.48Å; A722-V726 PolarHBondContact O-N 3.31Å; V726-F729 PolarHBondContact O-N 2.97Å; V726-K730 WeakPolarHBondContact O-CB 3.49Å; V726-K730 PolarHBondContact O-N 2.51Å
727	K	85.8	Confident	82.9	Confident	135 Å²	135	102.9 Å²	102.9	59%	0.587	53%	0.529	S	S	*	.	H	α-helix	trans	-64.9	-42.9	176.7	-167.5	175.2	-176.1	177.1	0	111.7	E723 V724 E725 K730 Q731	E723-K727 WeakPolarHBondContact O-CB 3.18Å; E723-K727 PolarHBondContact O-N 3.39Å; V724-K727 PolarHBondContact O-N 3.38Å; E725-K727 VanDerWaalsContact C-N 3.3Å; E725-K727 PolarHBondContact O-N 2.56Å; K727-K730 PolarHBondContact O-N 3.08Å; K727-Q731 WeakPolarHBondContact O-CB 3.27Å; K727-Q731 VanDerWaalsContact O-CG 3.27Å; K727-Q731 WeakPolarHBondContact O-CG 3.28Å; K727-Q731 PolarHBondContact O-N 3.01Å
728	K	84.3	Confident	82.2	Confident	130 Å²	130	101.5 Å²	101.5	57%	0.565	53%	0.534	S	S	*	.	H	α-helix	trans	-62.5	-45.8	173.7	-176.9	-173.1	176.4	-175.4	0	111.3	V724 E725 Q731 M732	V724-K728 VanDerWaalsContact O-CB 3.31Å; V724-K728 WeakPolarHBondContact O-CB 3.39Å; V724-K728 PolarHBondContact O-N 3.19Å; E725-K728 PolarHBondContact O-N 3.08Å; K728-Q731 PolarHBondContact O-N 3.17Å; K728-M732 HydrophobicContact CG-CE 4.25Å; K728-M732 WeakPolarHBondContact O-CG 3.43Å; K728-M732 PolarHBondContact O-N 2.85Å
729	F	81.9	Confident	81.5	Confident	136 Å²	136	102.3 Å²	102.3	60%	0.596	54%	0.536	S	S	*	.	H	α-helix	trans	-65	-43.3	178.6	-174.2	-97.5	0	0	0	111.4	E725 V726 M732 T733	E725-F729 VanDerWaalsContact O-CB 3.26Å; E725-F729 WeakPolarHBondContact O-CB 3.33Å; E725-F729 PolarHBondContact O-N 2.81Å; V726-F729 PolarHBondContact O-N 2.97Å; F729-M732 HydrophobicContact CB-CE 4.38Å; F729-M732 HydrophobicContact CD2-CE 4.1Å; F729-M732 PolarHBondContact O-N 3.31Å; F729-T733 WeakPolarHBondContact CE1-OG1 3.38Å; F729-T733 WeakPolarHBondContact O-CB 3.44Å; F729-T733 PolarHBondContact O-N 3.17Å; F729-T733 PolarHBondContact O-OG1 3.34Å
730	K	84.3	Confident	80.8	Confident	125 Å²	125	99 Å²	99	54%	0.543	53%	0.525	S	S	.	.	H	α-helix	trans	-59.4	-47.9	174	-177.3	174	175.7	178.1	0	111.1	V726 K727 M732 T733 E734	V726-K730 WeakPolarHBondContact O-CB 3.49Å; V726-K730 PolarHBondContact O-N 2.51Å; K727-K730 PolarHBondContact O-N 3.08Å; K730-M732 VanDerWaalsContact C-N 3.35Å; K730-M732 PolarHBondContact O-N 2.83Å; K730-T733 PolarHBondContact O-N 2.97Å; K730-E734 WeakPolarHBondContact CE-OE1 3.26Å; K730-E734 HydrophobicContact CG-CG 4.39Å; K730-E734 WeakPolarHBondContact CG-OE1 3.32Å; K730-E734 IonicContact NZ-OE1 4Å; K730-E734 WeakPolarHBondContact O-CB 3.31Å; K730-E734 WeakPolarHBondContact O-CG 3.27Å; K730-E734 PolarHBondContact O-N 3.39Å
731	Q	82.9	Confident	80.1	Confident	117 Å²	117	96.5 Å²	96.5	55%	0.547	52%	0.515	S	S	.	.	H	α-helix	trans	-60.2	-41.4	174.8	-74.7	175.1	-12.2	0	0	112.5	K727 K728 A735	K727-Q731 WeakPolarHBondContact O-CB 3.27Å; K727-Q731 VanDerWaalsContact O-CG 3.27Å; K727-Q731 WeakPolarHBondContact O-CG 3.28Å; K727-Q731 PolarHBondContact O-N 3.01Å; K728-Q731 PolarHBondContact O-N 3.17Å; Q731-A735 VanDerWaalsContact O-CB 3.27Å; Q731-A735 WeakPolarHBondContact O-CB 3.22Å; Q731-A735 PolarHBondContact O-N 2.92Å
732	M	76.6	Confident	79.4	Confident	90 Å²	90	100.1 Å²	100.1	44%	0.443	52%	0.521	S	S	.	.	H	α-helix	trans	-63.8	-42.5	174	-74.5	-173.9	-58.8	0	0	112.2	K728 F729 K730 A735 I736	K728-M732 HydrophobicContact CG-CE 4.25Å; K728-M732 WeakPolarHBondContact O-CG 3.43Å; K728-M732 PolarHBondContact O-N 2.85Å; F729-M732 HydrophobicContact CB-CE 4.38Å; F729-M732 HydrophobicContact CD2-CE 4.1Å; F729-M732 PolarHBondContact O-N 3.31Å; K730-M732 VanDerWaalsContact C-N 3.35Å; K730-M732 PolarHBondContact O-N 2.83Å; M732-A735 PolarHBondContact O-N 3.41Å; M732-I736 WeakPolarHBondContact O-CG1 3.28Å; M732-I736 PolarHBondContact O-N 3.4Å; M732-I736 VanDerWaalsContact O-N 3.07Å
733	T	76.8	Confident	78.8	Confident	44 Å²	44	102.8 Å²	102.8	27%	0.27	53%	0.529	S	S	.	.	H	α-helix	trans	-67.6	-42.3	-179	-51.6	0	0	0	0	111	F729 K730 I736 G737 I741	F729-T733 WeakPolarHBondContact CE1-OG1 3.38Å; F729-T733 WeakPolarHBondContact O-CB 3.44Å; F729-T733 PolarHBondContact O-N 3.17Å; F729-T733 PolarHBondContact O-OG1 3.34Å; K730-T733 PolarHBondContact O-N 2.97Å; T733-I736 PolarHBondContact O-N 2.89Å; T733-G737 PolarHBondContact O-N 3.38Å; T733-I741 HydrophobicContact CG2-CD1 3.35Å
734	E	80.1	Confident	77.7	Confident	124 Å²	124	102.8 Å²	102.8	58%	0.579	53%	0.533	S	S	*	.	H	α-helix	trans	-65.6	-36.6	174.7	-73.6	172.5	175.9	0	0	111.8	K730	K730-E734 WeakPolarHBondContact CE-OE1 3.26Å; K730-E734 HydrophobicContact CG-CG 4.39Å; K730-E734 WeakPolarHBondContact CG-OE1 3.32Å; K730-E734 IonicContact NZ-OE1 4Å; K730-E734 WeakPolarHBondContact O-CB 3.31Å; K730-E734 WeakPolarHBondContact O-CG 3.27Å; K730-E734 PolarHBondContact O-N 3.39Å
735	A	76.4	Confident	76.7	Confident	88 Å²	88	101.7 Å²	101.7	73%	0.727	53%	0.534	S	S	*	.	H	α-helix	trans	-69.2	-34.4	176.4	0	0	0	0	0	113.6	Q731 M732	Q731-A735 VanDerWaalsContact O-CB 3.27Å; Q731-A735 WeakPolarHBondContact O-CB 3.22Å; Q731-A735 PolarHBondContact O-N 2.92Å; M732-A735 PolarHBondContact O-N 3.41Å
736	I	74.1	Confident	75.9	Confident	94 Å²	94	97.6 Å²	97.6	48%	0.482	52%	0.518	S	S	.	.	H	α-helix	trans	-78.6	-32.5	176.2	-64.2	168.1	0	0	0	111.1	M732 T733 T740 I741	M732-I736 WeakPolarHBondContact O-CG1 3.28Å; M732-I736 PolarHBondContact O-N 3.4Å; M732-I736 VanDerWaalsContact O-N 3.07Å; T733-I736 PolarHBondContact O-N 2.89Å; I736-T740 HydrophobicContact CG2-CG2 4.06Å; I736-T740 WeakPolarHBondContact O-CB 3.3Å; I736-T740 PolarHBondContact O-OG1 2.83Å; I736-I741 HydrophobicContact CB-CD1 4.39Å; I736-I741 HydrophobicContact CB-CG1 4.29Å; I736-I741 HydrophobicContact CG2-CD1 4.31Å; I736-I741 HydrophobicContact CG2-CG1 3.67Å
737	G	74.9	Confident	74.8	Confident	14 Å²	14	95.6 Å²	95.6	14%	0.144	51%	0.512	C	S	.	.			trans	87.7	140.7	178.7	0	0	0	0	0	113.3	T733 S739 T740 I741	T733-G737 PolarHBondContact O-N 3.38Å; G737-S739 VanDerWaalsContact C-N 3.31Å; G737-S739 PolarHBondContact O-N 2.74Å; G737-T740 PolarHBondContact O-N 3.38Å; G737-I741 PolarHBondContact O-N 3.28Å
738	P	73.5	Confident	73.7	Confident	109 Å²	109	90.9 Å²	90.9	71%	0.708	50%	0.502	S	S	*	.	H	α-helix	trans	-67.5	-26.3	-172.6	24.7	-33.2	0	0	0	114.2	R742	P738-R742 PolarHBondContact O-N 3.37Å
739	S	72.9	Confident	72.7	Confident	73 Å²	73	88.3 Å²	88.3	51%	0.51	50%	0.498	S	S	.	.	H	α-helix	trans	-67.7	-45	172.5	49.9	0	0	0	0	111.3	G737 I741 R742 D743	G737-S739 VanDerWaalsContact C-N 3.31Å; G737-S739 PolarHBondContact O-N 2.74Å; S739-I741 PolarHBondContact O-N 3.46Å; S739-R742 WeakPolarHBondContact O-CB 3.44Å; S739-R742 PolarHBondContact O-N 2.78Å; S739-D743 PolarHBondContact O-N 3.24Å
740	T	71.3	Confident	71.7	Confident	63 Å²	63	87.3 Å²	87.3	39%	0.387	50%	0.496	S	S	.	.	H	α-helix	trans	-66.5	-36	-176.3	-39	0	0	0	0	112.3	I736 G737 D743 L744	I736-T740 HydrophobicContact CG2-CG2 4.06Å; I736-T740 WeakPolarHBondContact O-CB 3.3Å; I736-T740 PolarHBondContact O-OG1 2.83Å; G737-T740 PolarHBondContact O-N 3.38Å; T740-D743 PolarHBondContact O-N 2.86Å; T740-L744 WeakPolarHBondContact O-CB 3.35Å; T740-L744 PolarHBondContact O-N 3.31Å
741	I	70.2	Confident	70.4	Confident	66 Å²	66	87.8 Å²	87.8	34%	0.338	50%	0.501	S	S	.	.	H	α-helix	trans	-71	-38.2	176.7	-60.7	172.3	0	0	0	111.1	T733 I736 G737 S739 D743 L744 A745	T733-I741 HydrophobicContact CG2-CD1 3.35Å; I736-I741 HydrophobicContact CB-CD1 4.39Å; I736-I741 HydrophobicContact CB-CG1 4.29Å; I736-I741 HydrophobicContact CG2-CD1 4.31Å; I736-I741 HydrophobicContact CG2-CG1 3.67Å; G737-I741 PolarHBondContact O-N 3.28Å; S739-I741 PolarHBondContact O-N 3.46Å; I741-D743 VanDerWaalsContact C-N 3.33Å; I741-L744 PolarHBondContact O-N 2.88Å; I741-A745 WeakPolarHBondContact O-CB 3.33Å; I741-A745 PolarHBondContact O-N 3.42Å
742	R	72.6	Confident	69.1	Low	177 Å²	177	88.5 Å²	88.5	67%	0.668	51%	0.505	S	S	*	.	H	α-helix	trans	-59.5	-46.9	172.4	179.8	-171.4	-63.3	176.4	-0.4	110.3	P738 S739 L744 A745 V746	P738-R742 PolarHBondContact O-N 3.37Å; S739-R742 WeakPolarHBondContact O-CB 3.44Å; S739-R742 PolarHBondContact O-N 2.78Å; R742-L744 VanDerWaalsContact C-N 3.33Å; R742-L744 PolarHBondContact O-N 2.85Å; R742-A745 PolarHBondContact O-N 3.07Å; R742-V746 HydrophobicContact CG-CG2 4.36Å; R742-V746 WeakPolarHBondContact O-CB 3.17Å; R742-V746 WeakPolarHBondContact O-CG2 3.47Å; R742-V746 PolarHBondContact O-N 2.8Å
743	D	72.1	Confident	68.3	Low	105 Å²	105	88 Å²	88	56%	0.561	51%	0.507	S	S	*	.	H	α-helix	trans	-65.2	-38.1	-179.8	-62.4	-16.8	0	0	0	111.4	S739 T740 I741 A745 V746 A747	S739-D743 PolarHBondContact O-N 3.24Å; T740-D743 PolarHBondContact O-N 2.86Å; I741-D743 VanDerWaalsContact C-N 3.33Å; D743-A745 PolarHBondContact O-N 3.35Å; D743-V746 PolarHBondContact O-N 3.24Å; D743-A747 WeakPolarHBondContact O-CB 3.2Å; D743-A747 PolarHBondContact O-N 2.77Å; D743-A747 VanDerWaalsContact O-N 3.09Å
744	L	65.8	Low	67.4	Low	138 Å²	138	93.1 Å²	93.1	72%	0.723	53%	0.525	S	S	*	.	H	α-helix	trans	-65.2	-37.2	175.4	-132.5	105.7	0	0	0	113	T740 I741 R742	T740-L744 WeakPolarHBondContact O-CB 3.35Å; T740-L744 PolarHBondContact O-N 3.31Å; I741-L744 PolarHBondContact O-N 2.88Å; R742-L744 VanDerWaalsContact C-N 3.33Å; R742-L744 PolarHBondContact O-N 2.85Å
745	A	64.9	Low	66.2	Low	73 Å²	73	91.9 Å²	91.9	60%	0.603	52%	0.522	S	S	*	.	H	α-helix	trans	-76.3	-30.4	179	0	0	0	0	0	112.9	I741 R742 D743	I741-A745 WeakPolarHBondContact O-CB 3.33Å; I741-A745 PolarHBondContact O-N 3.42Å; R742-A745 PolarHBondContact O-N 3.07Å; D743-A745 PolarHBondContact O-N 3.35Å
746	V	66.3	Low	65.2	Low	51 Å²	51	92.8 Å²	92.8	31%	0.309	51%	0.514	S	S	.	.	H	α-helix	trans	-82.8	-19.9	179.8	173.9	0	0	0	0	112.3	R742 D743 G748 P749 E750	R742-V746 HydrophobicContact CG-CG2 4.36Å; R742-V746 WeakPolarHBondContact O-CB 3.17Å; R742-V746 WeakPolarHBondContact O-CG2 3.47Å; R742-V746 PolarHBondContact O-N 2.8Å; D743-V746 PolarHBondContact O-N 3.24Å; V746-G748 VanDerWaalsContact C-N 3.28Å; V746-G748 PolarHBondContact O-N 2.97Å; V746-P749 WeakPolarHBondContact O-CD 3.35Å; V746-E750 HydrophobicContact CG1-CB 4.36Å; V746-E750 HydrophobicContact CG1-CG 3.47Å; V746-E750 VanDerWaalsContact CG1-CG 3.47Å; V746-E750 WeakPolarHBondContact CG1-OE1 3.43Å; V746-E750 WeakPolarHBondContact O-CB 3.42Å; V746-E750 PolarHBondContact O-N 2.66Å; V746-E750 VanDerWaalsContact O-N 3.1Å
747	A	62.5	Low	64.3	Low	56 Å²	56	95.7 Å²	95.7	46%	0.463	53%	0.526	S	S	.	.	H	α-helix	trans	-58.1	-31.2	-179.2	0	0	0	0	0	114.8	D743 M751	D743-A747 WeakPolarHBondContact O-CB 3.2Å; D743-A747 PolarHBondContact O-N 2.77Å; D743-A747 VanDerWaalsContact O-N 3.09Å; A747-M751 VanDerWaalsContact O-CB 3.3Å; A747-M751 WeakPolarHBondContact O-CB 3.39Å; A747-M751 PolarHBondContact O-N 3.37Å
748	G	64.2	Low	63.4	Low	36 Å²	36	99.4 Å²	99.4	37%	0.371	55%	0.549	S	S	.	.	H	α-helix	trans	-74.5	-58.3	178.7	0	0	0	0	0	113.7	V746 E750 M751 Q752	V746-G748 VanDerWaalsContact C-N 3.28Å; V746-G748 PolarHBondContact O-N 2.97Å; G748-E750 PolarHBondContact O-N 3.45Å; G748-M751 PolarHBondContact O-N 3.43Å; G748-Q752 WeakPolarHBondContact O-CG 3.27Å; G748-Q752 PolarHBondContact O-N 3.4Å; G748-Q752 VanDerWaalsContact O-N 3.14Å
749	P	62.9	Low	62.6	Low	75 Å²	75	99.8 Å²	99.8	49%	0.487	54%	0.544	S	S	.	.	H	α-helix	trans	-63.4	-36.6	178.7	-22.4	32.3	0	0	0	113.5	V746 Q752 V753	V746-P749 WeakPolarHBondContact O-CD 3.35Å; P749-Q752 PolarHBondContact O-N 2.81Å; P749-V753 WeakPolarHBondContact O-CB 3.2Å; P749-V753 VanDerWaalsContact O-CG2 3.22Å; P749-V753 WeakPolarHBondContact O-CG2 3.45Å; P749-V753 PolarHBondContact O-N 2.98Å
750	E	59.7	Low	61.6	Low	116 Å²	116	99.6 Å²	99.6	54%	0.542	55%	0.554	S	S	.	*	H	α-helix	trans	-70.4	-32.4	178.6	-79.5	-172.1	171.4	0	0	113.2	V746 G748 K754	V746-E750 HydrophobicContact CG1-CB 4.36Å; V746-E750 HydrophobicContact CG1-CG 3.47Å; V746-E750 VanDerWaalsContact CG1-CG 3.47Å; V746-E750 WeakPolarHBondContact CG1-OE1 3.43Å; V746-E750 WeakPolarHBondContact O-CB 3.42Å; V746-E750 PolarHBondContact O-N 2.66Å; V746-E750 VanDerWaalsContact O-N 3.1Å; G748-E750 PolarHBondContact O-N 3.45Å; E750-K754 WeakPolarHBondContact O-CB 3.27Å; E750-K754 PolarHBondContact O-N 3.23Å; E750-K754 VanDerWaalsContact O-N 3.17Å
751	M	57.6	Low	60.5	Low	135 Å²	135	103.5 Å²	103.5	67%	0.665	57%	0.572	S	S	*	*	H	α-helix	trans	-71.8	-37.3	174	-167.4	153.8	89.4	0	0	111.5	A747 G748 L755	A747-M751 VanDerWaalsContact O-CB 3.3Å; A747-M751 WeakPolarHBondContact O-CB 3.39Å; A747-M751 PolarHBondContact O-N 3.37Å; G748-M751 PolarHBondContact O-N 3.43Å; M751-L755 PolarHBondContact O-N 3.35Å; M751-L755 VanDerWaalsContact O-N 3.09Å
752	Q	56.5	Low	59.3	Low	132 Å²	132	110.2 Å²	110.2	62%	0.617	60%	0.599	S	S	*	*	H	α-helix	trans	-73.1	-34.6	177.8	-70.6	174.9	-6.9	0	0	113	G748 P749 L755 L756	G748-Q752 WeakPolarHBondContact O-CG 3.27Å; G748-Q752 PolarHBondContact O-N 3.4Å; G748-Q752 VanDerWaalsContact O-N 3.14Å; P749-Q752 PolarHBondContact O-N 2.81Å; Q752-L755 PolarHBondContact O-N 3.16Å; Q752-L756 WeakPolarHBondContact O-CB 3.32Å; Q752-L756 WeakPolarHBondContact O-CG 3.46Å; Q752-L756 PolarHBondContact O-N 2.79Å
753	V	59.5	Low	57.8	Low	80 Å²	80	106.9 Å²	106.9	49%	0.485	60%	0.603	S	S	.	*	H	α-helix	trans	-70.1	-36.9	173.4	171.4	0	0	0	0	111.6	P749 L756 Q757	P749-V753 WeakPolarHBondContact O-CB 3.2Å; P749-V753 VanDerWaalsContact O-CG2 3.22Å; P749-V753 WeakPolarHBondContact O-CG2 3.45Å; P749-V753 PolarHBondContact O-N 2.98Å; V753-L756 PolarHBondContact O-N 3.5Å; V753-Q757 WeakPolarHBondContact O-CB 3.37Å; V753-Q757 PolarHBondContact O-N 2.93Å
754	K	57.9	Low	56.3	Low	150 Å²	150	108.6 Å²	108.6	65%	0.652	62%	0.617	S	S	*	*	H	α-helix	trans	-67.6	-33.2	172.5	-82.5	177.3	176.9	167.7	0	113.2	E750 S758	E750-K754 WeakPolarHBondContact O-CB 3.27Å; E750-K754 PolarHBondContact O-N 3.23Å; E750-K754 VanDerWaalsContact O-N 3.17Å; K754-S758 PolarHBondContact O-N 2.96Å; K754-S758 PolarHBondContact O-OG 2.94Å
755	L	55.1	Low	55.1	Low	98 Å²	98	109 Å²	109	51%	0.513	62%	0.619	S	S	.	*	H	α-helix	trans	-70.4	-39.1	172.2	-95.8	152.6	0	0	0	112.4	M751 Q752 S758 L759	M751-L755 PolarHBondContact O-N 3.35Å; M751-L755 VanDerWaalsContact O-N 3.09Å; Q752-L755 PolarHBondContact O-N 3.16Å; L755-S758 WeakPolarHBondContact CA-OG 3.17Å; L755-S758 PolarHBondContact O-N 3.03Å; L755-S758 PolarHBondContact O-OG 3.44Å; L755-L759 WeakPolarHBondContact O-CD1 3.39Å; L755-L759 PolarHBondContact O-N 3.1Å
756	L	53.8	Low	53.9	Low	108 Å²	108	113.4 Å²	113.4	57%	0.565	63%	0.631	S	S	*	*	H	α-helix	trans	-73.4	-32.2	176.9	-75.3	163.4	0	0	0	113.2	Q752 V753 L759	Q752-L756 WeakPolarHBondContact O-CB 3.32Å; Q752-L756 WeakPolarHBondContact O-CG 3.46Å; Q752-L756 PolarHBondContact O-N 2.79Å; V753-L756 PolarHBondContact O-N 3.5Å; L756-L759 PolarHBondContact O-N 2.98Å
757	Q	55.5	Low	52.9	Low	155 Å²	155	116 Å²	116	72%	0.724	65%	0.647	S	S	*	*	H	α-helix	trans	-70.8	-28.6	172.6	-87	-179.8	-25.8	0	0	113.6	V753 L759	V753-Q757 WeakPolarHBondContact O-CB 3.37Å; V753-Q757 PolarHBondContact O-N 2.93Å; Q757-L759 VanDerWaalsContact C-N 3.34Å
758	S	56.5	Low	51.7	Low	91 Å²	91	120.8 Å²	120.8	64%	0.636	67%	0.665	S	S	*	*	H	α-helix	trans	-80.4	-12.9	176.4	46.7	0	0	0	0	113.8	K754 L755	K754-S758 PolarHBondContact O-N 2.96Å; K754-S758 PolarHBondContact O-OG 2.94Å; L755-S758 WeakPolarHBondContact CA-OG 3.17Å; L755-S758 PolarHBondContact O-N 3.03Å; L755-S758 PolarHBondContact O-OG 3.44Å
759	L	57.8	Low	51.1	Low	117 Å²	117	122.4 Å²	122.4	61%	0.613	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	6.2	-179.6	-81.1	162	0	0	0	114.8	L755 L756 Q757 L761	L755-L759 WeakPolarHBondContact O-CD1 3.39Å; L755-L759 PolarHBondContact O-N 3.1Å; L756-L759 PolarHBondContact O-N 2.98Å; Q757-L759 VanDerWaalsContact C-N 3.34Å; L759-L761 VanDerWaalsContact C-N 3.34Å; L759-L761 PolarHBondContact O-N 2.83Å
760	G	51.9	Low	50.5	Low	69 Å²	69	124.3 Å²	124.3	71%	0.711	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	66.1	21.7	162	0	0	0	0	0	117.3
761	L	47.3	Very low	50	Low	146 Å²	146	124 Å²	124	76%	0.764	70%	0.703	S	S	*	*			trans	-91.7	114.2	-178.4	-68	168.7	0	0	0	111.7	L759	L759-L761 VanDerWaalsContact C-N 3.34Å; L759-L761 PolarHBondContact O-N 2.83Å
762	K	44.9	Very low	49.6	Very low	206 Å²	206	123.7 Å²	123.7	90%	0.896	71%	0.711	S	S	*	*			trans	-78.8	127.4	169.2	-74.5	179.6	178.1	177	0	109.7
763	S	40.6	Very low	49.2	Very low	108 Å²	108	124.2 Å²	124.2	76%	0.755	72%	0.716	S	S	*	*			trans	-55.7	142.7	-179.1	58.8	0	0	0	0	114.3
764	T	40.5	Very low	48.8	Very low	140 Å²	140	126.6 Å²	126.6	86%	0.859	73%	0.726	S	S	*	*			trans	-132.7	108.5	145.1	38.7	0	0	0	0	108.9
765	L	40.6	Very low	48.3	Very low	148 Å²	148	125.6 Å²	125.6	78%	0.775	73%	0.727	S	S	*	*			trans	-92.5	107.9	179.8	-162.1	118.5	0	0	0	106.4	T767	L765-T767 HydrophobicContact CD2-CG2 3.44Å; L765-T767 VanDerWaalsContact CD2-CG2 3.44Å; L765-T767 HydrophobicContact CG-CG2 4.15Å
766	I	39.7	Very low	48	Very low	164 Å²	164	128.6 Å²	128.6	84%	0.841	74%	0.736	S	S	*	*			trans	-108.2	103.7	166.3	-60.6	177.4	0	0	0	106.2
767	T	46.5	Very low	47.8	Very low	107 Å²	107	130.6 Å²	130.6	66%	0.656	75%	0.748	S	S	*	*			trans	-89.3	121.3	173.7	48.7	0	0	0	0	109.1	L765	L765-T767 HydrophobicContact CD2-CG2 3.44Å; L765-T767 VanDerWaalsContact CD2-CG2 3.44Å; L765-T767 HydrophobicContact CG-CG2 4.15Å
768	D	36.1	Very low	47.3	Very low	156 Å²	156	128.4 Å²	128.4	83%	0.834	75%	0.745	S	S	*	*			trans	-99	113.3	144.5	-167.9	-1.7	0	0	0	106.1	S770	D768-S770 PolarHBondContact O-N 3.19Å; D768-S770 VanDerWaalsContact O-N 3.11Å
769	G	52.4	Low	46.8	Very low	69 Å²	69	127 Å²	127	71%	0.711	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	101.2	-166.7	0	0	0	0	0	111.4
770	S	50.3	Low	46	Very low	115 Å²	115	130.1 Å²	130.1	80%	0.804	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-173.5	-25.5	155	177.6	0	0	0	0	113.3	D768	D768-S770 PolarHBondContact O-N 3.19Å; D768-S770 VanDerWaalsContact O-N 3.11Å
771	T	47.8	Very low	45.9	Very low	110 Å²	110	130.5 Å²	130.5	68%	0.675	75%	0.751	S	S	*	*			trans	-153.6	121.5	177.1	42.9	0	0	0	0	112.8	I773	T771-I773 PolarHBondContact O-N 3.44Å
772	P	49.7	Very low	45.8	Very low	129 Å²	129	130.8 Å²	130.8	84%	0.838	75%	0.753	S	S	*	*			trans	-72.8	115.4	171.3	26.9	-29.8	0	0	0	110.4	N774	P772-N774 PolarHBondContact O-N 2.77Å
773	I	49	Very low	45.9	Very low	143 Å²	143	127.7 Å²	127.7	73%	0.733	75%	0.746	S	S	*	*			trans	-67.6	112	169.4	-64.9	172.6	0	0	0	108	T771 L775	T771-I773 PolarHBondContact O-N 3.44Å; I773-L775 HydrophobicContact CG2-CD2 3.9Å; I773-L775 HydrophobicContact CG2-CG 4.15Å; I773-L775 PolarHBondContact O-N 3.18Å
774	N	51.3	Low	46	Very low	129 Å²	129	126.5 Å²	126.5	69%	0.69	75%	0.75	S	S	*	*			trans	-83.4	93.7	179.3	-157.2	-15.8	0	0	0	109.6	P772 F776	P772-N774 PolarHBondContact O-N 2.77Å; N774-F776 PolarHBondContact O-N 3.3Å; N774-F776 VanDerWaalsContact O-N 3.08Å; N774-F776 WeakPolarHBondContact OD1-CD2 2.88Å
775	L	47.4	Very low	45.9	Very low	130 Å²	130	128.4 Å²	128.4	68%	0.681	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	11	-174.3	-70.6	170.5	0	0	0	115.1	I773 T778	I773-L775 HydrophobicContact CG2-CD2 3.9Å; I773-L775 HydrophobicContact CG2-CG 4.15Å; I773-L775 PolarHBondContact O-N 3.18Å; L775-T778 PolarHBondContact O-OG1 3.28Å
776	F	49.3	Very low	45.8	Very low	160 Å²	160	124.7 Å²	124.7	70%	0.702	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-19.8	-178.3	-75.7	-83.3	0	0	0	114.3	N774	N774-F776 PolarHBondContact O-N 3.3Å; N774-F776 VanDerWaalsContact O-N 3.08Å; N774-F776 WeakPolarHBondContact OD1-CD2 2.88Å
777	N	48	Very low	46	Very low	151 Å²	151	122.3 Å²	122.3	81%	0.807	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-7	-178.9	-91.1	-3.7	0	0	0	114.9
778	T	46.6	Very low	45.2	Very low	109 Å²	109	126.5 Å²	126.5	67%	0.669	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	-7.6	176.1	30.3	0	0	0	0	113.9	L775	L775-T778 PolarHBondContact O-OG1 3.28Å
779	A	44.1	Very low	45	Very low	61 Å²	61	122.5 Å²	122.5	50%	0.504	75%	0.752	S	S	.	*	S	Bend	trans	-95.9	-19.7	-180	0	0	0	0	0	114.5
780	F	42.1	Very low	43.7	Very low	183 Å²	183	128.2 Å²	128.2	80%	0.803	76%	0.76	S	S	*	*	G	3₁₀ helix	trans	-85.4	-10	-179.6	-90.1	-82.2	0	0	0	114.7	L782	F780-L782 VanDerWaalsContact C-N 3.33Å
781	G	50.4	Low	43.2	Very low	76 Å²	76	127.4 Å²	127.4	78%	0.784	75%	0.752	S	S	*	*	G	3₁₀ helix	trans	-80.3	-7	173.5	0	0	0	0	0	115
782	L	45.2	Very low	42.2	Very low	152 Å²	152	130 Å²	130	80%	0.796	76%	0.761	S	S	*	*	G	3₁₀ helix	trans	-107.1	0.6	-171.2	-106.4	147.3	0	0	0	114.6	F780	F780-L782 VanDerWaalsContact C-N 3.33Å
783	L	45.4	Very low	41.3	Very low	142 Å²	142	128 Å²	128	74%	0.743	76%	0.763	S	S	*	*	S	Bend	trans	-121.7	13.8	-172.7	-79.8	168	0	0	0	116.5	M785	L783-M785 PolarHBondContact O-N 2.97Å
784	G	43.3	Very low	40.4	Very low	82 Å²	82	132.5 Å²	132.5	85%	0.845	77%	0.771	S	S	*	*			trans	43	50.2	149.5	0	0	0	0	0	119.5
785	M	38.6	Very low	39.2	Very low	180 Å²	180	137 Å²	137	89%	0.887	78%	0.778	S	S	*	*			trans	-134.8	107.3	166.4	-70.3	-180	75.3	0	0	109.9	L783	L783-M785 PolarHBondContact O-N 2.97Å
786	G	39	Very low	38.3	Very low	70 Å²	70	138.1 Å²	138.1	72%	0.722	79%	0.79	S	S	*	*			trans	-81.6	-165.6	156.7	0	0	0	0	0	110.3
787	P	43.8	Very low	37.5	Very low	115 Å²	115	134.6 Å²	134.6	75%	0.747	79%	0.79	S	S	*	*			cis	-144.9	-168.5	8.9	43.6	-23.2	0	0	0	115.1
788	E	30.3	Very low	36.7	Very low	195 Å²	195	132.6 Å²	132.6	91%	0.911	79%	0.788	S	S	*	*			trans	80.9	128.6	148.3	-76.3	-174.9	178.8	0	0	123
789	G	30.4	Very low	36	Very low	71 Å²	71	131.4 Å²	131.4	73%	0.732	80%	0.797	S	S	*	*			trans	131.6	75.4	138.5	0	0	0	0	0	119.2
790	Q	26.8	Very low	35.6	Very low	189 Å²	189	133.9 Å²	133.9	88%	0.883	81%	0.808	S	S	*	*			trans	50.4	162.8	136.7	-74.9	-175.3	2.8	0	0	122.8
791	P	39.8	Very low	35.1	Very low	99 Å²	99	130.3 Å²	130.3	64%	0.643	81%	0.806	S	S	*	*			cis	-137.7	164.2	-37.3	37.1	-19.6	0	0	0	115.3
792	L	26.4	Very low	34.7	Very low	165 Å²	165	132.5 Å²	132.5	86%	0.864	81%	0.806	S	S	*	*			trans	60	91.8	143.1	-68	160.8	0	0	0	120.7
793	G	29.5	Very low	34	Very low	85 Å²	85	128.3 Å²	128.3	88%	0.876	80%	0.8	S	S	*	*			trans	-108.1	109.5	145.9	0	0	0	0	0	109.6
794	R	31	Very low	33.2	Very low	238 Å²	238	131.3 Å²	131.3	90%	0.898	81%	0.81	S	S	*	*			trans	-74.2	134.5	-168.1	-156.3	175.2	-172.5	177.4	1	112
795	R	26.3	Very low	32.5	Very low	225 Å²	225	130.5 Å²	130.5	85%	0.849	80%	0.801	S	S	*	*			trans	-27.2	135.6	165.1	-63.5	171.1	178.3	178.9	-2.1	115.7
796	V	29.2	Very low	32.1	Very low	153 Å²	153	130.1 Å²	130.1	93%	0.927	80%	0.801	S	S	*	*			trans	-105.7	96.3	143.3	-175.9	0	0	0	0	106.8
797	A	30.9	Very low	32.1	Very low	85 Å²	85	131.8 Å²	131.8	70%	0.702	80%	0.802	S	S	*	*			trans	-133.4	109	162.4	0	0	0	0	0	106
798	S	30.8	Very low	32.1	Very low	110 Å²	110	131.4 Å²	131.4	77%	0.769	80%	0.8	S	S	*	*			trans	-175.1	83.8	149.4	57	0	0	0	0	109.2
799	G	32.8	Very low	32.1	Very low	83 Å²	83	130.4 Å²	130.4	86%	0.856	80%	0.795	S	S	*	*			trans	-123.3	87.3	146.2	0	0	0	0	0	107
800	P	35.5	Very low	32	Very low	113 Å²	113	132.5 Å²	132.5	73%	0.734	80%	0.798	S	S	*	*			trans	-83.8	135.9	165.5	34	-27.9	0	0	0	109.5
801	S	31.9	Very low	32.1	Very low	108 Å²	108	127.5 Å²	127.5	76%	0.755	79%	0.789	S	S	*	*			trans	-49.5	179.2	144.7	31.8	0	0	0	0	111.6
802	P	41.3	Very low	31.6	Very low	122 Å²	122	132 Å²	132	79%	0.792	80%	0.801	S	S	*	*			cis	-125.6	-176.6	3.2	25	2.4	0	0	0	110.2
803	G	30.3	Very low	31.9	Very low	64 Å²	64	128.3 Å²	128.3	66%	0.66	80%	0.795	S	S	*	*			cis	84.2	134.6	48.6	0	0	0	0	0	112.1
804	E	29.7	Very low	32.6	Very low	206 Å²	206	129.5 Å²	129.5	96%	0.963	79%	0.787	S	S	*	*			trans	84.5	133.5	164.9	-55.1	-178.4	165.5	0	0	117.7
805	G	28.4	Very low	32.6	Very low	64 Å²	64	126.9 Å²	126.9	66%	0.66	79%	0.785	S	S	*	*			cis	-168.8	165	3	0	0	0	0	0	106.8
806	I	30.7	Very low	33.1	Very low	172 Å²	172	120.6 Å²	120.6	88%	0.882	78%	0.781	S	S	*	*				-169.7	121.1	85.1	-78.2	149.1	0	0	0	107.6
807	S	38.1	Very low	33.6	Very low	106 Å²	106	119.5 Å²	119.5	74%	0.741	78%	0.778	S	S	*	*			trans	-86.6	171.2	152.5	-35.9	0	0	0	0	107.8
808	P	43.2	Very low	33.5	Very low	107 Å²	107	118.9 Å²	118.9	70%	0.695	78%	0.779	S	S	*	*			cis	-159	-177.1	39	41	-16.1	0	0	0	119.4
809	Q	30.7	Very low	33.6	Very low	174 Å²	174	121.5 Å²	121.5	81%	0.813	79%	0.785	S	S	*	*			trans	71.5	109.6	149.1	-80.4	174.3	13.8	0	0	122
810	S	28.9	Very low	33.5	Very low	115 Å²	115	125.4 Å²	125.4	80%	0.804	79%	0.786	S	S	*	*				104.7	146	98.3	76.9	0	0	0	0	110.8
811	A	28.8	Very low	33.2	Very low	83 Å²	83	128.8 Å²	128.8	69%	0.686	79%	0.791	S	S	*	*			cis	-164.2	171.5	9.9	0	0	0	0	0	110.8
812	Q	29.2	Very low	33.1	Very low	193 Å²	193	130.1 Å²	130.1	90%	0.902	80%	0.795	S	S	*	*			trans	82.2	124.9	148.9	-72.6	174.8	-5.9	0	0	122.2
813	A	33.7	Very low	32.8	Very low	89 Å²	89	130.7 Å²	130.7	74%	0.736	80%	0.796	S	S	*	*			trans	-87.4	167.3	149.4	0	0	0	0	0	109.2
814	P	44.1	Very low	33.5	Very low	109 Å²	109	132.8 Å²	132.8	71%	0.708	80%	0.798	S	S	*	*				-153.8	162.1	79.8	38.6	-17.9	0	0	0	118.2
815	Q	30.8	Very low	33.5	Very low	184 Å²	184	129.8 Å²	129.8	86%	0.86	79%	0.793	S	S	*	*			trans	75.3	117.3	135.5	-77.5	168.2	0.7	0	0	123.2
816	A	36.7	Very low	33.7	Very low	92 Å²	92	134.5 Å²	134.5	76%	0.76	80%	0.802	S	S	*	*			trans	-83.2	162.4	142.7	0	0	0	0	0	111.4
817	P	39.2	Very low	33.8	Very low	131 Å²	131	141.4 Å²	141.4	85%	0.851	82%	0.817	S	S	*	*				-132.4	158	126.4	37.5	-26.4	0	0	0	109.3
818	G	29.5	Very low	33.6	Very low	72 Å²	72	143.2 Å²	143.2	74%	0.742	82%	0.821	S	S	*	*			cis	174.4	148.7	5.1	0	0	0	0	0	105.5
819	D	32.7	Very low	33.1	Very low	164 Å²	164	145.1 Å²	145.1	88%	0.877	83%	0.828	S	S	*	*			trans	-53.7	144.8	179.1	-90.7	-40.5	0	0	0	113.6
820	N	29.7	Very low	33.3	Very low	165 Å²	165	143.4 Å²	143.4	88%	0.882	83%	0.829	S	S	*	*			trans	-149.9	130.6	139.3	-105.2	-21.6	0	0	0	111.4
821	H	30.5	Very low	33.5	Very low	184 Å²	184	145.1 Å²	145.1	85%	0.852	83%	0.83	S	S	*	*			trans	-46	149.3	172.3	-77.8	-38.8	0	0	0	114.7
822	V	29.5	Very low	33.8	Very low	137 Å²	137	149 Å²	149	83%	0.83	84%	0.839	S	S	*	*				176.9	136.2	111.5	165	0	0	0	0	109.4
823	V	33.9	Very low	34.1	Very low	133 Å²	133	146.1 Å²	146.1	81%	0.806	84%	0.835	S	S	*	*			trans	-117.2	170.5	160.5	-161	0	0	0	0	106.4
824	P	46.5	Very low	34.1	Very low	108 Å²	108	150.1 Å²	150.1	70%	0.701	84%	0.842	S	S	*	*				-108.5	162.2	-83.8	34.1	-18.6	0	0	0	112.4
825	V	27.8	Very low	33.4	Very low	143 Å²	143	153.3 Å²	153.3	87%	0.867	85%	0.852	S	S	*	*			trans	-141.9	128.5	153.5	-179.3	0	0	0	0	110.6
826	L	34.3	Very low	33.6	Very low	163 Å²	163	150.8 Å²	150.8	85%	0.853	85%	0.852	S	S	*	*			trans	-45.9	134.9	167.6	-70.7	128.7	0	0	0	114.1
827	R	33	Very low	33.3	Very low	317 Å²	317	156.1 Å²	156.1	100%	1.196	86%	0.86	S	S	*	*				-141	0	118.6	-106.5	-173.5	-176.7	-179.8	1.5	109.4

Retrieved 827 of 827 residues in 478 ms (Link to these results)

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