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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 X5D7S8, Species HUMAN (Homo sapiens, Human), Gene MVP, Length 673 aa.

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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	40.3	Very low	71.9	Confident	222 Å²	222	101.3 Å²	101.3	100%	1.094	50%	0.5	S	S	*	.				0	114.5	0	-67	-172	-173.3	0	0	107
2	A	45.4	Very low	73.5	Confident	74 Å²	74	99.1 Å²	99.1	61%	0.612	50%	0.499	S	S	*	.			trans	-73	124.6	178.5	0	0	0	0	0	109
3	T	55.9	Low	74.9	Confident	37 Å²	37	103.2 Å²	103.2	23%	0.227	51%	0.507	C	S	.	.			trans	-90.6	109.9	179.4	46.4	0	0	0	0	109.2	E5 A46	T3-E5 PolarHBondContact O-N 3.35Å; T3-A46 HydrophobicContact CG2-CB 4.08Å
4	E	60.6	Low	76.2	Confident	178 Å²	178	98.6 Å²	98.6	83%	0.832	48%	0.483	S	S	*	.			trans	-77.8	49.6	170.8	-68.6	-173.6	165.2	0	0	111.4
5	E	70.8	Confident	77.4	Confident	111 Å²	111	92.5 Å²	92.5	52%	0.519	45%	0.453	S	S	.	.			trans	-93.2	132.3	176.2	-67.7	-173.8	170	0	0	110.3	T3 I8	T3-E5 PolarHBondContact O-N 3.35Å; E5-I8 HydrophobicContact CB-CG1 4.08Å
6	F	75.8	Confident	78.3	Confident	125 Å²	125	86.8 Å²	86.8	55%	0.548	43%	0.425	S	S	.	.	S	Bend	trans	-74.3	-29	-179.8	-127.9	-86.1	0	0	0	112.5	R37	F6-R37 PolarHBondContact O-N 2.87Å
7	I	84.8	Confident	79.1	Confident	106 Å²	106	82.6 Å²	82.6	54%	0.544	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	118.2	-179.4	-58.1	176	0	0	0	107.9	T34	I7-T34 HydrophobicContact CG2-CG2 3.47Å; I7-T34 VanDerWaalsContact CG2-CG2 3.47Å
8	I	86.9	Confident	79.8	Confident	2 Å²	2	78 Å²	78	1%	0.01	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	113.4	-179	-63.1	162.6	0	0	0	108.4	E5 I10 I16 Y35 V43 P47	E5-I8 HydrophobicContact CB-CG1 4.08Å; I8-I10 HydrophobicContact CG2-CG1 4.23Å; I8-I10 PolarHBondContact O-N 3.46Å; I8-I16 HydrophobicContact CD1-CD1 4.48Å; I8-I16 HydrophobicContact CG2-CD1 4.24Å; I8-I16 HydrophobicContact CG2-CG2 4.46Å; I8-Y35 PolarHBondContact N-O 2.88Å; I8-Y35 PolarHBondContact O-N 3.47Å; I8-V43 HydrophobicContact CD1-CB 3.84Å; I8-V43 HydrophobicContact CD1-CG1 3.91Å; I8-V43 HydrophobicContact CD1-CG2 3.34Å; I8-P47 HydrophobicContact CG2-CG 3.72Å
9	R	88.7	Confident	80.3	Confident	207 Å²	207	75.1 Å²	75.1	78%	0.781	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.4	109.8	173.9	-173.8	174.5	-176.5	174.2	0.6	108.8	P11	R9-P11 VanDerWaalsContact O-CD 3.28Å; R9-P11 WeakPolarHBondContact O-CD 3.29Å
10	I	90.7	Very high	80.7	Confident	3 Å²	3	72.6 Å²	72.6	2%	0.015	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	110.7	176.2	-49.1	172.9	0	0	0	108	I8 H14 I16 E29 P32 K33	I8-I10 HydrophobicContact CG2-CG1 4.23Å; I8-I10 PolarHBondContact O-N 3.46Å; I10-H14 HydrophobicContact CG2-CB 4.06Å; I10-H14 VanDerWaalsContact CG2-O 3.3Å; I10-H14 WeakPolarHBondContact CG2-O 3.49Å; I10-I16 HydrophobicContact CD1-CD1 3.62Å; I10-I16 HydrophobicContact CD1-CG1 3.66Å; I10-I16 HydrophobicContact CG1-CD1 4.16Å; I10-I16 HydrophobicContact CG1-CG1 4.39Å; I10-I16 HydrophobicContact CG1-CG2 4.43Å; I10-E29 HydrophobicContact CD1-CB 4.17Å; I10-P32 WeakPolarHBondContact O-CA 3.37Å; I10-K33 HydrophobicContact CB-CG 4.36Å; I10-K33 WeakPolarHBondContact CB-O 3.28Å; I10-K33 HydrophobicContact CD1-CD 4.4Å; I10-K33 HydrophobicContact CD1-CG 3.87Å; I10-K33 HydrophobicContact CG1-CG 4.45Å; I10-K33 PolarHBondContact N-O 2.83Å; I10-K33 PolarHBondContact O-N 3.07Å; I10-K33 VanDerWaalsContact O-N 3.15Å
11	P	91.1	Very high	81	Confident	49 Å²	49	74 Å²	74	32%	0.318	36%	0.362	S	S	.	.			trans	-65.8	167.4	178.4	-18.3	32.4	0	0	0	112.5	R9 H14	R9-P11 VanDerWaalsContact O-CD 3.28Å; R9-P11 WeakPolarHBondContact O-CD 3.29Å; P11-H14 PolarHBondContact O-N 3.36Å
12	P	91.2	Very high	83.3	Confident	75 Å²	75	69.7 Å²	69.7	49%	0.487	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	143.4	167.6	-20.6	30	0	0	0	111.6	H14 P32	P12-H14 PolarHBondContact O-N 3.48Å; P12-H14 PolarHBondContact O-ND1 3.38Å; P12-P32 HydrophobicContact CG-CB 4.05Å
13	Y	91.9	Very high	85.1	Confident	153 Å²	153	68.9 Å²	68.9	60%	0.6	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.5	26.5	-178.8	-48.3	-69	0	0	0	115	M50 P96	Y13-M50 WeakPolarHBondContact O-CB 3.33Å; Y13-M50 WeakPolarHBondContact O-CG 3.43Å; Y13-M50 PolarHBondContact O-N 3.2Å; Y13-P96 HydrophobicContact CD1-CB 3.84Å; Y13-P96 HydrophobicContact CD1-CG 3.81Å; Y13-P96 HydrophobicContact CE1-CB 4.46Å; Y13-P96 HydrophobicContact CE1-CG 4.01Å
14	H	93.1	Very high	86.5	Confident	38 Å²	38	72.7 Å²	72.7	18%	0.176	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	157.9	170.6	-66.2	64.3	0	0	0	110.1	I10 P11 P12 G31 P47 M48 R49	I10-H14 HydrophobicContact CG2-CB 4.06Å; I10-H14 VanDerWaalsContact CG2-O 3.3Å; I10-H14 WeakPolarHBondContact CG2-O 3.49Å; P11-H14 PolarHBondContact O-N 3.36Å; P12-H14 PolarHBondContact O-N 3.48Å; P12-H14 PolarHBondContact O-ND1 3.38Å; H14-G31 PolarHBondContact O-N 3.06Å; H14-P47 HydrophobicContact CB-CB 4.18Å; H14-M48 CarbonylContact C-O 3.54Å; H14-M48 WeakPolarHBondContact CA-O 3.28Å; H14-M48 VanDerWaalsContact CB-O 3.32Å; H14-M48 WeakPolarHBondContact CB-O 3.41Å; H14-R49 VanDerWaalsContact NE2-CG 3.26Å; H14-R49 WeakPolarHBondContact NE2-CG 3.28Å
15	Y	94	Very high	87.8	Confident	8 Å²	8	64.8 Å²	64.8	3%	0.031	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	158.6	177.1	70.6	-80.3	0	0	0	111.4	H17 V28 E29 F45 M48 R49 M50 P98 L99	Y15-H17 AromaticContact CD2-CD2 3.95Å; Y15-H17 AromaticContact CD2-NE2 3.85Å; Y15-H17 AromaticContact CE2-NE2 3.54Å; Y15-V28 HydrophobicContact CD2-CG2 3.78Å; Y15-V28 HydrophobicContact CG-CG2 4.22Å; Y15-E29 WeakPolarHBondContact CA-O 3.36Å; Y15-F45 HydrophobicContact CD2-CE2 4.25Å; Y15-F45 HydrophobicContact CD2-CZ 4.18Å; Y15-F45 HydrophobicContact CE2-CE2 4.07Å; Y15-F45 AromaticContact CE2-CZ 3.78Å; Y15-F45 HydrophobicContact CE2-CZ 3.78Å; Y15-M48 WeakPolarHBondContact CD1-O 3.44Å; Y15-M48 HydrophobicContact CE1-CB 4.28Å; Y15-M48 HydrophobicContact CE2-CE 4.48Å; Y15-M48 PolarHBondContact N-O 3.35Å; Y15-M48 PolarHBondContact O-N 3.31Å; Y15-R49 WeakPolarHBondContact CE1-O 3.4Å; Y15-M50 HydrophobicContact CD1-CG 3.91Å; Y15-P98 HydrophobicContact CD1-CB 3.64Å; Y15-P98 HydrophobicContact CD2-CB 3.89Å; Y15-P98 HydrophobicContact CE1-CB 4.19Å; Y15-P98 HydrophobicContact CE2-CB 4.4Å; Y15-P98 HydrophobicContact CG-CB 3.47Å; Y15-P98 VanDerWaalsContact CG-CB 3.47Å; Y15-L99 HydrophobicContact CE2-CB 4.43Å; Y15-L99 VanDerWaalsContact CE2-O 3.28Å; Y15-L99 WeakPolarHBondContact CE2-O 3.16Å; Y15-L99 WeakPolarHBondContact OH-CB 3.49Å
16	I	92.2	Very high	88.7	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	159.3	168.7	63.5	178.5	0	0	0	109.4	I8 I10 V18 E29 Y35 V43 P47	I8-I16 HydrophobicContact CD1-CD1 4.48Å; I8-I16 HydrophobicContact CG2-CD1 4.24Å; I8-I16 HydrophobicContact CG2-CG2 4.46Å; I10-I16 HydrophobicContact CD1-CD1 3.62Å; I10-I16 HydrophobicContact CD1-CG1 3.66Å; I10-I16 HydrophobicContact CG1-CD1 4.16Å; I10-I16 HydrophobicContact CG1-CG1 4.39Å; I10-I16 HydrophobicContact CG1-CG2 4.43Å; I16-V18 HydrophobicContact CD1-CG2 3.92Å; I16-V18 HydrophobicContact CG1-CG2 4.09Å; I16-E29 HydrophobicContact CD1-CB 4.38Å; I16-E29 HydrophobicContact CG1-CB 3.79Å; I16-E29 PolarHBondContact N-O 3.5Å; I16-E29 PolarHBondContact O-N 3.19Å; I16-Y35 HydrophobicContact CD1-CD1 4.06Å; I16-Y35 HydrophobicContact CD1-CG 4.21Å; I16-V43 HydrophobicContact CB-CG1 4.15Å; I16-V43 HydrophobicContact CD1-CG1 4.07Å; I16-V43 HydrophobicContact CD1-CG2 4.28Å; I16-V43 HydrophobicContact CG2-CG1 4.49Å; I16-P47 HydrophobicContact CG2-CB 4.1Å; I16-P47 HydrophobicContact CG2-CG 3.78Å
17	H	92.3	Very high	89.3	Confident	16 Å²	16	57.7 Å²	57.7	7%	0.074	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	133.1	164.8	-66.4	170.2	0	0	0	110.2	Y15 R27 L44 F45 L99 P101	Y15-H17 AromaticContact CD2-CD2 3.95Å; Y15-H17 AromaticContact CD2-NE2 3.85Å; Y15-H17 AromaticContact CE2-NE2 3.54Å; H17-R27 WeakPolarHBondContact CA-O 3.36Å; H17-L44 HydrophobicContact CB-CB 4.19Å; H17-L44 HydrophobicContact CB-CD1 3.77Å; H17-L44 HydrophobicContact CB-CG 4.16Å; H17-L44 PolarHBondContact O-N 2.91Å; H17-F45 HydrophobicContact CB-CE1 3.68Å; H17-F45 HydrophobicContact CB-CZ 3.84Å; H17-F45 AromaticContact CD2-CZ 3.66Å; H17-F45 AromaticContact CE1-CE1 3.92Å; H17-F45 AromaticContact CE1-CZ 3.85Å; H17-F45 AromaticContact CG-CE1 3.46Å; H17-F45 VanDerWaalsContact CG-CE1 3.46Å; H17-F45 AromaticContact CG-CZ 3.41Å; H17-F45 VanDerWaalsContact CG-CZ 3.41Å; H17-F45 AromaticContact ND1-CE1 3.32Å; H17-F45 VanDerWaalsContact ND1-CE1 3.32Å; H17-F45 WeakPolarHBondContact ND1-CE1 3.45Å; H17-F45 AromaticContact ND1-CZ 3.58Å; H17-F45 AromaticContact NE2-CZ 3.91Å; H17-L99 PolarHBondContact CE1-O 3.38Å; H17-L99 PolarHBondContact NE2-O 3.15Å; H17-P101 HydrophobicContact CB-CG 4.47Å; H17-P101 VanDerWaalsContact CE1-CA 3.48Å; H17-P101 WeakPolarHBondContact CE1-CA 3.29Å
18	V	90.2	Very high	89.7	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	124.4	177.1	-174.4	0	0	0	0	108.6	I16 S26 R27 E29 Y35 E41 V43	I16-V18 HydrophobicContact CD1-CG2 3.92Å; I16-V18 HydrophobicContact CG1-CG2 4.09Å; V18-S26 WeakPolarHBondContact O-CA 3.4Å; V18-R27 PolarHBondContact N-O 3.33Å; V18-R27 PolarHBondContact O-N 3.37Å; V18-E29 HydrophobicContact CB-CG 4.4Å; V18-E29 HydrophobicContact CG2-CB 4.41Å; V18-E29 HydrophobicContact CG2-CG 3.71Å; V18-Y35 HydrophobicContact CG1-CE1 4.32Å; V18-Y35 HydrophobicContact CG2-CD1 4.45Å; V18-Y35 HydrophobicContact CG2-CE1 3.79Å; V18-Y35 HydrophobicContact CG2-CE2 4.49Å; V18-E41 HydrophobicContact CG1-CB 3.75Å; V18-E41 HydrophobicContact CG1-CG 4.03Å; V18-V43 HydrophobicContact CG2-CG2 4.15Å
19	L	90.2	Very high	89.8	Confident	22 Å²	22	55.3 Å²	55.3	12%	0.115	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	117.4	173.8	173.4	69.6	0	0	0	108.8	S26 E41 R42 L44	L19-S26 VanDerWaalsContact CD1-OG 3.28Å; L19-S26 WeakPolarHBondContact CD1-OG 3.44Å; L19-E41 CarbonylContact O-C 3.53Å; L19-E41 WeakPolarHBondContact O-CA 3.17Å; L19-R42 PolarHBondContact N-O 2.98Å; L19-R42 PolarHBondContact O-N 3.37Å; L19-L44 HydrophobicContact CB-CD2 4Å; L19-L44 HydrophobicContact CB-CG 4.44Å; L19-L44 HydrophobicContact CD2-CD2 4.42Å
20	D	89.1	Confident	90	Very high	26 Å²	26	48.2 Å²	48.2	14%	0.139	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	119.3	166.2	174	12.4	0	0	0	109.2	N22 S23 N24 V25 N40	D20-N22 VanDerWaalsContact C-N 3.33Å; D20-N22 PolarHBondContact OD1-N 2.93Å; D20-S23 WeakPolarHBondContact CB-OG 3.2Å; D20-S23 WeakPolarHBondContact OD2-CB 3.47Å; D20-S23 PolarHBondContact OD2-OG 3.32Å; D20-N24 CarbonylContact O-C 3.6Å; D20-N24 WeakPolarHBondContact O-CA 3.44Å; D20-N24 PolarHBondContact O-N 3.41Å; D20-V25 PolarHBondContact N-O 2.93Å; D20-V25 PolarHBondContact O-N 3.35Å; D20-N40 PolarHBondContact OD1-ND2 3.33Å
21	Q	86.9	Confident	89.9	Confident	101 Å²	101	48.6 Å²	48.6	47%	0.472	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-20.9	-176.2	-63.1	-177.7	-16.7	0	0	113.1	N40	Q21-N40 WeakPolarHBondContact CB-O 3.09Å; Q21-N40 PolarHBondContact N-O 3Å
22	N	86.9	Confident	89.9	Confident	132 Å²	132	51.2 Å²	51.2	71%	0.706	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-44.7	178.6	-70.9	-20.4	0	0	0	111.2	D20 N40	D20-N22 VanDerWaalsContact C-N 3.33Å; D20-N22 PolarHBondContact OD1-N 2.93Å; N22-N40 VanDerWaalsContact ND2-CB 3.33Å; N22-N40 WeakPolarHBondContact ND2-CB 3.38Å; N22-N40 PolarHBondContact ND2-ND2 3.42Å
23	S	83.3	Confident	89.8	Confident	58 Å²	58	50.9 Å²	50.9	41%	0.406	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-11	-179.4	61.6	0	0	0	0	113.4	D20 V25	D20-S23 WeakPolarHBondContact CB-OG 3.2Å; D20-S23 WeakPolarHBondContact OD2-CB 3.47Å; D20-S23 PolarHBondContact OD2-OG 3.32Å; S23-V25 PolarHBondContact O-N 2.84Å; S23-V25 WeakPolarHBondContact OG-CB 3.47Å; S23-V25 WeakPolarHBondContact OG-CG2 3.18Å; S23-V25 PolarHBondContact OG-N 3.36Å
24	N	86.1	Confident	89.7	Confident	116 Å²	116	47.7 Å²	47.7	62%	0.62	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	22.8	-167.8	-78.1	-40.1	0	0	0	114.1	D20	D20-N24 CarbonylContact O-C 3.6Å; D20-N24 WeakPolarHBondContact O-CA 3.44Å; D20-N24 PolarHBondContact O-N 3.41Å
25	V	87.6	Confident	89.5	Confident	12 Å²	12	47 Å²	47	7%	0.073	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	123.1	-178.8	178.4	0	0	0	0	110	D20 S23 T78 Q80	D20-V25 PolarHBondContact N-O 2.93Å; D20-V25 PolarHBondContact O-N 3.35Å; S23-V25 PolarHBondContact O-N 2.84Å; S23-V25 WeakPolarHBondContact OG-CB 3.47Å; S23-V25 WeakPolarHBondContact OG-CG2 3.18Å; S23-V25 PolarHBondContact OG-N 3.36Å; V25-T78 VanDerWaalsContact CG2-O 3.23Å; V25-T78 WeakPolarHBondContact CG2-O 3.49Å; V25-Q80 HydrophobicContact CG1-CB 4.21Å
26	S	89.8	Confident	89.2	Confident	20 Å²	20	51.3 Å²	51.3	14%	0.14	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	131.6	169	-63.3	0	0	0	0	110.4	V18 L19	V18-S26 WeakPolarHBondContact O-CA 3.4Å; L19-S26 VanDerWaalsContact CD1-OG 3.28Å; L19-S26 WeakPolarHBondContact CD1-OG 3.44Å
27	R	88.1	Confident	89	Confident	68 Å²	68	53.6 Å²	53.6	26%	0.257	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	159.3	176.4	68.3	-174.2	-170.8	-92.3	0.3	111.9	H17 V18 E29 Y35 E41	H17-R27 WeakPolarHBondContact CA-O 3.36Å; V18-R27 PolarHBondContact N-O 3.33Å; V18-R27 PolarHBondContact O-N 3.37Å; R27-E29 IonicContact CZ-OE1 3.17Å; R27-E29 IonicContact NE-OE1 2.67Å; R27-E29 PolarHBondContact NE-OE1 2.82Å; R27-E29 IonicContact NH2-OE1 3.32Å; R27-E29 PolarHBondContact NH2-OE1 2.7Å; R27-Y35 PolarHBondContact NH2-OH 3.01Å; R27-E41 IonicContact CZ-OE1 3.8Å; R27-E41 IonicContact NH1-OE1 2.67Å; R27-E41 PolarHBondContact NH1-OE1 3.43Å; R27-E41 IonicContact NH2-OE1 3.19Å; R27-E41 PolarHBondContact NH2-OE1 3.1Å; R27-E41 IonicContact NH2-OE2 3.25Å
28	V	92.6	Very high	88.7	Confident	26 Å²	26	57.8 Å²	57.8	16%	0.158	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	135.3	177.2	65.6	0	0	0	0	110.7	Y15 V30 P98 Y100	Y15-V28 HydrophobicContact CD2-CG2 3.78Å; Y15-V28 HydrophobicContact CG-CG2 4.22Å; V28-V30 HydrophobicContact CG2-CG2 4.31Å; V28-P98 HydrophobicContact CG2-CB 3.88Å; V28-P98 HydrophobicContact CG2-CG 4.23Å; V28-Y100 HydrophobicContact CB-CD1 4.25Å; V28-Y100 HydrophobicContact CG1-CD1 3.44Å; V28-Y100 VanDerWaalsContact CG1-CD1 3.44Å; V28-Y100 HydrophobicContact CG1-CE1 3.31Å; V28-Y100 HydrophobicContact CG1-CG 4.39Å
29	E	90.6	Very high	88.4	Confident	31 Å²	31	64.7 Å²	64.7	15%	0.145	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	111.8	176.1	-65.3	-66.4	173.7	0	0	108.8	I10 Y15 I16 V18 R27 K33 Y35	I10-E29 HydrophobicContact CD1-CB 4.17Å; Y15-E29 WeakPolarHBondContact CA-O 3.36Å; I16-E29 HydrophobicContact CD1-CB 4.38Å; I16-E29 HydrophobicContact CG1-CB 3.79Å; I16-E29 PolarHBondContact N-O 3.5Å; I16-E29 PolarHBondContact O-N 3.19Å; V18-E29 HydrophobicContact CB-CG 4.4Å; V18-E29 HydrophobicContact CG2-CB 4.41Å; V18-E29 HydrophobicContact CG2-CG 3.71Å; R27-E29 IonicContact CZ-OE1 3.17Å; R27-E29 IonicContact NE-OE1 2.67Å; R27-E29 PolarHBondContact NE-OE1 2.82Å; R27-E29 IonicContact NH2-OE1 3.32Å; R27-E29 PolarHBondContact NH2-OE1 2.7Å; E29-K33 WeakPolarHBondContact OE2-CE 3.5Å; E29-K33 IonicContact OE2-NZ 3.3Å; E29-K33 PolarHBondContact OE2-NZ 2.81Å; E29-Y35 HydrophobicContact CB-CD2 4.38Å; E29-Y35 HydrophobicContact CB-CE2 4.48Å; E29-Y35 HydrophobicContact CG-CD2 4.1Å; E29-Y35 HydrophobicContact CG-CE2 3.72Å
30	V	92.6	Very high	88.2	Confident	58 Å²	58	65.9 Å²	65.9	35%	0.352	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	140.4	-176.5	167	0	0	0	0	111.9	V28 K33 M50 P98	V28-V30 HydrophobicContact CG2-CG2 4.31Å; V30-K33 WeakPolarHBondContact O-CD 3.34Å; V30-K33 WeakPolarHBondContact O-CE 3.4Å; V30-K33 PolarHBondContact O-NZ 2.96Å; V30-K33 VanDerWaalsContact O-NZ 3.13Å; V30-M50 HydrophobicContact CB-CE 3.96Å; V30-M50 HydrophobicContact CG1-CE 3.27Å; V30-M50 HydrophobicContact CG2-CE 3.62Å; V30-P98 HydrophobicContact CG2-CB 4.24Å; V30-P98 HydrophobicContact CG2-CG 3.81Å
31	G	89.1	Confident	88.1	Confident	11 Å²	11	65.4 Å²	65.4	11%	0.113	35%	0.348	C	S	.	.	S	Bend	trans	-86	169.4	171.8	0	0	0	0	0	114.2	H14	H14-G31 PolarHBondContact O-N 3.06Å
32	P	90.2	Very high	88.2	Confident	104 Å²	104	66.3 Å²	66.3	68%	0.675	35%	0.347	S	S	*	.	S	Bend	cis	-83.2	117.6	8.7	30.6	-32.6	0	0	0	112.8	I10 P12	I10-P32 WeakPolarHBondContact O-CA 3.37Å; P12-P32 HydrophobicContact CG-CB 4.05Å
33	K	89.8	Confident	88.2	Confident	68 Å²	68	60.1 Å²	60.1	30%	0.296	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	149.2	172.9	67.7	-173.4	175.5	-157.5	0	111.8	I10 E29 V30	I10-K33 HydrophobicContact CB-CG 4.36Å; I10-K33 WeakPolarHBondContact CB-O 3.28Å; I10-K33 HydrophobicContact CD1-CD 4.4Å; I10-K33 HydrophobicContact CD1-CG 3.87Å; I10-K33 HydrophobicContact CG1-CG 4.45Å; I10-K33 PolarHBondContact N-O 2.83Å; I10-K33 PolarHBondContact O-N 3.07Å; I10-K33 VanDerWaalsContact O-N 3.15Å; E29-K33 WeakPolarHBondContact OE2-CE 3.5Å; E29-K33 IonicContact OE2-NZ 3.3Å; E29-K33 PolarHBondContact OE2-NZ 2.81Å; V30-K33 WeakPolarHBondContact O-CD 3.34Å; V30-K33 WeakPolarHBondContact O-CE 3.4Å; V30-K33 PolarHBondContact O-NZ 2.96Å; V30-K33 VanDerWaalsContact O-NZ 3.13Å
34	T	89.5	Confident	88.4	Confident	87 Å²	87	60.2 Å²	60.2	53%	0.534	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	104.1	166.4	-55.7	0	0	0	0	107.2	I7	I7-T34 HydrophobicContact CG2-CG2 3.47Å; I7-T34 VanDerWaalsContact CG2-CG2 3.47Å
35	Y	88.8	Confident	88.5	Confident	23 Å²	23	56.5 Å²	56.5	9%	0.09	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	126	-179.5	-172.6	-97	0	0	0	109.9	I8 I16 V18 R27 E29 R37 E41	I8-Y35 PolarHBondContact N-O 2.88Å; I8-Y35 PolarHBondContact O-N 3.47Å; I16-Y35 HydrophobicContact CD1-CD1 4.06Å; I16-Y35 HydrophobicContact CD1-CG 4.21Å; V18-Y35 HydrophobicContact CG1-CE1 4.32Å; V18-Y35 HydrophobicContact CG2-CD1 4.45Å; V18-Y35 HydrophobicContact CG2-CE1 3.79Å; V18-Y35 HydrophobicContact CG2-CE2 4.49Å; R27-Y35 PolarHBondContact NH2-OH 3.01Å; E29-Y35 HydrophobicContact CB-CD2 4.38Å; E29-Y35 HydrophobicContact CB-CE2 4.48Å; E29-Y35 HydrophobicContact CG-CD2 4.1Å; E29-Y35 HydrophobicContact CG-CE2 3.72Å; Y35-R37 HydrophobicContact CE1-CB 4.29Å; Y35-E41 PolarHBondContact OH-OE1 2.97Å; Y35-E41 PolarHBondContact OH-OE2 3.49Å
36	I	88.5	Confident	88.6	Confident	99 Å²	99	58.1 Å²	58.1	51%	0.508	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	114.5	175.2	-56.8	172.9	0	0	0	106.9	Q38	I36-Q38 PolarHBondContact O-NE2 2.95Å
37	R	86.4	Confident	88.6	Confident	47 Å²	47	59.1 Å²	59.1	18%	0.177	31%	0.309	C	S	.	.			trans	-71.9	130.7	-177	-170.4	-171.4	76.5	176.6	0.6	110	F6 Y35 E41 V43	F6-R37 PolarHBondContact O-N 2.87Å; Y35-R37 HydrophobicContact CE1-CB 4.29Å; R37-E41 WeakPolarHBondContact CD-O 3.48Å; R37-E41 HydrophobicContact CG-CB 3.84Å; R37-E41 WeakPolarHBondContact CG-O 3.47Å; R37-V43 HydrophobicContact CG-CG2 4.4Å
38	Q	86.6	Confident	88.8	Confident	104 Å²	104	59.8 Å²	59.8	49%	0.486	32%	0.316	S	S	.	.			trans	-79.1	163.9	172.5	-54.2	-56.7	-52.1	0	0	111.3	I36 N40 E41	I36-Q38 PolarHBondContact O-NE2 2.95Å; Q38-N40 VanDerWaalsContact C-N 3.26Å; Q38-N40 PolarHBondContact O-N 3.14Å; Q38-E41 HydrophobicContact CB-CG 4.04Å; Q38-E41 PolarHBondContact N-OE2 3.46Å; Q38-E41 VanDerWaalsContact N-OE2 3.07Å; Q38-E41 PolarHBondContact O-N 3.06Å
39	D	83.6	Confident	88.8	Confident	146 Å²	146	68 Å²	68	78%	0.781	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-33.9	-175.7	-68.4	-24.4	0	0	0	113.2	E41	D39-E41 VanDerWaalsContact C-N 3.31Å; D39-E41 PolarHBondContact O-N 3.49Å
40	N	87.1	Confident	88.9	Confident	47 Å²	47	67.5 Å²	67.5	25%	0.251	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	8.7	178.4	61.1	-52.1	0	0	0	113.8	D20 Q21 N22 Q38	D20-N40 PolarHBondContact OD1-ND2 3.33Å; Q21-N40 WeakPolarHBondContact CB-O 3.09Å; Q21-N40 PolarHBondContact N-O 3Å; N22-N40 VanDerWaalsContact ND2-CB 3.33Å; N22-N40 WeakPolarHBondContact ND2-CB 3.38Å; N22-N40 PolarHBondContact ND2-ND2 3.42Å; Q38-N40 VanDerWaalsContact C-N 3.26Å; Q38-N40 PolarHBondContact O-N 3.14Å
41	E	87.1	Confident	88.9	Confident	16 Å²	16	65.5 Å²	65.5	8%	0.075	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	142.4	-174.7	-67.9	179.1	160.9	0	0	112.9	V18 L19 R27 Y35 R37 Q38 D39	V18-E41 HydrophobicContact CG1-CB 3.75Å; V18-E41 HydrophobicContact CG1-CG 4.03Å; L19-E41 CarbonylContact O-C 3.53Å; L19-E41 WeakPolarHBondContact O-CA 3.17Å; R27-E41 IonicContact CZ-OE1 3.8Å; R27-E41 IonicContact NH1-OE1 2.67Å; R27-E41 PolarHBondContact NH1-OE1 3.43Å; R27-E41 IonicContact NH2-OE1 3.19Å; R27-E41 PolarHBondContact NH2-OE1 3.1Å; R27-E41 IonicContact NH2-OE2 3.25Å; Y35-E41 PolarHBondContact OH-OE1 2.97Å; Y35-E41 PolarHBondContact OH-OE2 3.49Å; R37-E41 WeakPolarHBondContact CD-O 3.48Å; R37-E41 HydrophobicContact CG-CB 3.84Å; R37-E41 WeakPolarHBondContact CG-O 3.47Å; Q38-E41 HydrophobicContact CB-CG 4.04Å; Q38-E41 PolarHBondContact N-OE2 3.46Å; Q38-E41 VanDerWaalsContact N-OE2 3.07Å; Q38-E41 PolarHBondContact O-N 3.06Å; D39-E41 VanDerWaalsContact C-N 3.31Å; D39-E41 PolarHBondContact O-N 3.49Å
42	R	87.1	Confident	89.1	Confident	120 Å²	120	68.3 Å²	68.3	45%	0.453	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	123.6	174.1	-173.2	176.9	69.8	-179.6	1.6	110.5	L19	L19-R42 PolarHBondContact N-O 2.98Å; L19-R42 PolarHBondContact O-N 3.37Å
43	V	88.3	Confident	89.2	Confident	2 Å²	2	63.6 Å²	63.6	1%	0.012	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	128.2	172.1	-177.6	0	0	0	0	109.7	I8 I16 V18 R37 F45	I8-V43 HydrophobicContact CD1-CB 3.84Å; I8-V43 HydrophobicContact CD1-CG1 3.91Å; I8-V43 HydrophobicContact CD1-CG2 3.34Å; I16-V43 HydrophobicContact CB-CG1 4.15Å; I16-V43 HydrophobicContact CD1-CG1 4.07Å; I16-V43 HydrophobicContact CD1-CG2 4.28Å; I16-V43 HydrophobicContact CG2-CG1 4.49Å; V18-V43 HydrophobicContact CG2-CG2 4.15Å; R37-V43 HydrophobicContact CG-CG2 4.4Å; V43-F45 VanDerWaalsContact CG1-O 3.25Å; V43-F45 WeakPolarHBondContact CG1-O 3.47Å
44	L	87.9	Confident	89.4	Confident	59 Å²	59	62.7 Å²	62.7	31%	0.309	32%	0.315	S	S	.	.			trans	-79.4	-34.3	-173.7	-60.1	-176.4	0	0	0	112.7	H17 L19	H17-L44 HydrophobicContact CB-CB 4.19Å; H17-L44 HydrophobicContact CB-CD1 3.77Å; H17-L44 HydrophobicContact CB-CG 4.16Å; H17-L44 PolarHBondContact O-N 2.91Å; L19-L44 HydrophobicContact CB-CD2 4Å; L19-L44 HydrophobicContact CB-CG 4.44Å; L19-L44 HydrophobicContact CD2-CD2 4.42Å
45	F	88.1	Confident	89.4	Confident	39 Å²	39	63.5 Å²	63.5	17%	0.171	32%	0.322	C	S	.	.	S	Bend	trans	-154.4	156.8	179.7	50.6	-100.7	0	0	0	111.9	Y15 H17 V43 M48	Y15-F45 HydrophobicContact CD2-CE2 4.25Å; Y15-F45 HydrophobicContact CD2-CZ 4.18Å; Y15-F45 HydrophobicContact CE2-CE2 4.07Å; Y15-F45 AromaticContact CE2-CZ 3.78Å; Y15-F45 HydrophobicContact CE2-CZ 3.78Å; H17-F45 HydrophobicContact CB-CE1 3.68Å; H17-F45 HydrophobicContact CB-CZ 3.84Å; H17-F45 AromaticContact CD2-CZ 3.66Å; H17-F45 AromaticContact CE1-CE1 3.92Å; H17-F45 AromaticContact CE1-CZ 3.85Å; H17-F45 AromaticContact CG-CE1 3.46Å; H17-F45 VanDerWaalsContact CG-CE1 3.46Å; H17-F45 AromaticContact CG-CZ 3.41Å; H17-F45 VanDerWaalsContact CG-CZ 3.41Å; H17-F45 AromaticContact ND1-CE1 3.32Å; H17-F45 VanDerWaalsContact ND1-CE1 3.32Å; H17-F45 WeakPolarHBondContact ND1-CE1 3.45Å; H17-F45 AromaticContact ND1-CZ 3.58Å; H17-F45 AromaticContact NE2-CZ 3.91Å; V43-F45 VanDerWaalsContact CG1-O 3.25Å; V43-F45 WeakPolarHBondContact CG1-O 3.47Å; F45-M48 HydrophobicContact CD1-CE 3.9Å; F45-M48 HydrophobicContact CD2-CB 4.33Å; F45-M48 HydrophobicContact CD2-CE 3.46Å; F45-M48 VanDerWaalsContact CD2-CE 3.46Å; F45-M48 HydrophobicContact CD2-CG 3.7Å; F45-M48 HydrophobicContact CD2-SD 4.18Å; F45-M48 HydrophobicContact CE1-CE 3.66Å; F45-M48 HydrophobicContact CE2-CB 4.12Å; F45-M48 HydrophobicContact CE2-CE 3.19Å; F45-M48 HydrophobicContact CE2-CG 3.94Å; F45-M48 HydrophobicContact CE2-SD 4.34Å; F45-M48 HydrophobicContact CG-CE 3.8Å; F45-M48 HydrophobicContact CZ-CE 3.31Å
46	A	88.5	Confident	89.5	Confident	46 Å²	46	72.1 Å²	72.1	38%	0.38	35%	0.354	S	S	.	.	S	Bend	trans	-63.8	153.8	173.9	0	0	0	0	0	111.7	T3 M48	T3-A46 HydrophobicContact CG2-CB 4.08Å; A46-M48 PolarHBondContact O-N 3Å
47	P	90.9	Very high	89.7	Confident	41 Å²	41	70.1 Å²	70.1	27%	0.266	34%	0.343	S	S	.	.			trans	-45	111.7	-175.6	-30.1	35.2	0	0	0	114.2	I8 H14 I16	I8-P47 HydrophobicContact CG2-CG 3.72Å; H14-P47 HydrophobicContact CB-CB 4.18Å; I16-P47 HydrophobicContact CG2-CB 4.1Å; I16-P47 HydrophobicContact CG2-CG 3.78Å
48	M	90.9	Very high	90.1	Very high	82 Å²	82	69 Å²	69	40%	0.404	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	149	177.6	-73.7	-159.5	-68.5	0	0	110.7	H14 Y15 F45 A46	H14-M48 CarbonylContact C-O 3.54Å; H14-M48 WeakPolarHBondContact CA-O 3.28Å; H14-M48 VanDerWaalsContact CB-O 3.32Å; H14-M48 WeakPolarHBondContact CB-O 3.41Å; Y15-M48 WeakPolarHBondContact CD1-O 3.44Å; Y15-M48 HydrophobicContact CE1-CB 4.28Å; Y15-M48 HydrophobicContact CE2-CE 4.48Å; Y15-M48 PolarHBondContact N-O 3.35Å; Y15-M48 PolarHBondContact O-N 3.31Å; F45-M48 HydrophobicContact CD1-CE 3.9Å; F45-M48 HydrophobicContact CD2-CB 4.33Å; F45-M48 HydrophobicContact CD2-CE 3.46Å; F45-M48 VanDerWaalsContact CD2-CE 3.46Å; F45-M48 HydrophobicContact CD2-CG 3.7Å; F45-M48 HydrophobicContact CD2-SD 4.18Å; F45-M48 HydrophobicContact CE1-CE 3.66Å; F45-M48 HydrophobicContact CE2-CB 4.12Å; F45-M48 HydrophobicContact CE2-CE 3.19Å; F45-M48 HydrophobicContact CE2-CG 3.94Å; F45-M48 HydrophobicContact CE2-SD 4.34Å; F45-M48 HydrophobicContact CG-CE 3.8Å; F45-M48 HydrophobicContact CZ-CE 3.31Å; A46-M48 PolarHBondContact O-N 3Å
49	R	92.3	Very high	90.4	Very high	199 Å²	199	64 Å²	64	75%	0.751	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.2	138.2	175.2	-77.3	-177.6	147	-172.3	-9	110.9	H14 Y15	H14-R49 VanDerWaalsContact NE2-CG 3.26Å; H14-R49 WeakPolarHBondContact NE2-CG 3.28Å; Y15-R49 WeakPolarHBondContact CE1-O 3.4Å
50	M	93.5	Very high	90.9	Very high	19 Å²	19	57.9 Å²	57.9	9%	0.094	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-61.6	152.3	166.4	-72.7	-179.2	172.9	0	0	110.9	Y13 Y15 V30 T52 P96 F97 P98	Y13-M50 WeakPolarHBondContact O-CB 3.33Å; Y13-M50 WeakPolarHBondContact O-CG 3.43Å; Y13-M50 PolarHBondContact O-N 3.2Å; Y15-M50 HydrophobicContact CD1-CG 3.91Å; V30-M50 HydrophobicContact CB-CE 3.96Å; V30-M50 HydrophobicContact CG1-CE 3.27Å; V30-M50 HydrophobicContact CG2-CE 3.62Å; M50-T52 PolarHBondContact O-N 2.91Å; M50-P96 HydrophobicContact CB-CB 3.98Å; M50-P96 HydrophobicContact SD-CB 4.29Å; M50-F97 WeakPolarHBondContact CA-O 3.48Å; M50-F97 WeakPolarHBondContact CB-O 3.36Å; M50-P98 HydrophobicContact CE-CB 4.13Å; M50-P98 HydrophobicContact CE-CG 4.19Å; M50-P98 HydrophobicContact CG-CB 4.38Å
51	V	93.1	Very high	91.2	Very high	16 Å²	16	55.6 Å²	55.6	10%	0.097	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	118.1	174.7	-177.3	0	0	0	0	107.7	V53 P96 F97 L99 L105	V51-V53 HydrophobicContact CG1-CG2 4.23Å; V51-P96 WeakPolarHBondContact O-CA 3.48Å; V51-F97 HydrophobicContact CB-CD2 4.24Å; V51-F97 HydrophobicContact CB-CE1 4.25Å; V51-F97 HydrophobicContact CB-CE2 3.69Å; V51-F97 HydrophobicContact CB-CZ 3.71Å; V51-F97 HydrophobicContact CG1-CE1 4.22Å; V51-F97 HydrophobicContact CG1-CE2 4.09Å; V51-F97 HydrophobicContact CG1-CZ 3.65Å; V51-F97 HydrophobicContact CG2-CE2 4.2Å; V51-F97 PolarHBondContact N-O 3.1Å; V51-F97 PolarHBondContact O-N 3.49Å; V51-F97 VanDerWaalsContact O-N 3.12Å; V51-L99 HydrophobicContact CG2-CD1 4.37Å; V51-L99 HydrophobicContact CG2-CD2 4.19Å; V51-L99 HydrophobicContact CG2-CG 4.13Å; V51-L105 HydrophobicContact CG1-CD1 4.43Å; V51-L105 HydrophobicContact CG2-CD2 4.38Å
52	T	92.4	Very high	91.5	Very high	71 Å²	71	55.4 Å²	55.4	44%	0.436	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	110.6	176.9	-58.4	0	0	0	0	108.2	M50 P54 P96 I109	M50-T52 PolarHBondContact O-N 2.91Å; T52-P54 VanDerWaalsContact O-CD 3.31Å; T52-P54 WeakPolarHBondContact O-CD 3.38Å; T52-P96 HydrophobicContact CG2-CG 4.16Å; T52-I109 WeakPolarHBondContact O-CD1 3.36Å
53	V	93.1	Very high	91.8	Very high	5 Å²	5	51.7 Å²	51.7	3%	0.03	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	111	178	-176.6	0	0	0	0	108.8	V51 H57 C59 A93 F97	V51-V53 HydrophobicContact CG1-CG2 4.23Å; V53-H57 HydrophobicContact CG1-CB 4.17Å; V53-H57 VanDerWaalsContact CG1-O 3.26Å; V53-H57 WeakPolarHBondContact CG1-O 3.38Å; V53-C59 HydrophobicContact CG2-CB 4.37Å; V53-C59 VanDerWaalsContact CG2-SG 3.5Å; V53-A93 WeakPolarHBondContact O-CA 3.35Å; V53-F97 HydrophobicContact CG2-CE1 3.88Å; V53-F97 HydrophobicContact CG2-CZ 4.24Å
54	P	92.6	Very high	92	Very high	49 Å²	49	51.6 Å²	51.6	32%	0.318	26%	0.261	S	S	.	.			trans	-65.7	161.8	178.4	-19.3	33	0	0	0	112.2	T52 R56 H57 I109	T52-P54 VanDerWaalsContact O-CD 3.31Å; T52-P54 WeakPolarHBondContact O-CD 3.38Å; P54-R56 PolarHBondContact O-N 2.92Å; P54-H57 WeakPolarHBondContact O-CB 3.42Å; P54-H57 PolarHBondContact O-N 3.28Å; P54-H57 VanDerWaalsContact O-N 3.14Å; P54-I109 HydrophobicContact CG-CG2 4.3Å
55	P	91.3	Very high	92.2	Very high	103 Å²	103	48.8 Å²	48.8	67%	0.669	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.6	142.1	169.1	-26.2	35.1	0	0	0	111.9	H57	P55-H57 PolarHBondContact O-N 3.25Å; P55-H57 PolarHBondContact O-ND1 3.14Å
56	R	90.3	Very high	92.3	Very high	204 Å²	204	47.7 Å²	47.7	77%	0.77	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.9	18.9	-177.3	-53.8	-179.9	179.3	169.9	-1.1	115.2	P54 L112	P54-R56 PolarHBondContact O-N 2.92Å; R56-L112 WeakPolarHBondContact O-CB 3.39Å; R56-L112 PolarHBondContact O-N 3.43Å
57	H	93.4	Very high	92.2	Very high	57 Å²	57	50.5 Å²	50.5	26%	0.264	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	164.3	171.4	-63.9	66.2	0	0	0	110	V53 P54 P55 I109 T110	V53-H57 HydrophobicContact CG1-CB 4.17Å; V53-H57 VanDerWaalsContact CG1-O 3.26Å; V53-H57 WeakPolarHBondContact CG1-O 3.38Å; P54-H57 WeakPolarHBondContact O-CB 3.42Å; P54-H57 PolarHBondContact O-N 3.28Å; P54-H57 VanDerWaalsContact O-N 3.14Å; P55-H57 PolarHBondContact O-N 3.25Å; P55-H57 PolarHBondContact O-ND1 3.14Å; H57-I109 HydrophobicContact CB-CG2 3.84Å; H57-T110 CarbonylContact C-O 3.59Å; H57-T110 VanDerWaalsContact CA-O 3.23Å; H57-T110 WeakPolarHBondContact CA-O 3.27Å; H57-T110 WeakPolarHBondContact CB-O 3.27Å
58	Y	94.7	Very high	92	Very high	24 Å²	24	51 Å²	51	9%	0.094	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	163.1	171.4	74.4	-77.9	0	0	0	110	I90 R91 K107 T110 L112 P153	Y58-I90 HydrophobicContact CD2-CG2 3.9Å; Y58-I90 HydrophobicContact CG-CG2 4.34Å; Y58-R91 VanDerWaalsContact CA-O 3.27Å; Y58-R91 WeakPolarHBondContact CA-O 3.23Å; Y58-K107 HydrophobicContact CE2-CD 4.2Å; Y58-K107 PolarHBondContact OH-NZ 3.21Å; Y58-T110 VanDerWaalsContact CD1-O 3.27Å; Y58-T110 WeakPolarHBondContact CD1-O 3.35Å; Y58-T110 HydrophobicContact CE1-CG2 3.83Å; Y58-T110 PolarHBondContact N-O 2.9Å; Y58-T110 PolarHBondContact O-N 3.05Å; Y58-L112 HydrophobicContact CD1-CD2 3.6Å; Y58-L112 HydrophobicContact CD1-CG 4.25Å; Y58-L112 HydrophobicContact CE1-CD2 4.36Å; Y58-L112 HydrophobicContact CG-CD2 4.15Å; Y58-P153 HydrophobicContact CD1-CG 3.91Å; Y58-P153 HydrophobicContact CD2-CG 3.7Å; Y58-P153 HydrophobicContact CE1-CG 3.76Å; Y58-P153 HydrophobicContact CE2-CB 4.32Å; Y58-P153 HydrophobicContact CE2-CG 3.54Å; Y58-P153 HydrophobicContact CG-CG 3.87Å
59	C	93.1	Very high	91.7	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	160.7	165	64.7	0	0	0	0	109.2	V53 R91 L105 K107	V53-C59 HydrophobicContact CG2-CB 4.37Å; V53-C59 VanDerWaalsContact CG2-SG 3.5Å; C59-R91 PolarHBondContact N-O 2.92Å; C59-R91 PolarHBondContact O-N 3.4Å; C59-L105 HydrophobicContact CB-CD1 3.88Å; C59-K107 WeakPolarHBondContact CB-O 3.48Å
60	T	93.4	Very high	91.2	Very high	16 Å²	16	49.8 Å²	49.8	10%	0.098	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	124.5	177.4	-53.6	0	0	0	0	109.1	L88 E89 I90 E106 K107	T60-L88 HydrophobicContact CG2-CB 4.09Å; T60-L88 HydrophobicContact CG2-CD1 4.46Å; T60-L88 HydrophobicContact CG2-CD2 4.03Å; T60-L88 HydrophobicContact CG2-CG 4.42Å; T60-E89 WeakPolarHBondContact CA-O 3.45Å; T60-I90 HydrophobicContact CG2-CG1 4.49Å; T60-E106 HydrophobicContact CG2-CB 4.46Å; T60-E106 PolarHBondContact O-N 2.62Å; T60-K107 PolarHBondContact N-O 3.25Å; T60-K107 PolarHBondContact O-N 3.03Å; T60-K107 VanDerWaalsContact O-N 3.1Å
61	V	93.8	Very high	90.4	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	125.2	177.1	180	0	0	0	0	108.7	L88 E89 F97 L99 E103 V104 L105	V61-L88 WeakPolarHBondContact O-CA 3.3Å; V61-E89 PolarHBondContact N-O 2.85Å; V61-E89 PolarHBondContact O-N 3.29Å; V61-F97 HydrophobicContact CG2-CE2 4.43Å; V61-L99 HydrophobicContact CG1-CD2 4.28Å; V61-L99 HydrophobicContact CG2-CD2 4.19Å; V61-E103 HydrophobicContact CG1-CB 3.9Å; V61-E103 HydrophobicContact CG1-CG 4.04Å; V61-V104 CarbonylContact C-O 3.54Å; V61-V104 WeakPolarHBondContact CA-O 3.46Å; V61-L105 HydrophobicContact CG2-CD1 4.23Å
62	A	93.3	Very high	90	Very high	12 Å²	12	55.3 Å²	55.3	10%	0.099	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	145.3	170.6	0	0	0	0	0	111	L88 E103 V104 E106	A62-L88 HydrophobicContact CB-CD2 3.88Å; A62-E103 WeakPolarHBondContact O-CA 3.39Å; A62-V104 PolarHBondContact N-O 2.81Å; A62-V104 PolarHBondContact O-N 2.92Å; A62-E106 HydrophobicContact CB-CB 4.09Å
63	N	92.9	Very high	89.7	Confident	42 Å²	42	53.1 Å²	53.1	23%	0.225	29%	0.288	C	S	.	.	S	Bend	trans	55.6	51.9	-174.6	-51.9	-55.8	0	0	0	113.5	L83 R84 A86 D87 E103	N63-L83 HydrophobicContact CB-CD1 4.27Å; N63-R84 WeakPolarHBondContact CA-O 3.29Å; N63-A86 PolarHBondContact OD1-N 3.43Å; N63-D87 PolarHBondContact N-O 3.29Å; N63-E103 WeakPolarHBondContact O-CG 3.25Å
64	P	93.1	Very high	89.5	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-62.8	149.8	-173.2	29.5	-37.6	0	0	0	112.2	R84 D87 E89 E103	P64-R84 HydrophobicContact CG-CB 4.21Å; P64-R84 PolarHBondContact O-N 2.91Å; P64-D87 WeakPolarHBondContact CD-O 3.42Å; P64-D87 HydrophobicContact CG-CB 4.43Å; P64-E89 HydrophobicContact CB-CB 3.47Å; P64-E89 VanDerWaalsContact CB-CB 3.47Å; P64-E89 HydrophobicContact CB-CG 4.3Å; P64-E89 WeakPolarHBondContact CB-OE2 3.4Å; P64-E89 HydrophobicContact CG-CB 3.68Å; P64-E103 WeakPolarHBondContact CA-OE1 3.32Å
65	V	92	Very high	89.3	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-57.8	142.4	172.8	-65.8	0	0	0	0	112.4	R67 V73 V81 L83 Y100 E103	V65-R67 HydrophobicContact CG2-CG 4.28Å; V65-V73 HydrophobicContact CB-CG1 4.2Å; V65-V73 HydrophobicContact CG1-CG1 4.31Å; V65-V73 HydrophobicContact CG2-CG2 4.12Å; V65-V81 HydrophobicContact CB-CG1 4.17Å; V65-V81 HydrophobicContact CG1-CG1 3.44Å; V65-V81 VanDerWaalsContact CG1-CG1 3.44Å; V65-L83 HydrophobicContact CB-CD2 4.41Å; V65-L83 HydrophobicContact CG1-CD2 3.72Å; V65-Y100 HydrophobicContact CB-CD2 4.45Å; V65-Y100 VanDerWaalsContact CG1-CB 3.5Å; V65-Y100 HydrophobicContact CG1-CD1 4.3Å; V65-Y100 HydrophobicContact CG1-CD2 3.37Å; V65-Y100 HydrophobicContact CG1-CE2 4.14Å; V65-Y100 HydrophobicContact CG1-CG 3.45Å; V65-Y100 VanDerWaalsContact CG1-CG 3.45Å; V65-Y100 HydrophobicContact CG2-CD2 4.28Å; V65-Y100 HydrophobicContact CG2-CE2 4.42Å; V65-E103 HydrophobicContact CG1-CG 4.23Å; V65-E103 WeakPolarHBondContact CG1-OE1 3.41Å; V65-E103 PolarHBondContact N-OE1 3.04Å
66	S	89.2	Confident	88.9	Confident	16 Å²	16	58.6 Å²	58.6	11%	0.112	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-79.3	129.7	170.8	-58.9	0	0	0	0	108.8	L74 R82	S66-L74 PolarHBondContact O-N 2.96Å; S66-R82 WeakPolarHBondContact CB-O 3.45Å; S66-R82 PolarHBondContact N-O 3.41Å; S66-R82 PolarHBondContact OG-O 3.19Å
67	R	88	Confident	88.7	Confident	104 Å²	104	55.7 Å²	55.7	39%	0.392	31%	0.308	S	S	.	.	B	Isolated β-bridge	trans	-116	150.1	179.2	-61.1	-178.2	-176.1	-170.6	1.5	110.9	V65 L72	V65-R67 HydrophobicContact CG2-CG 4.28Å; R67-L72 CarbonylContact C-O 3.6Å; R67-L72 WeakPolarHBondContact CA-O 3.34Å
68	D	86.6	Confident	88.2	Confident	51 Å²	51	56.9 Å²	56.9	27%	0.273	32%	0.319	S	S	.	.			trans	-78	179.2	170.9	67.6	12.1	0	0	0	112	Q70 G71 L72 L74	D68-Q70 PolarHBondContact O-N 3Å; D68-Q70 VanDerWaalsContact O-N 3.16Å; D68-Q70 VanDerWaalsContact OD1-C 3.28Å; D68-Q70 WeakPolarHBondContact OD1-CA 3.29Å; D68-Q70 WeakPolarHBondContact OD1-CB 3.09Å; D68-Q70 PolarHBondContact OD1-N 3.22Å; D68-Q70 PolarHBondContact OD2-OE1 3.21Å; D68-G71 PolarHBondContact O-N 2.93Å; D68-G71 PolarHBondContact OD1-N 3.2Å; D68-L72 PolarHBondContact N-O 3.31Å; D68-L72 PolarHBondContact OD1-N 3.38Å; D68-L74 HydrophobicContact CB-CD2 4.03Å; D68-L74 HydrophobicContact CB-CG 4.46Å
69	A	83.1	Confident	87.4	Confident	106 Å²	106	57.4 Å²	57.4	88%	0.876	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-18.4	179	0	0	0	0	0	113.2
70	Q	82.1	Confident	87.2	Confident	150 Å²	150	61.4 Å²	61.4	70%	0.701	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-1	176.9	-62.5	83.3	-3.7	0	0	112.5	D68	D68-Q70 PolarHBondContact O-N 3Å; D68-Q70 VanDerWaalsContact O-N 3.16Å; D68-Q70 VanDerWaalsContact OD1-C 3.28Å; D68-Q70 WeakPolarHBondContact OD1-CA 3.29Å; D68-Q70 WeakPolarHBondContact OD1-CB 3.09Å; D68-Q70 PolarHBondContact OD1-N 3.22Å; D68-Q70 PolarHBondContact OD2-OE1 3.21Å
71	G	77.3	Confident	86.9	Confident	37 Å²	37	61.1 Å²	61.1	38%	0.381	35%	0.349	S	S	.	.	S	Bend	trans	80.8	10.6	179.3	0	0	0	0	0	114.7	D68	D68-G71 PolarHBondContact O-N 2.93Å; D68-G71 PolarHBondContact OD1-N 3.2Å
72	L	83.8	Confident	86.7	Confident	114 Å²	114	68.4 Å²	68.4	60%	0.597	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-84.1	148	175.9	-61.7	171.8	0	0	0	111	R67 D68	R67-L72 CarbonylContact C-O 3.6Å; R67-L72 WeakPolarHBondContact CA-O 3.34Å; D68-L72 PolarHBondContact N-O 3.31Å; D68-L72 PolarHBondContact OD1-N 3.38Å
73	V	88	Confident	86.6	Confident	25 Å²	25	68.7 Å²	68.7	15%	0.152	38%	0.376	C	S	.	.	B	Isolated β-bridge	trans	-73.5	130.7	-178.1	177.5	0	0	0	0	110.7	V65 F75 V81 Y100	V65-V73 HydrophobicContact CB-CG1 4.2Å; V65-V73 HydrophobicContact CG1-CG1 4.31Å; V65-V73 HydrophobicContact CG2-CG2 4.12Å; V73-F75 HydrophobicContact CG1-CZ 4.48Å; V73-F75 WeakPolarHBondContact O-CD2 3.12Å; V73-F75 WeakPolarHBondContact O-CE2 3.41Å; V73-V81 HydrophobicContact CG1-CG1 3.5Å; V73-V81 HydrophobicContact CG1-CG2 4.4Å; V73-Y100 HydrophobicContact CG1-CE1 4.3Å; V73-Y100 HydrophobicContact CG2-CE1 4.36Å; V73-Y100 HydrophobicContact CG2-CE2 4.04Å; V73-Y100 WeakPolarHBondContact CG2-OH 3.06Å
74	L	88.6	Confident	86.4	Confident	64 Å²	64	70.8 Å²	70.8	34%	0.335	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-82.9	138.4	177.2	-67.6	173.2	0	0	0	111.1	S66 D68 R82	S66-L74 PolarHBondContact O-N 2.96Å; D68-L74 HydrophobicContact CB-CD2 4.03Å; D68-L74 HydrophobicContact CB-CG 4.46Å; L74-R82 HydrophobicContact CB-CB 4.33Å; L74-R82 PolarHBondContact O-N 3.01Å
75	F	86.9	Confident	86.2	Confident	121 Å²	121	77.8 Å²	77.8	53%	0.531	41%	0.413	S	S	.	.	B	Isolated β-bridge	trans	-112.4	147.4	174.3	-60.9	-89.1	0	0	0	110	V73 G79 Q80 V81	V73-F75 HydrophobicContact CG1-CZ 4.48Å; V73-F75 WeakPolarHBondContact O-CD2 3.12Å; V73-F75 WeakPolarHBondContact O-CE2 3.41Å; F75-G79 WeakPolarHBondContact CD1-O 3.26Å; F75-Q80 CarbonylContact C-O 3.59Å; F75-Q80 VanDerWaalsContact CA-O 3.3Å; F75-Q80 WeakPolarHBondContact CA-O 3.25Å; F75-V81 HydrophobicContact CD1-CG2 3.88Å; F75-V81 HydrophobicContact CE1-CG2 3.5Å; F75-V81 HydrophobicContact CZ-CG2 4.4Å
76	D	84.4	Confident	86	Confident	87 Å²	87	82.7 Å²	82.7	47%	0.465	45%	0.453	S	S	.	.			trans	-77.6	172.7	172.7	-163.2	15.4	0	0	0	111.2	T78 G79 Q80	D76-T78 PolarHBondContact O-N 3.18Å; D76-T78 VanDerWaalsContact O-N 3.07Å; D76-G79 PolarHBondContact O-N 2.71Å; D76-Q80 PolarHBondContact N-O 2.85Å
77	V	85.3	Confident	86	Confident	143 Å²	143	83.8 Å²	83.8	87%	0.867	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-24.2	179.4	-78.1	0	0	0	0	114
78	T	82.3	Confident	86.1	Confident	82 Å²	82	81.8 Å²	81.8	50%	0.503	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-9.9	176.1	57.2	0	0	0	0	113.3	V25 D76	V25-T78 VanDerWaalsContact CG2-O 3.23Å; V25-T78 WeakPolarHBondContact CG2-O 3.49Å; D76-T78 PolarHBondContact O-N 3.18Å; D76-T78 VanDerWaalsContact O-N 3.07Å
79	G	79.6	Confident	86.3	Confident	35 Å²	35	81.1 Å²	81.1	36%	0.361	45%	0.45	S	S	.	.	S	Bend	trans	86.4	6	-172	0	0	0	0	0	114.2	F75 D76	F75-G79 WeakPolarHBondContact CD1-O 3.26Å; D76-G79 PolarHBondContact O-N 2.71Å
80	Q	86.9	Confident	86.8	Confident	84 Å²	84	78 Å²	78	39%	0.393	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-77	145.4	171.7	-171.8	169.2	12.2	0	0	111.2	V25 F75 D76 R82	V25-Q80 HydrophobicContact CG1-CB 4.21Å; F75-Q80 CarbonylContact C-O 3.59Å; F75-Q80 VanDerWaalsContact CA-O 3.3Å; F75-Q80 WeakPolarHBondContact CA-O 3.25Å; D76-Q80 PolarHBondContact N-O 2.85Å; Q80-R82 PolarHBondContact O-N 3.42Å
81	V	88.6	Confident	87.3	Confident	10 Å²	10	71.1 Å²	71.1	6%	0.061	39%	0.386	C	S	.	.	B	Isolated β-bridge	trans	-67.1	130.5	178.2	177.9	0	0	0	0	110.3	V65 V73 F75 L83 Y100	V65-V81 HydrophobicContact CB-CG1 4.17Å; V65-V81 HydrophobicContact CG1-CG1 3.44Å; V65-V81 VanDerWaalsContact CG1-CG1 3.44Å; V73-V81 HydrophobicContact CG1-CG1 3.5Å; V73-V81 HydrophobicContact CG1-CG2 4.4Å; F75-V81 HydrophobicContact CD1-CG2 3.88Å; F75-V81 HydrophobicContact CE1-CG2 3.5Å; F75-V81 HydrophobicContact CZ-CG2 4.4Å; V81-L83 HydrophobicContact CG1-CD2 4.08Å; V81-Y100 HydrophobicContact CB-CD1 4.44Å; V81-Y100 HydrophobicContact CG1-CD1 4.11Å; V81-Y100 HydrophobicContact CG1-CG 4.28Å; V81-Y100 HydrophobicContact CG2-CD1 3.72Å; V81-Y100 HydrophobicContact CG2-CE1 4.28Å
82	R	89.5	Confident	88	Confident	153 Å²	153	72.7 Å²	72.7	58%	0.577	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-82	121	179.4	-171.4	175.3	-179.8	173.7	-0.1	110.3	S66 L74 Q80	S66-R82 WeakPolarHBondContact CB-O 3.45Å; S66-R82 PolarHBondContact N-O 3.41Å; S66-R82 PolarHBondContact OG-O 3.19Å; L74-R82 HydrophobicContact CB-CB 4.33Å; L74-R82 PolarHBondContact O-N 3.01Å; Q80-R82 PolarHBondContact O-N 3.42Å
83	L	90.6	Very high	88.4	Confident	19 Å²	19	69.8 Å²	69.8	10%	0.099	38%	0.378	C	S	.	.	B	Isolated β-bridge	trans	-103.1	151.9	177.9	-52.2	-178.8	0	0	0	111.4	N63 V65 V81 H85 E103	N63-L83 HydrophobicContact CB-CD1 4.27Å; V65-L83 HydrophobicContact CB-CD2 4.41Å; V65-L83 HydrophobicContact CG1-CD2 3.72Å; V81-L83 HydrophobicContact CG1-CD2 4.08Å; L83-H85 PolarHBondContact O-N 3.14Å; L83-E103 HydrophobicContact CD2-CG 4.21Å
84	R	89.7	Confident	88.5	Confident	86 Å²	86	72.3 Å²	72.3	33%	0.325	39%	0.388	S	S	.	.			trans	-85.4	88.2	163.1	-66.4	-176.3	-76.7	160.8	-13	108.2	N63 P64 D87 E89	N63-R84 WeakPolarHBondContact CA-O 3.29Å; P64-R84 HydrophobicContact CG-CB 4.21Å; P64-R84 PolarHBondContact O-N 2.91Å; R84-D87 HydrophobicContact CB-CB 3.78Å; R84-D87 IonicContact CZ-OD2 2.78Å; R84-D87 IonicContact NE-OD2 3.96Å; R84-D87 IonicContact NH1-OD2 3.64Å; R84-D87 PolarHBondContact NH1-OD2 3.46Å; R84-D87 WeakPolarHBondContact O-CB 3.3Å; R84-D87 PolarHBondContact O-N 2.86Å; R84-E89 IonicContact NH2-OE1 3.7Å; R84-E89 PolarHBondContact NH2-OE1 3.06Å
85	H	88.1	Confident	88.6	Confident	147 Å²	147	76 Å²	76	68%	0.681	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	140.2	-178.3	-67.7	-70.3	0	0	0	111.9	L83 D87	L83-H85 PolarHBondContact O-N 3.14Å; H85-D87 PolarHBondContact O-N 3.01Å
86	A	87.5	Confident	88.9	Confident	102 Å²	102	72 Å²	72	84%	0.843	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	19.1	-177	0	0	0	0	0	114.7	N63	N63-A86 PolarHBondContact OD1-N 3.43Å
87	D	89.5	Confident	89.2	Confident	39 Å²	39	68.7 Å²	68.7	21%	0.209	38%	0.376	C	S	.	.			trans	-105.1	159.2	173.5	-162.7	14	0	0	0	110.9	N63 P64 R84 H85 K155	N63-D87 PolarHBondContact N-O 3.29Å; P64-D87 WeakPolarHBondContact CD-O 3.42Å; P64-D87 HydrophobicContact CG-CB 4.43Å; R84-D87 HydrophobicContact CB-CB 3.78Å; R84-D87 IonicContact CZ-OD2 2.78Å; R84-D87 IonicContact NE-OD2 3.96Å; R84-D87 IonicContact NH1-OD2 3.64Å; R84-D87 PolarHBondContact NH1-OD2 3.46Å; R84-D87 WeakPolarHBondContact O-CB 3.3Å; R84-D87 PolarHBondContact O-N 2.86Å; H85-D87 PolarHBondContact O-N 3.01Å; D87-K155 IonicContact OD1-NZ 3.25Å; D87-K155 PolarHBondContact OD1-NZ 2.84Å; D87-K155 IonicContact OD2-NZ 2.71Å; D87-K155 PolarHBondContact OD2-NZ 3.47Å
88	L	90.4	Very high	89.6	Confident	63 Å²	63	62.6 Å²	62.6	33%	0.33	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	148.2	174.2	-62.9	173.8	0	0	0	109.7	T60 V61 A62 E106 K155	T60-L88 HydrophobicContact CG2-CB 4.09Å; T60-L88 HydrophobicContact CG2-CD1 4.46Å; T60-L88 HydrophobicContact CG2-CD2 4.03Å; T60-L88 HydrophobicContact CG2-CG 4.42Å; V61-L88 WeakPolarHBondContact O-CA 3.3Å; A62-L88 HydrophobicContact CB-CD2 3.88Å; L88-E106 HydrophobicContact CD2-CG 4.36Å; L88-K155 HydrophobicContact CB-CB 3.97Å; L88-K155 HydrophobicContact CB-CD 4.24Å; L88-K155 WeakPolarHBondContact O-CD 3.4Å; L88-K155 PolarHBondContact O-NZ 3.45Å
89	E	91.2	Very high	90.1	Very high	36 Å²	36	59.5 Å²	59.5	17%	0.168	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	128.1	170.8	-178.8	175	-120	0	0	109.9	T60 V61 P64 R84 R91	T60-E89 WeakPolarHBondContact CA-O 3.45Å; V61-E89 PolarHBondContact N-O 2.85Å; V61-E89 PolarHBondContact O-N 3.29Å; P64-E89 HydrophobicContact CB-CB 3.47Å; P64-E89 VanDerWaalsContact CB-CB 3.47Å; P64-E89 HydrophobicContact CB-CG 4.3Å; P64-E89 WeakPolarHBondContact CB-OE2 3.4Å; P64-E89 HydrophobicContact CG-CB 3.68Å; R84-E89 IonicContact NH2-OE1 3.7Å; R84-E89 PolarHBondContact NH2-OE1 3.06Å; E89-R91 HydrophobicContact CG-CG 4.2Å; E89-R91 IonicContact OE2-CZ 3.69Å; E89-R91 VanDerWaalsContact OE2-CZ 3.3Å; E89-R91 IonicContact OE2-NE 3.7Å; E89-R91 PolarHBondContact OE2-NE 3.44Å; E89-R91 IonicContact OE2-NH2 2.84Å; E89-R91 PolarHBondContact OE2-NH2 3.1Å
90	I	92.3	Very high	90.7	Very high	40 Å²	40	60 Å²	60	21%	0.205	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	115.6	175.8	-66.6	171.1	0	0	0	107.5	Y58 T60 L92 P153 R154	Y58-I90 HydrophobicContact CD2-CG2 3.9Å; Y58-I90 HydrophobicContact CG-CG2 4.34Å; T60-I90 HydrophobicContact CG2-CG1 4.49Å; I90-L92 HydrophobicContact CG2-CD2 4.48Å; I90-P153 HydrophobicContact CD1-CB 4.07Å; I90-P153 HydrophobicContact CD1-CG 4.3Å; I90-P153 WeakPolarHBondContact CD1-O 3.38Å; I90-P153 HydrophobicContact CG2-CG 4.22Å; I90-R154 VanDerWaalsContact CD1-C 3.43Å
91	R	92.1	Very high	90.8	Very high	7 Å²	7	56.7 Å²	56.7	3%	0.026	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	119.6	178.7	-68.6	-179.4	177.7	170.7	8.9	109.5	Y58 C59 E89 F97 E103	Y58-R91 VanDerWaalsContact CA-O 3.27Å; Y58-R91 WeakPolarHBondContact CA-O 3.23Å; C59-R91 PolarHBondContact N-O 2.92Å; C59-R91 PolarHBondContact O-N 3.4Å; E89-R91 HydrophobicContact CG-CG 4.2Å; E89-R91 IonicContact OE2-CZ 3.69Å; E89-R91 VanDerWaalsContact OE2-CZ 3.3Å; E89-R91 IonicContact OE2-NE 3.7Å; E89-R91 PolarHBondContact OE2-NE 3.44Å; E89-R91 IonicContact OE2-NH2 2.84Å; E89-R91 PolarHBondContact OE2-NH2 3.1Å; R91-F97 HydrophobicContact CB-CE1 4.32Å; R91-F97 HydrophobicContact CB-CZ 4.14Å; R91-F97 HydrophobicContact CG-CZ 4.36Å; R91-E103 IonicContact CZ-OE1 2.53Å; R91-E103 IonicContact NH1-OE1 3.64Å; R91-E103 IonicContact NH1-OE2 2.9Å; R91-E103 IonicContact NH2-OE1 3.85Å; R91-E103 PolarHBondContact NH2-OE1 2.74Å; R91-E103 IonicContact NH2-OE2 2.8Å
92	L	93.2	Very high	90.8	Very high	69 Å²	69	58.3 Å²	58.3	36%	0.361	32%	0.315	S	S	.	.			trans	-82.2	-173.8	174	-58.8	179.4	0	0	0	110.7	I90 Q94 L112 I152	I90-L92 HydrophobicContact CG2-CD2 4.48Å; L92-Q94 PolarHBondContact O-N 2.77Å; L92-L112 HydrophobicContact CD2-CD1 4.47Å; L92-L112 HydrophobicContact CD2-CD2 4.2Å; L92-I152 HydrophobicContact CD1-CD1 4.47Å; L92-I152 HydrophobicContact CD1-CG2 4.39Å; L92-I152 HydrophobicContact CD2-CG2 4.19Å
93	A	92.4	Very high	91	Very high	54 Å²	54	51.6 Å²	51.6	45%	0.446	29%	0.29	S	S	.	.	S	Bend	trans	-57.7	117.9	175.5	0	0	0	0	0	111.5	V53	V53-A93 WeakPolarHBondContact O-CA 3.35Å
94	Q	90.5	Very high	91	Very high	77 Å²	77	54.3 Å²	54.3	36%	0.36	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	174.4	178.7	64.6	-176.2	-7.1	0	0	109.3	L92 F97	L92-Q94 PolarHBondContact O-N 2.77Å; Q94-F97 HydrophobicContact CG-CD1 3.88Å; Q94-F97 HydrophobicContact CG-CE1 4.08Å
95	D	89.4	Confident	91.1	Very high	142 Å²	142	52.7 Å²	52.7	76%	0.759	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.4	146.4	176.1	-69.8	-25.5	0	0	0	111.4	F97	D95-F97 PolarHBondContact O-N 3.1Å
96	P	92.8	Very high	91.2	Very high	37 Å²	37	51.9 Å²	51.9	24%	0.24	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.7	126.5	-179.9	-25.8	33.6	0	0	0	111.6	Y13 M50 V51 T52	Y13-P96 HydrophobicContact CD1-CB 3.84Å; Y13-P96 HydrophobicContact CD1-CG 3.81Å; Y13-P96 HydrophobicContact CE1-CB 4.46Å; Y13-P96 HydrophobicContact CE1-CG 4.01Å; M50-P96 HydrophobicContact CB-CB 3.98Å; M50-P96 HydrophobicContact SD-CB 4.29Å; V51-P96 WeakPolarHBondContact O-CA 3.48Å; T52-P96 HydrophobicContact CG2-CG 4.16Å
97	F	92.3	Very high	91.3	Very high	18 Å²	18	51.5 Å²	51.5	8%	0.079	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	144.7	-175.3	58.9	-91.4	0	0	0	111.4	M50 V51 V53 V61 R91 Q94 D95 L99	M50-F97 WeakPolarHBondContact CA-O 3.48Å; M50-F97 WeakPolarHBondContact CB-O 3.36Å; V51-F97 HydrophobicContact CB-CD2 4.24Å; V51-F97 HydrophobicContact CB-CE1 4.25Å; V51-F97 HydrophobicContact CB-CE2 3.69Å; V51-F97 HydrophobicContact CB-CZ 3.71Å; V51-F97 HydrophobicContact CG1-CE1 4.22Å; V51-F97 HydrophobicContact CG1-CE2 4.09Å; V51-F97 HydrophobicContact CG1-CZ 3.65Å; V51-F97 HydrophobicContact CG2-CE2 4.2Å; V51-F97 PolarHBondContact N-O 3.1Å; V51-F97 PolarHBondContact O-N 3.49Å; V51-F97 VanDerWaalsContact O-N 3.12Å; V53-F97 HydrophobicContact CG2-CE1 3.88Å; V53-F97 HydrophobicContact CG2-CZ 4.24Å; V61-F97 HydrophobicContact CG2-CE2 4.43Å; R91-F97 HydrophobicContact CB-CE1 4.32Å; R91-F97 HydrophobicContact CB-CZ 4.14Å; R91-F97 HydrophobicContact CG-CZ 4.36Å; Q94-F97 HydrophobicContact CG-CD1 3.88Å; Q94-F97 HydrophobicContact CG-CE1 4.08Å; D95-F97 PolarHBondContact O-N 3.1Å; F97-L99 HydrophobicContact CE2-CD2 4.14Å
98	P	92.6	Very high	91.5	Very high	14 Å²	14	54.7 Å²	54.7	9%	0.091	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-76.5	156.4	169.2	34.8	-35.3	0	0	0	110.4	Y15 V28 V30 M50	Y15-P98 HydrophobicContact CD1-CB 3.64Å; Y15-P98 HydrophobicContact CD2-CB 3.89Å; Y15-P98 HydrophobicContact CE1-CB 4.19Å; Y15-P98 HydrophobicContact CE2-CB 4.4Å; Y15-P98 HydrophobicContact CG-CB 3.47Å; Y15-P98 VanDerWaalsContact CG-CB 3.47Å; V28-P98 HydrophobicContact CG2-CB 3.88Å; V28-P98 HydrophobicContact CG2-CG 4.23Å; V30-P98 HydrophobicContact CG2-CB 4.24Å; V30-P98 HydrophobicContact CG2-CG 3.81Å; M50-P98 HydrophobicContact CE-CB 4.13Å; M50-P98 HydrophobicContact CE-CG 4.19Å; M50-P98 HydrophobicContact CG-CB 4.38Å
99	L	92.3	Very high	91.6	Very high	17 Å²	17	54.9 Å²	54.9	9%	0.089	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-84.7	133.4	163.2	-59.6	174.9	0	0	0	108.2	Y15 H17 V51 V61 F97 E103 L105	Y15-L99 HydrophobicContact CE2-CB 4.43Å; Y15-L99 VanDerWaalsContact CE2-O 3.28Å; Y15-L99 WeakPolarHBondContact CE2-O 3.16Å; Y15-L99 WeakPolarHBondContact OH-CB 3.49Å; H17-L99 PolarHBondContact CE1-O 3.38Å; H17-L99 PolarHBondContact NE2-O 3.15Å; V51-L99 HydrophobicContact CG2-CD1 4.37Å; V51-L99 HydrophobicContact CG2-CD2 4.19Å; V51-L99 HydrophobicContact CG2-CG 4.13Å; V61-L99 HydrophobicContact CG1-CD2 4.28Å; V61-L99 HydrophobicContact CG2-CD2 4.19Å; F97-L99 HydrophobicContact CE2-CD2 4.14Å; L99-E103 WeakPolarHBondContact CA-OE2 3.4Å; L99-E103 HydrophobicContact CB-CB 4.18Å; L99-E103 HydrophobicContact CD2-CB 4.4Å; L99-L105 HydrophobicContact CD1-CB 4.06Å
100	Y	91.9	Very high	91.6	Very high	47 Å²	47	54.9 Å²	54.9	18%	0.184	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-78	159.8	175.7	-73.7	-92.3	0	0	0	111.3	V28 V65 V73 V81 G102 E103	V28-Y100 HydrophobicContact CB-CD1 4.25Å; V28-Y100 HydrophobicContact CG1-CD1 3.44Å; V28-Y100 VanDerWaalsContact CG1-CD1 3.44Å; V28-Y100 HydrophobicContact CG1-CE1 3.31Å; V28-Y100 HydrophobicContact CG1-CG 4.39Å; V65-Y100 HydrophobicContact CB-CD2 4.45Å; V65-Y100 VanDerWaalsContact CG1-CB 3.5Å; V65-Y100 HydrophobicContact CG1-CD1 4.3Å; V65-Y100 HydrophobicContact CG1-CD2 3.37Å; V65-Y100 HydrophobicContact CG1-CE2 4.14Å; V65-Y100 HydrophobicContact CG1-CG 3.45Å; V65-Y100 VanDerWaalsContact CG1-CG 3.45Å; V65-Y100 HydrophobicContact CG2-CD2 4.28Å; V65-Y100 HydrophobicContact CG2-CE2 4.42Å; V73-Y100 HydrophobicContact CG1-CE1 4.3Å; V73-Y100 HydrophobicContact CG2-CE1 4.36Å; V73-Y100 HydrophobicContact CG2-CE2 4.04Å; V73-Y100 WeakPolarHBondContact CG2-OH 3.06Å; V81-Y100 HydrophobicContact CB-CD1 4.44Å; V81-Y100 HydrophobicContact CG1-CD1 4.11Å; V81-Y100 HydrophobicContact CG1-CG 4.28Å; V81-Y100 HydrophobicContact CG2-CD1 3.72Å; V81-Y100 HydrophobicContact CG2-CE1 4.28Å; Y100-G102 PolarHBondContact O-N 2.85Å; Y100-E103 PolarHBondContact N-OE2 2.68Å; Y100-E103 WeakPolarHBondContact O-CB 3.47Å; Y100-E103 PolarHBondContact O-N 2.92Å
101	P	90.3	Very high	91.7	Very high	13 Å²	13	56.8 Å²	56.8	8%	0.084	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	115.8	176.5	-25.8	35.1	0	0	0	111.4	H17	H17-P101 HydrophobicContact CB-CG 4.47Å; H17-P101 VanDerWaalsContact CE1-CA 3.48Å; H17-P101 WeakPolarHBondContact CE1-CA 3.29Å
102	G	88.4	Confident	91.7	Very high	44 Å²	44	57.7 Å²	57.7	45%	0.454	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.3	-14.5	-177.8	0	0	0	0	0	115.4	Y100	Y100-G102 PolarHBondContact O-N 2.85Å
103	E	92.8	Very high	91.7	Very high	12 Å²	12	57.8 Å²	57.8	6%	0.056	32%	0.32	C	S	.	.			trans	-71.4	138	165.2	-73.3	-171.1	144	0	0	110	V61 A62 N63 P64 V65 L83 R91 L99 Y100	V61-E103 HydrophobicContact CG1-CB 3.9Å; V61-E103 HydrophobicContact CG1-CG 4.04Å; A62-E103 WeakPolarHBondContact O-CA 3.39Å; N63-E103 WeakPolarHBondContact O-CG 3.25Å; P64-E103 WeakPolarHBondContact CA-OE1 3.32Å; V65-E103 HydrophobicContact CG1-CG 4.23Å; V65-E103 WeakPolarHBondContact CG1-OE1 3.41Å; V65-E103 PolarHBondContact N-OE1 3.04Å; L83-E103 HydrophobicContact CD2-CG 4.21Å; R91-E103 IonicContact CZ-OE1 2.53Å; R91-E103 IonicContact NH1-OE1 3.64Å; R91-E103 IonicContact NH1-OE2 2.9Å; R91-E103 IonicContact NH2-OE1 3.85Å; R91-E103 PolarHBondContact NH2-OE1 2.74Å; R91-E103 IonicContact NH2-OE2 2.8Å; L99-E103 WeakPolarHBondContact CA-OE2 3.4Å; L99-E103 HydrophobicContact CB-CB 4.18Å; L99-E103 HydrophobicContact CD2-CB 4.4Å; Y100-E103 PolarHBondContact N-OE2 2.68Å; Y100-E103 WeakPolarHBondContact O-CB 3.47Å; Y100-E103 PolarHBondContact O-N 2.92Å
104	V	91.3	Very high	91.7	Very high	77 Å²	77	59.8 Å²	59.8	47%	0.467	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	135.7	175.5	-178.8	0	0	0	0	108.6	V61 A62 E106	V61-V104 CarbonylContact C-O 3.54Å; V61-V104 WeakPolarHBondContact CA-O 3.46Å; A62-V104 PolarHBondContact N-O 2.81Å; A62-V104 PolarHBondContact O-N 2.92Å; V104-E106 PolarHBondContact O-N 3.49Å; V104-E106 VanDerWaalsContact O-N 3.11Å
105	L	91.6	Very high	91.8	Very high	52 Å²	52	56.3 Å²	56.3	27%	0.272	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	98.1	171.3	-170.5	67.4	0	0	0	108.4	V51 C59 V61 L99	V51-L105 HydrophobicContact CG1-CD1 4.43Å; V51-L105 HydrophobicContact CG2-CD2 4.38Å; C59-L105 HydrophobicContact CB-CD1 3.88Å; V61-L105 HydrophobicContact CG2-CD1 4.23Å; L99-L105 HydrophobicContact CD1-CB 4.06Å
106	E	91.2	Very high	92	Very high	130 Å²	130	54.7 Å²	54.7	61%	0.607	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.5	-47.8	-177.6	-173.7	66.7	-164.7	0	0	110.8	T60 A62 L88 V104	T60-E106 HydrophobicContact CG2-CB 4.46Å; T60-E106 PolarHBondContact O-N 2.62Å; A62-E106 HydrophobicContact CB-CB 4.09Å; L88-E106 HydrophobicContact CD2-CG 4.36Å; V104-E106 PolarHBondContact O-N 3.49Å; V104-E106 VanDerWaalsContact O-N 3.11Å
107	K	89.8	Confident	91.9	Very high	93 Å²	93	56.8 Å²	56.8	40%	0.404	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	122.6	177.1	-164.8	174.7	-175.5	174.7	0	109.5	Y58 C59 T60 T110	Y58-K107 HydrophobicContact CE2-CD 4.2Å; Y58-K107 PolarHBondContact OH-NZ 3.21Å; C59-K107 WeakPolarHBondContact CB-O 3.48Å; T60-K107 PolarHBondContact N-O 3.25Å; T60-K107 PolarHBondContact O-N 3.03Å; T60-K107 VanDerWaalsContact O-N 3.1Å; K107-T110 WeakPolarHBondContact CE-OG1 3.32Å
108	D	91.9	Very high	91.9	Very high	107 Å²	107	60.7 Å²	60.7	57%	0.572	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.2	171.5	176.9	-156.7	0.8	0	0	0	111.4	T110	D108-T110 PolarHBondContact O-N 3.32Å; D108-T110 PolarHBondContact O-OG1 3.07Å
109	I	92.8	Very high	91.9	Very high	66 Å²	66	61 Å²	61	34%	0.338	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.4	110.9	-175.4	-59.8	160.8	0	0	0	110.3	T52 P54 H57	T52-I109 WeakPolarHBondContact O-CD1 3.36Å; P54-I109 HydrophobicContact CG-CG2 4.3Å; H57-I109 HydrophobicContact CB-CG2 3.84Å
110	T	92.6	Very high	92	Very high	36 Å²	36	60.1 Å²	60.1	22%	0.221	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	136.2	-176.1	-56.8	0	0	0	0	109.3	H57 Y58 K107 D108	H57-T110 CarbonylContact C-O 3.59Å; H57-T110 VanDerWaalsContact CA-O 3.23Å; H57-T110 WeakPolarHBondContact CA-O 3.27Å; H57-T110 WeakPolarHBondContact CB-O 3.27Å; Y58-T110 VanDerWaalsContact CD1-O 3.27Å; Y58-T110 WeakPolarHBondContact CD1-O 3.35Å; Y58-T110 HydrophobicContact CE1-CG2 3.83Å; Y58-T110 PolarHBondContact N-O 2.9Å; Y58-T110 PolarHBondContact O-N 3.05Å; K107-T110 WeakPolarHBondContact CE-OG1 3.32Å; D108-T110 PolarHBondContact O-N 3.32Å; D108-T110 PolarHBondContact O-OG1 3.07Å
111	P	93.8	Very high	92.1	Very high	80 Å²	80	58 Å²	58	52%	0.519	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	143.5	174	26.7	-34.4	0	0	0	111
112	L	92.8	Very high	92.3	Very high	27 Å²	27	57.7 Å²	57.7	14%	0.141	32%	0.323	C	S	.	.			trans	-65.1	140.9	171	-71.1	173	0	0	0	109.9	R56 Y58 L92 V114 T150 P153	R56-L112 WeakPolarHBondContact O-CB 3.39Å; R56-L112 PolarHBondContact O-N 3.43Å; Y58-L112 HydrophobicContact CD1-CD2 3.6Å; Y58-L112 HydrophobicContact CD1-CG 4.25Å; Y58-L112 HydrophobicContact CE1-CD2 4.36Å; Y58-L112 HydrophobicContact CG-CD2 4.15Å; L92-L112 HydrophobicContact CD2-CD1 4.47Å; L92-L112 HydrophobicContact CD2-CD2 4.2Å; L112-V114 PolarHBondContact O-N 3.02Å; L112-T150 HydrophobicContact CB-CG2 3.47Å; L112-T150 VanDerWaalsContact CB-CG2 3.47Å; L112-T150 HydrophobicContact CD1-CG2 3.94Å; L112-T150 HydrophobicContact CG-CG2 4.3Å; L112-P153 VanDerWaalsContact CD2-CD 3.44Å; L112-P153 HydrophobicContact CD2-CG 4.31Å
113	Q	91.8	Very high	92.6	Very high	71 Å²	71	55.8 Å²	55.8	33%	0.332	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	115.5	-177.1	-173.7	164.9	-4.2	0	0	110.2	L121 Y151	Q113-L121 HydrophobicContact CG-CD1 4.3Å; Q113-Y151 PolarHBondContact O-N 2.79Å
114	V	92.8	Very high	92.6	Very high	95 Å²	95	58.7 Å²	58.7	58%	0.576	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.8	122.8	173.8	-178.3	0	0	0	0	108.6	L112	L112-V114 PolarHBondContact O-N 3.02Å
115	V	93.7	Very high	92.7	Very high	4 Å²	4	55.1 Å²	55.1	2%	0.024	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	120.2	179.3	-171.5	0	0	0	0	107.7	T119 L121 F145 P148 G149	V115-T119 WeakPolarHBondContact CG1-O 3.34Å; V115-L121 HydrophobicContact CG1-CG 4.43Å; V115-L121 HydrophobicContact CG2-CD1 3.54Å; V115-L121 HydrophobicContact CG2-CD2 4.07Å; V115-L121 HydrophobicContact CG2-CG 3.56Å; V115-F145 HydrophobicContact CB-CD1 4.19Å; V115-F145 HydrophobicContact CB-CE1 4.12Å; V115-F145 HydrophobicContact CG1-CD1 4.47Å; V115-F145 HydrophobicContact CG2-CD1 3.74Å; V115-F145 HydrophobicContact CG2-CE1 3.8Å; V115-P148 WeakPolarHBondContact O-CA 3.42Å; V115-G149 PolarHBondContact N-O 3.38Å; V115-G149 PolarHBondContact O-N 2.88Å; V115-G149 VanDerWaalsContact O-N 3.16Å
116	L	92.8	Very high	92.7	Very high	109 Å²	109	57.3 Å²	57.3	57%	0.571	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-77.6	159.8	-174.9	-61.6	175.4	0	0	0	110.8	T119	L116-T119 HydrophobicContact CB-CG2 4.37Å; L116-T119 PolarHBondContact N-OG1 2.86Å; L116-T119 VanDerWaalsContact N-OG1 3.09Å; L116-T119 PolarHBondContact O-N 2.84Å; L116-T119 PolarHBondContact O-OG1 2.93Å
117	P	90.9	Very high	92.6	Very high	81 Å²	81	55.1 Å²	55.1	53%	0.526	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	147.6	166.6	-20.5	30.6	0	0	0	111.1	T119 P148	P117-T119 PolarHBondContact O-N 2.93Å; P117-P148 HydrophobicContact CG-CB 4.1Å
118	N	92	Very high	92.7	Very high	99 Å²	99	56 Å²	56	53%	0.529	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.3	19.4	-177	-56.7	-29	0	0	0	114.4	A165 A203	N118-A165 HydrophobicContact CB-CB 3.88Å; N118-A165 WeakPolarHBondContact O-CB 3.12Å; N118-A165 PolarHBondContact O-N 3.04Å; N118-A203 HydrophobicContact CB-CB 4.47Å
119	T	93.6	Very high	92.6	Very high	20 Å²	20	51.9 Å²	51.9	12%	0.123	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	151.6	170.3	67.2	0	0	0	0	109.9	V115 L116 P117 G147 I163 Q164	V115-T119 WeakPolarHBondContact CG1-O 3.34Å; L116-T119 HydrophobicContact CB-CG2 4.37Å; L116-T119 PolarHBondContact N-OG1 2.86Å; L116-T119 VanDerWaalsContact N-OG1 3.09Å; L116-T119 PolarHBondContact O-N 2.84Å; L116-T119 PolarHBondContact O-OG1 2.93Å; P117-T119 PolarHBondContact O-N 2.93Å; T119-G147 PolarHBondContact O-N 2.94Å; T119-I163 CarbonylContact C-O 3.46Å; T119-I163 WeakPolarHBondContact CA-O 3.42Å; T119-Q164 HydrophobicContact CG2-CG 4.26Å
120	A	94.1	Very high	92.5	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	154.2	173.4	0	0	0	0	0	111.2	L144 F145 I162 I163 L205	A120-L144 HydrophobicContact CB-CB 4.19Å; A120-L144 HydrophobicContact CB-CD1 4.34Å; A120-L144 HydrophobicContact CB-CD2 4.36Å; A120-F145 VanDerWaalsContact CA-O 3.24Å; A120-F145 WeakPolarHBondContact CA-O 3.39Å; A120-F145 WeakPolarHBondContact CB-O 3.29Å; A120-I162 CarbonylContact O-C 3.5Å; A120-I162 WeakPolarHBondContact O-CA 3.42Å; A120-I163 PolarHBondContact N-O 2.96Å; A120-I163 PolarHBondContact O-N 3.42Å; A120-L205 HydrophobicContact CB-CD1 4.23Å; A120-L205 HydrophobicContact CB-CD2 3.85Å; A120-L205 HydrophobicContact CB-CG 4.46Å
121	L	94.1	Very high	92.1	Very high	1 Å²	1	55.2 Å²	55.2	1%	0.005	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	126.4	167.2	-55.5	-178.8	0	0	0	108.8	Q113 V115 L123 L144 F145 Y151 V159 I162	Q113-L121 HydrophobicContact CG-CD1 4.3Å; V115-L121 HydrophobicContact CG1-CG 4.43Å; V115-L121 HydrophobicContact CG2-CD1 3.54Å; V115-L121 HydrophobicContact CG2-CD2 4.07Å; V115-L121 HydrophobicContact CG2-CG 3.56Å; L121-L123 HydrophobicContact CB-CD2 3.98Å; L121-L123 HydrophobicContact CB-CG 4.31Å; L121-L123 PolarHBondContact O-N 2.92Å; L121-L144 WeakPolarHBondContact O-CA 3.43Å; L121-F145 HydrophobicContact CB-CB 4.31Å; L121-F145 PolarHBondContact N-O 3.45Å; L121-F145 PolarHBondContact O-N 2.87Å; L121-Y151 HydrophobicContact CD1-CD1 3.76Å; L121-Y151 HydrophobicContact CD1-CD2 4.26Å; L121-Y151 HydrophobicContact CD1-CG 3.59Å; L121-V159 HydrophobicContact CB-CG1 4.31Å; L121-V159 HydrophobicContact CD2-CG1 4.24Å; L121-I162 HydrophobicContact CD2-CB 4.46Å; L121-I162 HydrophobicContact CD2-CD1 4.41Å; L121-I162 HydrophobicContact CD2-CG1 3.75Å; L121-I162 HydrophobicContact CD2-CG2 4.43Å
122	H	94.1	Very high	91.4	Very high	8 Å²	8	59 Å²	59	4%	0.037	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	110.7	166.3	-178.5	-164	0	0	0	108.3	E142 L144 V160 E161 I163	H122-E142 IonicContact CE1-OE2 3.23Å; H122-E142 PolarHBondContact CE1-OE2 3.48Å; H122-E142 IonicContact NE2-OE2 2.79Å; H122-E142 PolarHBondContact NE2-OE2 3.35Å; H122-L144 HydrophobicContact CB-CD2 4.3Å; H122-V160 HydrophobicContact CB-CB 4.3Å; H122-V160 PolarHBondContact O-N 3.08Å; H122-E161 HydrophobicContact CB-CG 3.87Å; H122-E161 PolarHBondContact N-O 3.23Å; H122-I163 HydrophobicContact CB-CD1 3.96Å; H122-I163 HydrophobicContact CB-CG1 4.47Å
123	L	93.9	Very high	90.9	Very high	3 Å²	3	64.2 Å²	64.2	2%	0.016	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	143.2	-178	-61.2	-178.5	0	0	0	109.8	L121 E142 W143 F145 Y151 V157 E158 V159	L121-L123 HydrophobicContact CB-CD2 3.98Å; L121-L123 HydrophobicContact CB-CG 4.31Å; L121-L123 PolarHBondContact O-N 2.92Å; L123-E142 VanDerWaalsContact O-CA 3.24Å; L123-E142 WeakPolarHBondContact O-CA 3.32Å; L123-W143 HydrophobicContact CB-CD2 4.12Å; L123-W143 HydrophobicContact CB-CG 4.41Å; L123-W143 HydrophobicContact CB-CZ2 4.13Å; L123-W143 HydrophobicContact CD1-CZ2 4.42Å; L123-W143 PolarHBondContact N-O 3.39Å; L123-W143 PolarHBondContact O-N 2.96Å; L123-F145 HydrophobicContact CD1-CB 3.8Å; L123-F145 HydrophobicContact CG-CB 4.44Å; L123-Y151 HydrophobicContact CD1-CD2 4.19Å; L123-Y151 HydrophobicContact CD1-CE2 3.48Å; L123-Y151 VanDerWaalsContact CD1-CE2 3.48Å; L123-Y151 HydrophobicContact CD2-CE1 4.22Å; L123-Y151 HydrophobicContact CD2-CE2 3.88Å; L123-Y151 HydrophobicContact CG-CE2 4.36Å; L123-V157 HydrophobicContact CB-CG1 3.76Å; L123-V157 HydrophobicContact CD1-CG1 4.34Å; L123-V157 HydrophobicContact CD2-CG1 4.09Å; L123-V157 HydrophobicContact CG-CG1 4.27Å; L123-E158 WeakPolarHBondContact CA-O 3.44Å; L123-V159 HydrophobicContact CD2-CB 4.37Å; L123-V159 HydrophobicContact CD2-CG2 3.74Å
124	K	93.5	Very high	90.4	Very high	74 Å²	74	63.1 Å²	63.1	32%	0.322	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	131	176.4	-177.1	174.9	-179.5	175.5	0	110.9	D141 E142 V157 E158 V160	K124-D141 WeakPolarHBondContact CA-O 3.08Å; K124-E142 HydrophobicContact CB-CG 4.17Å; K124-E142 HydrophobicContact CD-CG 4.33Å; K124-E142 HydrophobicContact CG-CG 3.98Å; K124-V157 WeakPolarHBondContact O-CA 3.21Å; K124-E158 PolarHBondContact N-O 2.93Å; K124-E158 PolarHBondContact O-N 2.85Å; K124-V160 HydrophobicContact CB-CG2 3.65Å; K124-V160 HydrophobicContact CD-CG2 4.34Å
125	A	93.5	Very high	90.1	Very high	2 Å²	2	63.9 Å²	63.9	2%	0.017	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	127.7	172.7	0	0	0	0	0	110.8	F129 V137 V138 G140 D141 W143	A125-F129 HydrophobicContact CB-CE1 4.11Å; A125-V137 HydrophobicContact CB-CG1 3.78Å; A125-V138 WeakPolarHBondContact CB-O 3.35Å; A125-G140 PolarHBondContact O-N 2.99Å; A125-D141 PolarHBondContact N-O 2.87Å; A125-W143 HydrophobicContact CB-CH2 4.02Å; A125-W143 HydrophobicContact CB-CZ3 3.82Å
126	L	90.9	Very high	89.9	Confident	97 Å²	97	71.5 Å²	71.5	51%	0.508	37%	0.373	S	S	.	.	S	Bend	trans	-83.9	-29.9	173.8	-66.6	177.6	0	0	0	112.3	E156 E158	L126-E156 PolarHBondContact N-O 2.93Å; L126-E158 HydrophobicContact CD1-CB 4.24Å; L126-E158 HydrophobicContact CD2-CB 4.01Å; L126-E158 HydrophobicContact CG-CB 4.05Å
127	L	89.3	Confident	89.8	Confident	85 Å²	85	67.2 Å²	67.2	45%	0.445	35%	0.352	S	S	.	.	S	Bend	trans	-149.6	161.8	-176.1	57.8	108.5	0	0	0	110.5	F129 E156	L127-F129 WeakPolarHBondContact O-CD1 3.35Å; L127-F129 PolarHBondContact O-N 3.31Å; L127-E156 HydrophobicContact CD1-CB 4.06Å; L127-E156 HydrophobicContact CD1-CG 3.61Å; L127-E156 HydrophobicContact CD2-CB 4.48Å; L127-E156 HydrophobicContact CD2-CG 4.44Å; L127-E156 HydrophobicContact CG-CB 3.99Å; L127-E156 HydrophobicContact CG-CG 4.06Å
128	D	91.1	Very high	89.8	Confident	110 Å²	110	67.1 Å²	67.1	59%	0.588	35%	0.349	S	S	*	.			trans	-68.2	128.5	179.7	-58.9	-9.7	0	0	0	110.6	V137 A139	D128-V137 WeakPolarHBondContact CA-O 3.49Å; D128-A139 WeakPolarHBondContact OD1-CB 3.39Å; D128-A139 PolarHBondContact OD1-N 3.25Å
129	F	90.9	Very high	89.8	Confident	22 Å²	22	64.7 Å²	64.7	10%	0.096	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	163.9	176.3	74.2	-82.9	0	0	0	112.3	A125 L127 D131 V137 W143 E156 V157	A125-F129 HydrophobicContact CB-CE1 4.11Å; L127-F129 WeakPolarHBondContact O-CD1 3.35Å; L127-F129 PolarHBondContact O-N 3.31Å; F129-D131 HydrophobicContact CE2-CB 4.35Å; F129-V137 HydrophobicContact CD1-CB 4.14Å; F129-V137 HydrophobicContact CD1-CG1 4.43Å; F129-V137 HydrophobicContact CE1-CB 3.77Å; F129-V137 HydrophobicContact CE1-CG1 3.75Å; F129-V137 HydrophobicContact CE1-CG2 4.31Å; F129-V137 HydrophobicContact CE2-CB 4.44Å; F129-V137 HydrophobicContact CE2-CG2 4.23Å; F129-V137 HydrophobicContact CZ-CB 3.93Å; F129-V137 HydrophobicContact CZ-CG1 4.09Å; F129-V137 HydrophobicContact CZ-CG2 3.93Å; F129-V137 PolarHBondContact N-O 3.32Å; F129-V137 PolarHBondContact O-N 3Å; F129-W143 HydrophobicContact CE1-CH2 4.07Å; F129-W143 AromaticContact CZ-CH2 3.97Å; F129-W143 HydrophobicContact CZ-CH2 3.97Å; F129-W143 HydrophobicContact CZ-CZ2 4.28Å; F129-E156 HydrophobicContact CB-CB 4.23Å; F129-E156 HydrophobicContact CB-CG 3.92Å; F129-E156 HydrophobicContact CD1-CB 3.51Å; F129-E156 HydrophobicContact CD1-CG 4.16Å; F129-E156 HydrophobicContact CE1-CB 4Å; F129-E156 HydrophobicContact CG-CB 3.87Å; F129-E156 HydrophobicContact CG-CG 4.04Å; F129-V157 HydrophobicContact CE1-CG2 3.8Å; F129-V157 HydrophobicContact CZ-CG2 3.72Å
130	E	89.6	Confident	89.5	Confident	127 Å²	127	65.2 Å²	65.2	59%	0.593	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.1	125.8	173.2	-70.3	-179.2	173.5	0	0	109.5	D135 K136	E130-D135 WeakPolarHBondContact CA-O 2.96Å; E130-K136 HydrophobicContact CG-CG 4.04Å; E130-K136 VanDerWaalsContact OE1-CE 3.3Å; E130-K136 WeakPolarHBondContact OE1-CE 3.5Å
131	D	84.2	Confident	89.3	Confident	45 Å²	45	68.7 Å²	68.7	24%	0.241	37%	0.371	C	S	.	.			trans	-72.6	170	175.8	-156.1	-5.1	0	0	0	111.3	F129 D133 G134 D135 V137 R154	F129-D131 HydrophobicContact CE2-CB 4.35Å; D131-D133 PolarHBondContact O-N 2.83Å; D131-D133 VanDerWaalsContact O-N 3.16Å; D131-G134 PolarHBondContact O-N 3.23Å; D131-D135 PolarHBondContact N-O 3.38Å; D131-V137 HydrophobicContact CB-CG2 4.37Å; D131-R154 IonicContact OD1-CZ 3.06Å; D131-R154 IonicContact OD1-NH1 3.03Å; D131-R154 PolarHBondContact OD1-NH1 3.39Å; D131-R154 IonicContact OD1-NH2 2.66Å; D131-R154 PolarHBondContact OD1-NH2 3.41Å
132	K	80.6	Confident	89.2	Confident	160 Å²	160	70.8 Å²	70.8	70%	0.696	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-28	179.3	-67.8	179.2	-179.9	-179.3	0	112.9	G134	K132-G134 VanDerWaalsContact C-N 3.28Å
133	D	80.9	Confident	89.1	Confident	136 Å²	136	73.8 Å²	73.8	73%	0.727	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-2.7	178.2	-59.6	-43.7	0	0	0	112.6	D131	D131-D133 PolarHBondContact O-N 2.83Å; D131-D133 VanDerWaalsContact O-N 3.16Å
134	G	82.1	Confident	89	Confident	48 Å²	48	75.2 Å²	75.2	50%	0.495	40%	0.399	S	S	.	.	S	Bend	trans	87.9	3.8	179.9	0	0	0	0	0	114.3	D131 K132	D131-G134 PolarHBondContact O-N 3.23Å; K132-G134 VanDerWaalsContact C-N 3.28Å
135	D	86.8	Confident	89	Confident	111 Å²	111	74.7 Å²	74.7	59%	0.594	40%	0.397	S	S	*	.			trans	-76.3	137	178	-68.7	-34.8	0	0	0	111.4	E130 D131 V137	E130-D135 WeakPolarHBondContact CA-O 2.96Å; D131-D135 PolarHBondContact N-O 3.38Å; D135-V137 PolarHBondContact O-N 3.1Å
136	K	89.4	Confident	89	Confident	163 Å²	163	79.4 Å²	79.4	71%	0.709	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.7	114.1	177.8	-68.4	-176.8	177.8	-171.9	0	109.7	E130	E130-K136 HydrophobicContact CG-CG 4.04Å; E130-K136 VanDerWaalsContact OE1-CE 3.3Å; E130-K136 WeakPolarHBondContact OE1-CE 3.5Å
137	V	90.4	Very high	89	Confident	20 Å²	20	75.7 Å²	75.7	12%	0.121	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	129.3	174	-175.9	0	0	0	0	108.5	A125 D128 F129 D131 D135 D141 W143	A125-V137 HydrophobicContact CB-CG1 3.78Å; D128-V137 WeakPolarHBondContact CA-O 3.49Å; F129-V137 HydrophobicContact CD1-CB 4.14Å; F129-V137 HydrophobicContact CD1-CG1 4.43Å; F129-V137 HydrophobicContact CE1-CB 3.77Å; F129-V137 HydrophobicContact CE1-CG1 3.75Å; F129-V137 HydrophobicContact CE1-CG2 4.31Å; F129-V137 HydrophobicContact CE2-CB 4.44Å; F129-V137 HydrophobicContact CE2-CG2 4.23Å; F129-V137 HydrophobicContact CZ-CB 3.93Å; F129-V137 HydrophobicContact CZ-CG1 4.09Å; F129-V137 HydrophobicContact CZ-CG2 3.93Å; F129-V137 PolarHBondContact N-O 3.32Å; F129-V137 PolarHBondContact O-N 3Å; D131-V137 HydrophobicContact CB-CG2 4.37Å; D135-V137 PolarHBondContact O-N 3.1Å; V137-D141 HydrophobicContact CG1-CB 3.97Å; V137-W143 HydrophobicContact CG1-CE3 4.47Å; V137-W143 HydrophobicContact CG1-CH2 3.94Å; V137-W143 HydrophobicContact CG1-CZ3 3.64Å
138	V	91.8	Very high	89.1	Confident	78 Å²	78	76.8 Å²	76.8	47%	0.473	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-94.2	148.1	-178.6	-177.7	0	0	0	0	110.1	A125 G140 D141	A125-V138 WeakPolarHBondContact CB-O 3.35Å; V138-G140 PolarHBondContact O-N 3.26Å; V138-D141 PolarHBondContact N-OD2 3.28Å; V138-D141 VanDerWaalsContact O-CB 3.25Å; V138-D141 WeakPolarHBondContact O-CB 3.47Å; V138-D141 VanDerWaalsContact O-CG 3.28Å; V138-D141 PolarHBondContact O-N 2.98Å
139	A	90.6	Very high	89.2	Confident	48 Å²	48	72.6 Å²	72.6	40%	0.397	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	126.8	174.7	0	0	0	0	0	111.1	D128	D128-A139 WeakPolarHBondContact OD1-CB 3.39Å; D128-A139 PolarHBondContact OD1-N 3.25Å
140	G	88.4	Confident	89.2	Confident	31 Å²	31	74.7 Å²	74.7	32%	0.32	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	91	-4.8	-176.3	0	0	0	0	0	115	A125 V138	A125-G140 PolarHBondContact O-N 2.99Å; V138-G140 PolarHBondContact O-N 3.26Å
141	D	90.1	Very high	89.4	Confident	73 Å²	73	69.3 Å²	69.3	39%	0.39	39%	0.388	S	S	.	.			trans	-63.3	142.3	169.5	-72.7	-15.8	0	0	0	110.3	K124 A125 V137 V138 W143	K124-D141 WeakPolarHBondContact CA-O 3.08Å; A125-D141 PolarHBondContact N-O 2.87Å; V137-D141 HydrophobicContact CG1-CB 3.97Å; V138-D141 PolarHBondContact N-OD2 3.28Å; V138-D141 VanDerWaalsContact O-CB 3.25Å; V138-D141 WeakPolarHBondContact O-CB 3.47Å; V138-D141 VanDerWaalsContact O-CG 3.28Å; V138-D141 PolarHBondContact O-N 2.98Å; D141-W143 HydrophobicContact CB-CZ3 4.37Å; D141-W143 WeakPolarHBondContact O-CZ3 3.39Å
142	E	91.2	Very high	89.7	Confident	46 Å²	46	70.7 Å²	70.7	22%	0.215	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	133.6	-176.2	-66.6	174.7	-160.7	0	0	109.9	H122 L123 K124 V208 F209	H122-E142 IonicContact CE1-OE2 3.23Å; H122-E142 PolarHBondContact CE1-OE2 3.48Å; H122-E142 IonicContact NE2-OE2 2.79Å; H122-E142 PolarHBondContact NE2-OE2 3.35Å; L123-E142 VanDerWaalsContact O-CA 3.24Å; L123-E142 WeakPolarHBondContact O-CA 3.32Å; K124-E142 HydrophobicContact CB-CG 4.17Å; K124-E142 HydrophobicContact CD-CG 4.33Å; K124-E142 HydrophobicContact CG-CG 3.98Å; E142-V208 HydrophobicContact CB-CG1 3.46Å; E142-V208 VanDerWaalsContact CB-CG1 3.46Å; E142-F209 HydrophobicContact CB-CE1 4.25Å; E142-F209 HydrophobicContact CB-CZ 4.4Å
143	W	91.5	Very high	90.2	Very high	71 Å²	71	64 Å²	64	27%	0.269	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	169.5	179.1	65.9	99.8	0	0	0	111	L123 A125 F129 V137 D141 V157 V208	L123-W143 HydrophobicContact CB-CD2 4.12Å; L123-W143 HydrophobicContact CB-CG 4.41Å; L123-W143 HydrophobicContact CB-CZ2 4.13Å; L123-W143 HydrophobicContact CD1-CZ2 4.42Å; L123-W143 PolarHBondContact N-O 3.39Å; L123-W143 PolarHBondContact O-N 2.96Å; A125-W143 HydrophobicContact CB-CH2 4.02Å; A125-W143 HydrophobicContact CB-CZ3 3.82Å; F129-W143 HydrophobicContact CE1-CH2 4.07Å; F129-W143 AromaticContact CZ-CH2 3.97Å; F129-W143 HydrophobicContact CZ-CH2 3.97Å; F129-W143 HydrophobicContact CZ-CZ2 4.28Å; V137-W143 HydrophobicContact CG1-CE3 4.47Å; V137-W143 HydrophobicContact CG1-CH2 3.94Å; V137-W143 HydrophobicContact CG1-CZ3 3.64Å; D141-W143 HydrophobicContact CB-CZ3 4.37Å; D141-W143 WeakPolarHBondContact O-CZ3 3.39Å; W143-V157 HydrophobicContact CH2-CG1 3.96Å; W143-V157 HydrophobicContact CH2-CG2 3.78Å; W143-V157 HydrophobicContact CZ2-CB 4.47Å; W143-V157 HydrophobicContact CZ2-CG1 3.76Å; W143-V157 HydrophobicContact CZ2-CG2 3.78Å; W143-V208 VanDerWaalsContact CA-CG2 3.49Å
144	L	92.9	Very high	90.7	Very high	33 Å²	33	60.8 Å²	60.8	17%	0.173	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	140.1	175.8	-61.6	-177.3	0	0	0	111.2	A120 L121 H122 E146 I163 P206 V208	A120-L144 HydrophobicContact CB-CB 4.19Å; A120-L144 HydrophobicContact CB-CD1 4.34Å; A120-L144 HydrophobicContact CB-CD2 4.36Å; L121-L144 WeakPolarHBondContact O-CA 3.43Å; H122-L144 HydrophobicContact CB-CD2 4.3Å; L144-E146 HydrophobicContact CB-CG 4.37Å; L144-I163 HydrophobicContact CD2-CD1 3.7Å; L144-P206 WeakPolarHBondContact CD1-O 3.18Å; L144-V208 HydrophobicContact CD1-CG2 4.48Å; L144-V208 HydrophobicContact CD2-CG2 3.86Å; L144-V208 HydrophobicContact CG-CG2 3.62Å
145	F	93.3	Very high	91	Very high	63 Å²	63	61.5 Å²	61.5	28%	0.276	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	99.3	158.3	-178.7	-88.6	0	0	0	108.2	V115 A120 L121 L123 Y151	V115-F145 HydrophobicContact CB-CD1 4.19Å; V115-F145 HydrophobicContact CB-CE1 4.12Å; V115-F145 HydrophobicContact CG1-CD1 4.47Å; V115-F145 HydrophobicContact CG2-CD1 3.74Å; V115-F145 HydrophobicContact CG2-CE1 3.8Å; A120-F145 VanDerWaalsContact CA-O 3.24Å; A120-F145 WeakPolarHBondContact CA-O 3.39Å; A120-F145 WeakPolarHBondContact CB-O 3.29Å; L121-F145 HydrophobicContact CB-CB 4.31Å; L121-F145 PolarHBondContact N-O 3.45Å; L121-F145 PolarHBondContact O-N 2.87Å; L123-F145 HydrophobicContact CD1-CB 3.8Å; L123-F145 HydrophobicContact CG-CB 4.44Å; F145-Y151 HydrophobicContact CB-CD2 4.44Å; F145-Y151 HydrophobicContact CD1-CD2 4.43Å; F145-Y151 HydrophobicContact CD2-CD2 4.11Å; F145-Y151 HydrophobicContact CE2-CD2 4.48Å; F145-Y151 HydrophobicContact CG-CD2 4.08Å
146	E	92.6	Very high	91.2	Very high	101 Å²	101	58 Å²	58	47%	0.472	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	132.7	-179.7	-60.4	-168	153.5	0	0	111.2	L144 R185 L205	L144-E146 HydrophobicContact CB-CG 4.37Å; E146-R185 IonicContact OE1-CZ 3.56Å; E146-R185 IonicContact OE1-NH2 3.45Å; E146-R185 PolarHBondContact OE1-NH2 3.4Å; E146-L205 HydrophobicContact CB-CD2 4.47Å; E146-L205 HydrophobicContact CG-CD2 3.93Å
147	G	90.8	Very high	91.3	Very high	19 Å²	19	50.8 Å²	50.8	20%	0.196	29%	0.285	C	S	.	.	S	Bend	trans	-76.2	164.9	172.1	0	0	0	0	0	113	T119	T119-G147 PolarHBondContact O-N 2.94Å
148	P	92.5	Very high	91.5	Very high	107 Å²	107	54.6 Å²	54.6	70%	0.695	30%	0.301	S	S	*	.	S	Bend	cis	-84.8	129.5	5.9	30.8	-32.2	0	0	0	113.1	V115 P117	V115-P148 WeakPolarHBondContact O-CA 3.42Å; P117-P148 HydrophobicContact CG-CB 4.1Å
149	G	92.1	Very high	91.5	Very high	23 Å²	23	53.2 Å²	53.2	24%	0.237	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170	161.6	179.6	0	0	0	0	0	112.6	V115	V115-G149 PolarHBondContact N-O 3.38Å; V115-G149 PolarHBondContact O-N 2.88Å; V115-G149 VanDerWaalsContact O-N 3.16Å
150	T	92	Very high	91.7	Very high	65 Å²	65	54.2 Å²	54.2	40%	0.399	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	115.9	169.5	-57.8	0	0	0	0	108.2	L112 I152	L112-T150 HydrophobicContact CB-CG2 3.47Å; L112-T150 VanDerWaalsContact CB-CG2 3.47Å; L112-T150 HydrophobicContact CD1-CG2 3.94Å; L112-T150 HydrophobicContact CG-CG2 4.3Å; T150-I152 PolarHBondContact O-N 2.96Å
151	Y	93.3	Very high	91.8	Very high	15 Å²	15	57.2 Å²	57.2	6%	0.059	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	124.5	178.4	176	-111.7	0	0	0	109.8	Q113 L121 L123 F145 P153 V159	Q113-Y151 PolarHBondContact O-N 2.79Å; L121-Y151 HydrophobicContact CD1-CD1 3.76Å; L121-Y151 HydrophobicContact CD1-CD2 4.26Å; L121-Y151 HydrophobicContact CD1-CG 3.59Å; L123-Y151 HydrophobicContact CD1-CD2 4.19Å; L123-Y151 HydrophobicContact CD1-CE2 3.48Å; L123-Y151 VanDerWaalsContact CD1-CE2 3.48Å; L123-Y151 HydrophobicContact CD2-CE1 4.22Å; L123-Y151 HydrophobicContact CD2-CE2 3.88Å; L123-Y151 HydrophobicContact CG-CE2 4.36Å; F145-Y151 HydrophobicContact CB-CD2 4.44Å; F145-Y151 HydrophobicContact CD1-CD2 4.43Å; F145-Y151 HydrophobicContact CD2-CD2 4.11Å; F145-Y151 HydrophobicContact CE2-CD2 4.48Å; F145-Y151 HydrophobicContact CG-CD2 4.08Å; Y151-P153 HydrophobicContact CE1-CB 4.12Å; Y151-V159 HydrophobicContact CD1-CG2 4.25Å; Y151-V159 HydrophobicContact CE1-CG2 3.66Å
152	I	91.3	Very high	92	Very high	73 Å²	73	58.3 Å²	58.3	37%	0.374	31%	0.305	S	S	.	.			trans	-92.2	113.8	171.4	-61.8	173.7	0	0	0	106.8	L92 T150	L92-I152 HydrophobicContact CD1-CD1 4.47Å; L92-I152 HydrophobicContact CD1-CG2 4.39Å; L92-I152 HydrophobicContact CD2-CG2 4.19Å; T150-I152 PolarHBondContact O-N 2.96Å
153	P	91	Very high	92	Very high	21 Å²	21	57.4 Å²	57.4	14%	0.136	30%	0.301	C	S	.	.			trans	-63.4	148.1	-179	25.8	-30.8	0	0	0	110.3	Y58 I90 L112 Y151	Y58-P153 HydrophobicContact CD1-CG 3.91Å; Y58-P153 HydrophobicContact CD2-CG 3.7Å; Y58-P153 HydrophobicContact CE1-CG 3.76Å; Y58-P153 HydrophobicContact CE2-CB 4.32Å; Y58-P153 HydrophobicContact CE2-CG 3.54Å; Y58-P153 HydrophobicContact CG-CG 3.87Å; I90-P153 HydrophobicContact CD1-CB 4.07Å; I90-P153 HydrophobicContact CD1-CG 4.3Å; I90-P153 WeakPolarHBondContact CD1-O 3.38Å; I90-P153 HydrophobicContact CG2-CG 4.22Å; L112-P153 VanDerWaalsContact CD2-CD 3.44Å; L112-P153 HydrophobicContact CD2-CG 4.31Å; Y151-P153 HydrophobicContact CE1-CB 4.12Å
154	R	89.9	Confident	92	Very high	67 Å²	67	61 Å²	61	25%	0.253	32%	0.32	S	S	.	.			trans	-119.3	154.5	173	-64.8	-166.8	-172.3	-166.9	11.2	108.9	I90 D131 E156 V157	I90-R154 VanDerWaalsContact CD1-C 3.43Å; D131-R154 IonicContact OD1-CZ 3.06Å; D131-R154 IonicContact OD1-NH1 3.03Å; D131-R154 PolarHBondContact OD1-NH1 3.39Å; D131-R154 IonicContact OD1-NH2 2.66Å; D131-R154 PolarHBondContact OD1-NH2 3.41Å; R154-E156 VanDerWaalsContact C-N 3.29Å; R154-V157 HydrophobicContact CB-CB 4.13Å; R154-V157 HydrophobicContact CB-CG2 3.91Å
155	K	88.8	Confident	92	Very high	63 Å²	63	60.3 Å²	60.3	27%	0.274	32%	0.32	S	S	.	.	S	Bend	trans	-76.3	-25.1	179.7	62.7	-174.5	-179	174.7	0	111.7	D87 L88 V157	D87-K155 IonicContact OD1-NZ 3.25Å; D87-K155 PolarHBondContact OD1-NZ 2.84Å; D87-K155 IonicContact OD2-NZ 2.71Å; D87-K155 PolarHBondContact OD2-NZ 3.47Å; L88-K155 HydrophobicContact CB-CB 3.97Å; L88-K155 HydrophobicContact CB-CD 4.24Å; L88-K155 WeakPolarHBondContact O-CD 3.4Å; L88-K155 PolarHBondContact O-NZ 3.45Å; K155-V157 VanDerWaalsContact C-N 3.34Å
156	E	90.9	Very high	92	Very high	37 Å²	37	59.1 Å²	59.1	17%	0.173	32%	0.318	C	S	.	.	S	Bend	trans	-86	-7.7	-178.8	-50.8	87.2	175.1	0	0	112.6	L126 L127 F129 R154	L126-E156 PolarHBondContact N-O 2.93Å; L127-E156 HydrophobicContact CD1-CB 4.06Å; L127-E156 HydrophobicContact CD1-CG 3.61Å; L127-E156 HydrophobicContact CD2-CB 4.48Å; L127-E156 HydrophobicContact CD2-CG 4.44Å; L127-E156 HydrophobicContact CG-CB 3.99Å; L127-E156 HydrophobicContact CG-CG 4.06Å; F129-E156 HydrophobicContact CB-CB 4.23Å; F129-E156 HydrophobicContact CB-CG 3.92Å; F129-E156 HydrophobicContact CD1-CB 3.51Å; F129-E156 HydrophobicContact CD1-CG 4.16Å; F129-E156 HydrophobicContact CE1-CB 4Å; F129-E156 HydrophobicContact CG-CB 3.87Å; F129-E156 HydrophobicContact CG-CG 4.04Å; R154-E156 VanDerWaalsContact C-N 3.29Å
157	V	92.9	Very high	92.1	Very high	13 Å²	13	59.9 Å²	59.9	8%	0.079	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	128.1	-170.1	-173.6	0	0	0	0	110.6	L123 K124 F129 W143 R154 K155	L123-V157 HydrophobicContact CB-CG1 3.76Å; L123-V157 HydrophobicContact CD1-CG1 4.34Å; L123-V157 HydrophobicContact CD2-CG1 4.09Å; L123-V157 HydrophobicContact CG-CG1 4.27Å; K124-V157 WeakPolarHBondContact O-CA 3.21Å; F129-V157 HydrophobicContact CE1-CG2 3.8Å; F129-V157 HydrophobicContact CZ-CG2 3.72Å; W143-V157 HydrophobicContact CH2-CG1 3.96Å; W143-V157 HydrophobicContact CH2-CG2 3.78Å; W143-V157 HydrophobicContact CZ2-CB 4.47Å; W143-V157 HydrophobicContact CZ2-CG1 3.76Å; W143-V157 HydrophobicContact CZ2-CG2 3.78Å; R154-V157 HydrophobicContact CB-CB 4.13Å; R154-V157 HydrophobicContact CB-CG2 3.91Å; K155-V157 VanDerWaalsContact C-N 3.34Å
158	E	93	Very high	92.2	Very high	99 Å²	99	59 Å²	59	46%	0.463	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	141.9	172.7	-175.6	175.5	-156	0	0	110.5	L123 K124 L126	L123-E158 WeakPolarHBondContact CA-O 3.44Å; K124-E158 PolarHBondContact N-O 2.93Å; K124-E158 PolarHBondContact O-N 2.85Å; L126-E158 HydrophobicContact CD1-CB 4.24Å; L126-E158 HydrophobicContact CD2-CB 4.01Å; L126-E158 HydrophobicContact CG-CB 4.05Å
159	V	93.4	Very high	92.2	Very high	50 Å²	50	62.2 Å²	62.2	30%	0.303	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	108.7	169.4	-177.5	0	0	0	0	107.5	L121 L123 Y151	L121-V159 HydrophobicContact CB-CG1 4.31Å; L121-V159 HydrophobicContact CD2-CG1 4.24Å; L123-V159 HydrophobicContact CD2-CB 4.37Å; L123-V159 HydrophobicContact CD2-CG2 3.74Å; Y151-V159 HydrophobicContact CD1-CG2 4.25Å; Y151-V159 HydrophobicContact CE1-CG2 3.66Å
160	V	93.1	Very high	92.2	Very high	69 Å²	69	68.6 Å²	68.6	42%	0.418	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	-55.8	-177.7	-178.9	0	0	0	0	110.3	H122 K124	H122-V160 HydrophobicContact CB-CB 4.3Å; H122-V160 PolarHBondContact O-N 3.08Å; K124-V160 HydrophobicContact CB-CG2 3.65Å; K124-V160 HydrophobicContact CD-CG2 4.34Å
161	E	92	Very high	92.1	Very high	94 Å²	94	69.3 Å²	69.3	44%	0.439	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	169	-179	62.2	-179.1	-176.2	0	0	112.8	H122 I163	H122-E161 HydrophobicContact CB-CG 3.87Å; H122-E161 PolarHBondContact N-O 3.23Å; E161-I163 HydrophobicContact CG-CG1 4.27Å
162	I	92.6	Very high	92.2	Very high	96 Å²	96	70.2 Å²	70.2	49%	0.492	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	113.1	172.5	-52.5	179	0	0	0	107.5	A120 L121	A120-I162 CarbonylContact O-C 3.5Å; A120-I162 WeakPolarHBondContact O-CA 3.42Å; L121-I162 HydrophobicContact CD2-CB 4.46Å; L121-I162 HydrophobicContact CD2-CD1 4.41Å; L121-I162 HydrophobicContact CD2-CG1 3.75Å; L121-I162 HydrophobicContact CD2-CG2 4.43Å
163	I	92.4	Very high	92.3	Very high	26 Å²	26	66.7 Å²	66.7	13%	0.133	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	133.3	177.1	-64.3	166.9	0	0	0	108.5	T119 A120 H122 L144 E161 L205 P206	T119-I163 CarbonylContact C-O 3.46Å; T119-I163 WeakPolarHBondContact CA-O 3.42Å; A120-I163 PolarHBondContact N-O 2.96Å; A120-I163 PolarHBondContact O-N 3.42Å; H122-I163 HydrophobicContact CB-CD1 3.96Å; H122-I163 HydrophobicContact CB-CG1 4.47Å; L144-I163 HydrophobicContact CD2-CD1 3.7Å; E161-I163 HydrophobicContact CG-CG1 4.27Å; I163-L205 HydrophobicContact CG2-CD1 4.03Å; I163-P206 HydrophobicContact CG2-CG 4.39Å
164	Q	91.8	Very high	92.4	Very high	146 Å²	146	65.8 Å²	65.8	68%	0.682	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.3	143.7	173.6	-61.8	-172.9	-11.7	0	0	109.7	T119	T119-Q164 HydrophobicContact CG2-CG 4.26Å
165	A	92.8	Very high	92.7	Very high	19 Å²	19	65.4 Å²	65.4	16%	0.157	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-69.5	138.5	174.1	0	0	0	0	0	111.3	N118 A203 Y204 L205	N118-A165 HydrophobicContact CB-CB 3.88Å; N118-A165 WeakPolarHBondContact O-CB 3.12Å; N118-A165 PolarHBondContact O-N 3.04Å; A165-A203 HydrophobicContact CB-CB 3.91Å; A165-Y204 CarbonylContact C-O 3.42Å; A165-Y204 WeakPolarHBondContact CA-O 3.44Å; A165-Y204 WeakPolarHBondContact CB-O 3.47Å; A165-L205 HydrophobicContact CB-CB 4.11Å; A165-L205 HydrophobicContact CB-CD1 4.17Å
166	T	93.3	Very high	92.9	Very high	38 Å²	38	62.4 Å²	62.4	23%	0.233	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	130.2	174.4	-57.2	0	0	0	0	109.6	I168 L174 Y204 L215	T166-I168 PolarHBondContact O-N 3.35Å; T166-L174 HydrophobicContact CG2-CD1 3.73Å; T166-L174 HydrophobicContact CG2-CD2 4.47Å; T166-Y204 PolarHBondContact N-O 3.3Å; T166-Y204 PolarHBondContact O-N 2.87Å; T166-L215 HydrophobicContact CG2-CD1 4.34Å; T166-L215 HydrophobicContact CG2-CD2 4.31Å; T166-L215 HydrophobicContact CG2-CG 4.42Å
167	I	93.4	Very high	93.1	Very high	118 Å²	118	64.6 Å²	64.6	61%	0.605	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.5	116.3	-179.1	-58.7	171.1	0	0	0	109.6
168	I	94.1	Very high	93.2	Very high	1 Å²	1	64 Å²	64	1%	0.005	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	118.3	174.3	-51.2	176.8	0	0	0	108	T166 Q172 L174 V198 G202 Y204 L215	T166-I168 PolarHBondContact O-N 3.35Å; I168-Q172 HydrophobicContact CG2-CB 4.23Å; I168-Q172 VanDerWaalsContact CG2-O 3.27Å; I168-Q172 WeakPolarHBondContact CG2-O 3.3Å; I168-L174 HydrophobicContact CD1-CB 3.51Å; I168-L174 HydrophobicContact CD1-CD2 4.31Å; I168-L174 HydrophobicContact CG1-CB 3.94Å; I168-V198 HydrophobicContact CD1-CB 4.33Å; I168-V198 HydrophobicContact CD1-CG1 4.04Å; I168-G202 PolarHBondContact N-O 3.28Å; I168-G202 PolarHBondContact O-N 3.28Å; I168-Y204 HydrophobicContact CD1-CG 4.37Å; I168-L215 HydrophobicContact CG1-CD2 4.39Å
169	R	93	Very high	93.1	Very high	174 Å²	174	65.2 Å²	65.2	66%	0.657	31%	0.308	S	S	*	.	P	Polyproline II helix	trans	-84.8	172	176	-57.7	179.2	179.7	175.5	1.8	110.8	Q172	R169-Q172 HydrophobicContact CB-CG 4.24Å; R169-Q172 VanDerWaalsContact CB-OE1 3.27Å; R169-Q172 PolarHBondContact O-N 2.87Å
170	Q	90.5	Very high	92.9	Very high	156 Å²	156	67.7 Å²	67.7	73%	0.729	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	141.3	167.6	-168.4	170.3	6.7	0	0	109.9	Q172	Q170-Q172 PolarHBondContact O-N 2.9Å
171	N	91.8	Very high	92.8	Very high	81 Å²	81	71.4 Å²	71.4	43%	0.433	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.3	25.9	-174.6	-57.7	-13.7	0	0	0	114.2	A218	N171-A218 HydrophobicContact CB-CB 3.83Å; N171-A218 WeakPolarHBondContact O-CB 3.48Å; N171-A218 PolarHBondContact O-N 3.42Å
172	Q	93.4	Very high	92.6	Very high	33 Å²	33	67.7 Å²	67.7	15%	0.154	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	153.9	170.3	-62.5	-170.7	-43.8	0	0	109.9	I168 R169 Q170 V216 D217	I168-Q172 HydrophobicContact CG2-CB 4.23Å; I168-Q172 VanDerWaalsContact CG2-O 3.27Å; I168-Q172 WeakPolarHBondContact CG2-O 3.3Å; R169-Q172 HydrophobicContact CB-CG 4.24Å; R169-Q172 VanDerWaalsContact CB-OE1 3.27Å; R169-Q172 PolarHBondContact O-N 2.87Å; Q170-Q172 PolarHBondContact O-N 2.9Å; Q172-V216 CarbonylContact C-O 3.52Å; Q172-V216 WeakPolarHBondContact CA-O 3.3Å; Q172-D217 WeakPolarHBondContact CG-OD1 3.44Å; Q172-D217 PolarHBondContact NE2-OD1 2.94Å
173	A	93.6	Very high	92.4	Very high	0 Å²	0	71.1 Å²	71.1	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	151.6	166.7	0	0	0	0	0	110.6	L197 V198 T199 L215 V216 V260	A173-L197 HydrophobicContact CB-CB 4.11Å; A173-L197 HydrophobicContact CB-CD1 4.15Å; A173-L197 HydrophobicContact CB-CD2 4.35Å; A173-L197 HydrophobicContact CB-CG 4.44Å; A173-V198 CarbonylContact C-O 3.55Å; A173-V198 VanDerWaalsContact CA-O 3.26Å; A173-V198 WeakPolarHBondContact CA-O 3.44Å; A173-V198 WeakPolarHBondContact CB-O 3.2Å; A173-T199 HydrophobicContact CB-CG2 3.98Å; A173-L215 CarbonylContact O-C 3.47Å; A173-L215 WeakPolarHBondContact O-CA 3.41Å; A173-V216 PolarHBondContact N-O 2.58Å; A173-V216 PolarHBondContact O-N 3.25Å; A173-V260 HydrophobicContact CB-CG1 3.76Å
174	L	94.7	Very high	92.2	Very high	1 Å²	1	70.3 Å²	70.3	1%	0.005	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	123.7	174.2	-172.8	66.7	0	0	0	109.8	T166 I168 L176 L197 V198 Y204 V212 L215	T166-L174 HydrophobicContact CG2-CD1 3.73Å; T166-L174 HydrophobicContact CG2-CD2 4.47Å; I168-L174 HydrophobicContact CD1-CB 3.51Å; I168-L174 HydrophobicContact CD1-CD2 4.31Å; I168-L174 HydrophobicContact CG1-CB 3.94Å; L174-L176 HydrophobicContact CD2-CD2 3.79Å; L174-L176 HydrophobicContact CG-CD2 3.97Å; L174-L176 HydrophobicContact CG-CG 4.48Å; L174-L197 CarbonylContact O-C 3.57Å; L174-L197 WeakPolarHBondContact O-CA 3.21Å; L174-V198 HydrophobicContact CB-CB 4.42Å; L174-V198 PolarHBondContact N-O 3.35Å; L174-V198 PolarHBondContact O-N 2.92Å; L174-Y204 HydrophobicContact CD2-CD1 3.58Å; L174-Y204 HydrophobicContact CD2-CE1 4.32Å; L174-Y204 HydrophobicContact CD2-CG 4.16Å; L174-V212 HydrophobicContact CD1-CG1 3.65Å; L174-V212 HydrophobicContact CD2-CG1 4.44Å; L174-V212 HydrophobicContact CD2-CG2 4.42Å; L174-V212 HydrophobicContact CG-CG1 4.31Å; L174-L215 HydrophobicContact CB-CD2 4.26Å; L174-L215 HydrophobicContact CD1-CD2 3.71Å; L174-L215 HydrophobicContact CD1-CG 4.14Å
175	R	94.9	Very high	91.8	Very high	59 Å²	59	69.6 Å²	69.6	22%	0.223	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	126.6	173	-166.5	-172	-172	152.3	-1.6	110.2	E195 W196 L197 L213 D214 V216 V263	R175-E195 IonicContact CZ-OE2 2.83Å; R175-E195 IonicContact NE-OE2 3.99Å; R175-E195 PolarHBondContact NE-OE2 2.91Å; R175-E195 IonicContact NH2-OE2 3.25Å; R175-E195 PolarHBondContact NH2-OE2 3.03Å; R175-W196 WeakPolarHBondContact CA-O 3.5Å; R175-L197 HydrophobicContact CB-CD2 3.68Å; R175-L197 HydrophobicContact CG-CD2 3.94Å; R175-L213 HydrophobicContact CB-CB 4.38Å; R175-L213 HydrophobicContact CG-CB 4.47Å; R175-L213 HydrophobicContact CG-CD1 4.16Å; R175-L213 PolarHBondContact O-N 2.91Å; R175-D214 VanDerWaalsContact CB-OD1 3.23Å; R175-D214 WeakPolarHBondContact CB-OD1 3.5Å; R175-D214 WeakPolarHBondContact CD-OD1 3.5Å; R175-D214 PolarHBondContact N-O 2.85Å; R175-V216 HydrophobicContact CB-CG2 4.38Å; R175-V263 HydrophobicContact CG-CG2 4.42Å
176	L	94.1	Very high	91.4	Very high	0 Å²	0	74.9 Å²	74.9	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	154.5	178.1	-59.5	178.5	0	0	0	110.3	L174 E195 W196 V198 Y204 E210 E211 V212	L174-L176 HydrophobicContact CD2-CD2 3.79Å; L174-L176 HydrophobicContact CG-CD2 3.97Å; L174-L176 HydrophobicContact CG-CG 4.48Å; L176-E195 WeakPolarHBondContact O-CA 3.44Å; L176-W196 HydrophobicContact CB-CD2 4.22Å; L176-W196 HydrophobicContact CB-CH2 4.28Å; L176-W196 HydrophobicContact CB-CZ2 3.86Å; L176-W196 HydrophobicContact CD1-CZ2 4Å; L176-W196 PolarHBondContact N-O 2.79Å; L176-W196 PolarHBondContact O-N 2.86Å; L176-W196 VanDerWaalsContact O-N 3.08Å; L176-V198 HydrophobicContact CD1-CG2 3.56Å; L176-V198 HydrophobicContact CG-CG2 4.3Å; L176-Y204 HydrophobicContact CD1-CD1 4.5Å; L176-Y204 HydrophobicContact CD1-CE1 3.53Å; L176-Y204 WeakPolarHBondContact CD1-OH 3.36Å; L176-Y204 HydrophobicContact CD2-CE1 4.36Å; L176-E210 HydrophobicContact CD1-CB 4.43Å; L176-E210 HydrophobicContact CD1-CG 4.45Å; L176-E211 CarbonylContact C-O 3.55Å; L176-E211 WeakPolarHBondContact CA-O 3.22Å; L176-V212 HydrophobicContact CD2-CB 4.39Å; L176-V212 HydrophobicContact CD2-CG2 3.85Å
177	R	94.6	Very high	91.1	Very high	83 Å²	83	75.4 Å²	75.4	31%	0.313	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	133.5	170.4	-177.4	169.9	64.9	-164.9	1.7	110.6	R179 E194 E195 E211 L213	R177-R179 PolarHBondContact O-N 3.12Å; R177-E194 CarbonylContact C-O 3.6Å; R177-E194 WeakPolarHBondContact CA-O 3.39Å; R177-E195 HydrophobicContact CB-CG 3.94Å; R177-E195 HydrophobicContact CG-CG 3.97Å; R177-E211 HydrophobicContact CB-CB 4.34Å; R177-E211 IonicContact CZ-OE1 3.34Å; R177-E211 IonicContact CZ-OE2 3.57Å; R177-E211 PolarHBondContact N-O 3.4Å; R177-E211 IonicContact NE-OE2 3.95Å; R177-E211 PolarHBondContact NE-OE2 2.9Å; R177-E211 IonicContact NH2-OE1 2.72Å; R177-E211 PolarHBondContact NH2-OE1 3.19Å; R177-E211 IonicContact NH2-OE2 3.2Å; R177-E211 PolarHBondContact NH2-OE2 2.84Å; R177-E211 WeakPolarHBondContact O-CB 3.39Å; R177-E211 PolarHBondContact O-N 2.8Å; R177-L213 HydrophobicContact CB-CD1 3.93Å; R177-L213 HydrophobicContact CB-CD2 4.43Å; R177-L213 HydrophobicContact CB-CG 4.15Å
178	A	94.2	Very high	90.9	Very high	2 Å²	2	75.3 Å²	75.3	2%	0.017	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	121.1	175.5	0	0	0	0	0	110.9	R190 V191 G193 E194 W196	A178-R190 HydrophobicContact CB-CB 4.18Å; A178-V191 VanDerWaalsContact CB-O 3.31Å; A178-V191 WeakPolarHBondContact CB-O 3.34Å; A178-G193 WeakPolarHBondContact O-CA 3.46Å; A178-G193 PolarHBondContact O-N 2.77Å; A178-E194 PolarHBondContact N-O 3.24Å; A178-W196 HydrophobicContact CB-CH2 3.99Å; A178-W196 HydrophobicContact CB-CZ3 3.66Å
179	R	90.9	Very high	90.8	Very high	123 Å²	123	81.1 Å²	81.1	46%	0.464	37%	0.366	S	S	.	.	S	Bend	trans	-75.5	-29.7	172.9	-67.8	-175.7	171.9	175.7	1.4	112.6	R177 F209 E211	R177-R179 PolarHBondContact O-N 3.12Å; R179-F209 PolarHBondContact N-O 2.88Å; R179-E211 HydrophobicContact CG-CB 3.98Å
180	K	89.6	Confident	90.7	Very high	103 Å²	103	73.8 Å²	73.8	45%	0.448	34%	0.339	S	S	.	.	S	Bend	trans	-144.4	169.7	178.1	-68.8	-176	-177.9	171.1	0	108.7	C182 T192 F209	K180-C182 PolarHBondContact O-N 3.44Å; K180-T192 WeakPolarHBondContact CA-OG1 3.06Å; K180-F209 HydrophobicContact CB-CB 4.47Å; K180-F209 HydrophobicContact CB-CD1 4.31Å; K180-F209 HydrophobicContact CB-CG 4.26Å; K180-F209 HydrophobicContact CD-CD1 4.04Å; K180-F209 HydrophobicContact CD-CE1 3.94Å; K180-F209 HydrophobicContact CG-CD1 4.36Å
181	E	91	Very high	90.8	Very high	146 Å²	146	70.1 Å²	70.1	68%	0.682	33%	0.327	S	S	*	.	S	Bend	trans	-58.5	120.2	168.8	-68.5	174.3	-178.6	0	0	109.5	R190 T192	E181-R190 WeakPolarHBondContact CA-O 3.18Å; E181-T192 PolarHBondContact N-OG1 3.02Å
182	C	88.5	Confident	90.9	Very high	16 Å²	16	70.4 Å²	70.4	11%	0.108	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	167.2	-175.8	67	0	0	0	0	111.4	K180 R190 F209	K180-C182 PolarHBondContact O-N 3.44Å; C182-R190 PolarHBondContact N-O 3.15Å; C182-R190 VanDerWaalsContact N-O 3.11Å; C182-R190 PolarHBondContact O-N 2.95Å; C182-F209 HydrophobicContact CB-CB 4.05Å; C182-F209 HydrophobicContact CB-CD2 4.08Å
183	W	88	Confident	90.7	Very high	169 Å²	169	71 Å²	71	64%	0.64	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.8	128.2	170.9	-63.3	83.1	0	0	0	107.7	G187 E189	W183-G187 WeakPolarHBondContact CZ3-O 3.36Å; W183-E189 HydrophobicContact CE3-CB 4.26Å; W183-E189 HydrophobicContact CH2-CB 4.13Å; W183-E189 HydrophobicContact CZ2-CB 4.48Å; W183-E189 HydrophobicContact CZ3-CB 4.02Å
184	D	87.9	Confident	90.7	Very high	9 Å²	9	72.7 Å²	72.7	5%	0.048	35%	0.354	C	S	.	.			trans	-72.1	172.1	173.2	70.6	15.7	0	0	0	111.4	D186 G187 K188 R190 W196	D184-D186 PolarHBondContact O-N 3.05Å; D184-D186 WeakPolarHBondContact OD1-CA 3.46Å; D184-D186 PolarHBondContact OD1-N 2.92Å; D184-G187 PolarHBondContact O-N 3.49Å; D184-G187 PolarHBondContact OD1-N 2.91Å; D184-K188 PolarHBondContact N-O 3.11Å; D184-K188 PolarHBondContact OD1-N 2.81Å; D184-K188 WeakPolarHBondContact OD2-CB 3.18Å; D184-R190 HydrophobicContact CB-CG 4.06Å; D184-R190 IonicContact OD2-CZ 2.86Å; D184-R190 IonicContact OD2-NE 2.65Å; D184-R190 PolarHBondContact OD2-NE 3.08Å; D184-R190 IonicContact OD2-NH2 2.85Å; D184-R190 PolarHBondContact OD2-NH2 2.89Å; D184-W196 HydrophobicContact CB-CZ2 4.13Å
185	R	84.6	Confident	90.6	Very high	130 Å²	130	74.8 Å²	74.8	49%	0.491	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-21.5	178	-77.2	-155.5	-175.8	-121	-4.7	114.4	E146 G187 Y204 L205	E146-R185 IonicContact OE1-CZ 3.56Å; E146-R185 IonicContact OE1-NH2 3.45Å; E146-R185 PolarHBondContact OE1-NH2 3.4Å; R185-G187 VanDerWaalsContact C-N 3.28Å; R185-Y204 HydrophobicContact CG-CE2 4.33Å; R185-L205 PolarHBondContact NE-O 3.29Å; R185-L205 PolarHBondContact NH2-O 2.97Å
186	D	83.7	Confident	90.5	Very high	131 Å²	131	72.5 Å²	72.5	70%	0.701	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	1.1	178	-62.9	-37.6	0	0	0	112.1	D184	D184-D186 PolarHBondContact O-N 3.05Å; D184-D186 WeakPolarHBondContact OD1-CA 3.46Å; D184-D186 PolarHBondContact OD1-N 2.92Å
187	G	86	Confident	90.5	Very high	48 Å²	48	73.9 Å²	73.9	50%	0.495	36%	0.362	S	S	.	.	S	Bend	trans	79.3	19.8	178.7	0	0	0	0	0	113.8	W183 D184 R185	W183-G187 WeakPolarHBondContact CZ3-O 3.36Å; D184-G187 PolarHBondContact O-N 3.49Å; D184-G187 PolarHBondContact OD1-N 2.91Å; R185-G187 VanDerWaalsContact C-N 3.28Å
188	K	88.9	Confident	90.4	Very high	117 Å²	117	70.3 Å²	70.3	51%	0.509	35%	0.349	S	S	.	.			trans	-93.7	135	174.6	-171.1	178.9	172.6	-162.8	0	110.2	D184	D184-K188 PolarHBondContact N-O 3.11Å; D184-K188 PolarHBondContact OD1-N 2.81Å; D184-K188 WeakPolarHBondContact OD2-CB 3.18Å
189	E	92.1	Very high	90.1	Very high	123 Å²	123	74.7 Å²	74.7	58%	0.575	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.2	131.1	175.3	-171.4	176.1	-164.3	0	0	110.4	W183	W183-E189 HydrophobicContact CE3-CB 4.26Å; W183-E189 HydrophobicContact CH2-CB 4.13Å; W183-E189 HydrophobicContact CZ2-CB 4.48Å; W183-E189 HydrophobicContact CZ3-CB 4.02Å
190	R	92.4	Very high	90.1	Very high	20 Å²	20	73.1 Å²	73.1	8%	0.075	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	130.3	179.6	-58.2	-58.6	-179.3	158.2	11.9	110.1	A178 E181 C182 D184 E194 W196	A178-R190 HydrophobicContact CB-CB 4.18Å; E181-R190 WeakPolarHBondContact CA-O 3.18Å; C182-R190 PolarHBondContact N-O 3.15Å; C182-R190 VanDerWaalsContact N-O 3.11Å; C182-R190 PolarHBondContact O-N 2.95Å; D184-R190 HydrophobicContact CB-CG 4.06Å; D184-R190 IonicContact OD2-CZ 2.86Å; D184-R190 IonicContact OD2-NE 2.65Å; D184-R190 PolarHBondContact OD2-NE 3.08Å; D184-R190 IonicContact OD2-NH2 2.85Å; D184-R190 PolarHBondContact OD2-NH2 2.89Å; R190-E194 WeakPolarHBondContact CA-OE2 3.36Å; R190-E194 WeakPolarHBondContact CD-OE1 3.4Å; R190-E194 IonicContact CZ-OE1 2.98Å; R190-E194 IonicContact NH1-OE1 3.4Å; R190-E194 PolarHBondContact NH1-OE1 3.33Å; R190-W196 HydrophobicContact CB-CH2 4.22Å; R190-W196 HydrophobicContact CB-CZ3 3.97Å; R190-W196 HydrophobicContact CG-CD2 4.37Å; R190-W196 HydrophobicContact CG-CE3 4.05Å; R190-W196 HydrophobicContact CG-CH2 3.91Å; R190-W196 HydrophobicContact CG-CZ2 4.21Å; R190-W196 HydrophobicContact CG-CZ3 3.82Å
191	V	92.8	Very high	90.2	Very high	79 Å²	79	72.7 Å²	72.7	48%	0.479	39%	0.386	S	S	.	.			trans	-86.9	157.4	177	-60.1	0	0	0	0	111.4	A178 G193 E194	A178-V191 VanDerWaalsContact CB-O 3.31Å; A178-V191 WeakPolarHBondContact CB-O 3.34Å; V191-G193 PolarHBondContact O-N 3.07Å; V191-E194 HydrophobicContact CG2-CB 3.85Å; V191-E194 PolarHBondContact N-OE2 2.93Å; V191-E194 WeakPolarHBondContact O-CB 3.39Å; V191-E194 PolarHBondContact O-N 2.53Å
192	T	92.4	Very high	90.3	Very high	87 Å²	87	67.2 Å²	67.2	53%	0.534	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	127	179.5	-57.9	0	0	0	0	111.4	K180 E181 E194	K180-T192 WeakPolarHBondContact CA-OG1 3.06Å; E181-T192 PolarHBondContact N-OG1 3.02Å; T192-E194 VanDerWaalsContact C-N 3.27Å; T192-E194 PolarHBondContact O-N 2.81Å
193	G	90.6	Very high	90.4	Very high	44 Å²	44	68.8 Å²	68.8	45%	0.454	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.1	0.2	-177.7	0	0	0	0	0	114.9	A178 V191	A178-G193 WeakPolarHBondContact O-CA 3.46Å; A178-G193 PolarHBondContact O-N 2.77Å; V191-G193 PolarHBondContact O-N 3.07Å
194	E	92.4	Very high	90.7	Very high	36 Å²	36	61.7 Å²	61.7	17%	0.168	36%	0.356	C	S	.	.			trans	-64.9	141.2	170.3	-170	-179	156.2	0	0	110.3	R177 A178 R190 V191 T192 W196	R177-E194 CarbonylContact C-O 3.6Å; R177-E194 WeakPolarHBondContact CA-O 3.39Å; A178-E194 PolarHBondContact N-O 3.24Å; R190-E194 WeakPolarHBondContact CA-OE2 3.36Å; R190-E194 WeakPolarHBondContact CD-OE1 3.4Å; R190-E194 IonicContact CZ-OE1 2.98Å; R190-E194 IonicContact NH1-OE1 3.4Å; R190-E194 PolarHBondContact NH1-OE1 3.33Å; V191-E194 HydrophobicContact CG2-CB 3.85Å; V191-E194 PolarHBondContact N-OE2 2.93Å; V191-E194 WeakPolarHBondContact O-CB 3.39Å; V191-E194 PolarHBondContact O-N 2.53Å; T192-E194 VanDerWaalsContact C-N 3.27Å; T192-E194 PolarHBondContact O-N 2.81Å; E194-W196 WeakPolarHBondContact O-CZ3 3.3Å
195	E	93.2	Very high	90.9	Very high	45 Å²	45	62 Å²	62	21%	0.21	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	141.5	177.3	-71	174.5	-171	0	0	109.8	R175 L176 R177 L213 V263	R175-E195 IonicContact CZ-OE2 2.83Å; R175-E195 IonicContact NE-OE2 3.99Å; R175-E195 PolarHBondContact NE-OE2 2.91Å; R175-E195 IonicContact NH2-OE2 3.25Å; R175-E195 PolarHBondContact NH2-OE2 3.03Å; L176-E195 WeakPolarHBondContact O-CA 3.44Å; R177-E195 HydrophobicContact CB-CG 3.94Å; R177-E195 HydrophobicContact CG-CG 3.97Å; E195-L213 HydrophobicContact CG-CD1 4.12Å; E195-V263 HydrophobicContact CB-CG1 3.57Å; E195-V263 HydrophobicContact CB-CG2 4.3Å
196	W	93.1	Very high	91.2	Very high	11 Å²	11	56 Å²	56	4%	0.042	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	167.3	176	67.9	98.2	0	0	0	111.4	R175 L176 A178 D184 R190 E194 E210	R175-W196 WeakPolarHBondContact CA-O 3.5Å; L176-W196 HydrophobicContact CB-CD2 4.22Å; L176-W196 HydrophobicContact CB-CH2 4.28Å; L176-W196 HydrophobicContact CB-CZ2 3.86Å; L176-W196 HydrophobicContact CD1-CZ2 4Å; L176-W196 PolarHBondContact N-O 2.79Å; L176-W196 PolarHBondContact O-N 2.86Å; L176-W196 VanDerWaalsContact O-N 3.08Å; A178-W196 HydrophobicContact CB-CH2 3.99Å; A178-W196 HydrophobicContact CB-CZ3 3.66Å; D184-W196 HydrophobicContact CB-CZ2 4.13Å; R190-W196 HydrophobicContact CB-CH2 4.22Å; R190-W196 HydrophobicContact CB-CZ3 3.97Å; R190-W196 HydrophobicContact CG-CD2 4.37Å; R190-W196 HydrophobicContact CG-CE3 4.05Å; R190-W196 HydrophobicContact CG-CH2 3.91Å; R190-W196 HydrophobicContact CG-CZ2 4.21Å; R190-W196 HydrophobicContact CG-CZ3 3.82Å; E194-W196 WeakPolarHBondContact O-CZ3 3.3Å; W196-E210 HydrophobicContact CH2-CG 4.11Å; W196-E210 HydrophobicContact CZ2-CG 3.87Å
197	L	93	Very high	91.5	Very high	30 Å²	30	51.4 Å²	51.4	16%	0.157	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	143.4	176.5	-64.4	-175.6	0	0	0	111.7	A173 L174 R175 V216 V260 P261 V263	A173-L197 HydrophobicContact CB-CB 4.11Å; A173-L197 HydrophobicContact CB-CD1 4.15Å; A173-L197 HydrophobicContact CB-CD2 4.35Å; A173-L197 HydrophobicContact CB-CG 4.44Å; L174-L197 CarbonylContact O-C 3.57Å; L174-L197 WeakPolarHBondContact O-CA 3.21Å; R175-L197 HydrophobicContact CB-CD2 3.68Å; R175-L197 HydrophobicContact CG-CD2 3.94Å; L197-V216 HydrophobicContact CD2-CG2 4.06Å; L197-V260 HydrophobicContact CD1-CG1 3.95Å; L197-P261 WeakPolarHBondContact CD1-O 3.39Å; L197-V263 HydrophobicContact CD2-CG2 4.22Å; L197-V263 HydrophobicContact CG-CG2 3.99Å
198	V	92.8	Very high	91.7	Very high	7 Å²	7	49.9 Å²	49.9	4%	0.042	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	120.3	166.3	179.3	0	0	0	0	108.7	I168 A173 L174 L176 Y204	I168-V198 HydrophobicContact CD1-CB 4.33Å; I168-V198 HydrophobicContact CD1-CG1 4.04Å; A173-V198 CarbonylContact C-O 3.55Å; A173-V198 VanDerWaalsContact CA-O 3.26Å; A173-V198 WeakPolarHBondContact CA-O 3.44Å; A173-V198 WeakPolarHBondContact CB-O 3.2Å; L174-V198 HydrophobicContact CB-CB 4.42Å; L174-V198 PolarHBondContact N-O 3.35Å; L174-V198 PolarHBondContact O-N 2.92Å; L176-V198 HydrophobicContact CD1-CG2 3.56Å; L176-V198 HydrophobicContact CG-CG2 4.3Å; V198-Y204 HydrophobicContact CB-CE2 4.38Å; V198-Y204 HydrophobicContact CG1-CD2 3.69Å; V198-Y204 HydrophobicContact CG1-CE2 3.71Å; V198-Y204 HydrophobicContact CG1-CG 4.35Å; V198-Y204 HydrophobicContact CG2-CE1 4.45Å; V198-Y204 HydrophobicContact CG2-CE2 4Å
199	T	88.9	Confident	91.8	Very high	95 Å²	95	46.9 Å²	46.9	58%	0.583	28%	0.284	S	S	*	.			trans	-103.4	-3.4	-176.7	54.2	0	0	0	0	113.4	A173 V201	A173-T199 HydrophobicContact CB-CG2 3.98Å; T199-V201 PolarHBondContact O-N 2.9Å; T199-V201 VanDerWaalsContact O-N 3.14Å
200	T	89.8	Confident	91.8	Very high	90 Å²	90	41.5 Å²	41.5	55%	0.552	26%	0.259	S	S	*	.			trans	-65.8	112.6	179.9	-52.7	0	0	0	0	110.5	G202	T200-G202 PolarHBondContact O-N 2.82Å
201	V	92.4	Very high	91.8	Very high	94 Å²	94	43 Å²	43	57%	0.57	27%	0.266	S	S	*	.			trans	-65.7	131.5	180	-179.3	0	0	0	0	110.1	T199	T199-V201 PolarHBondContact O-N 2.9Å; T199-V201 VanDerWaalsContact O-N 3.14Å
202	G	92.1	Very high	91.9	Very high	30 Å²	30	41.9 Å²	41.9	31%	0.309	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	136.5	-168.1	-179.4	0	0	0	0	0	113.1	I168 T200 Y204	I168-G202 PolarHBondContact N-O 3.28Å; I168-G202 PolarHBondContact O-N 3.28Å; T200-G202 PolarHBondContact O-N 2.82Å; G202-Y204 PolarHBondContact O-N 2.98Å
203	A	92.3	Very high	91.9	Very high	49 Å²	49	40.7 Å²	40.7	41%	0.405	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	111.8	173.9	0	0	0	0	0	109.2	N118 A165	N118-A203 HydrophobicContact CB-CB 4.47Å; A165-A203 HydrophobicContact CB-CB 3.91Å
204	Y	92.9	Very high	92.1	Very high	21 Å²	21	42.1 Å²	42.1	8%	0.082	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	116.7	175.5	-173.4	-94.5	0	0	0	110	A165 T166 I168 L174 L176 R185 V198 G202 P206 E210	A165-Y204 CarbonylContact C-O 3.42Å; A165-Y204 WeakPolarHBondContact CA-O 3.44Å; A165-Y204 WeakPolarHBondContact CB-O 3.47Å; T166-Y204 PolarHBondContact N-O 3.3Å; T166-Y204 PolarHBondContact O-N 2.87Å; I168-Y204 HydrophobicContact CD1-CG 4.37Å; L174-Y204 HydrophobicContact CD2-CD1 3.58Å; L174-Y204 HydrophobicContact CD2-CE1 4.32Å; L174-Y204 HydrophobicContact CD2-CG 4.16Å; L176-Y204 HydrophobicContact CD1-CD1 4.5Å; L176-Y204 HydrophobicContact CD1-CE1 3.53Å; L176-Y204 WeakPolarHBondContact CD1-OH 3.36Å; L176-Y204 HydrophobicContact CD2-CE1 4.36Å; R185-Y204 HydrophobicContact CG-CE2 4.33Å; V198-Y204 HydrophobicContact CB-CE2 4.38Å; V198-Y204 HydrophobicContact CG1-CD2 3.69Å; V198-Y204 HydrophobicContact CG1-CE2 3.71Å; V198-Y204 HydrophobicContact CG1-CG 4.35Å; V198-Y204 HydrophobicContact CG2-CE1 4.45Å; V198-Y204 HydrophobicContact CG2-CE2 4Å; G202-Y204 PolarHBondContact O-N 2.98Å; Y204-P206 HydrophobicContact CD1-CG 4.47Å; Y204-P206 WeakPolarHBondContact O-CD 3.26Å; Y204-E210 PolarHBondContact OH-OE1 2.74Å; Y204-E210 PolarHBondContact OH-OE2 2.68Å
205	L	92	Very high	92.1	Very high	15 Å²	15	43.7 Å²	43.7	8%	0.079	26%	0.256	C	S	.	.			trans	-93.5	111	174.9	-175.2	71.5	0	0	0	109.1	A120 E146 I163 A165 R185	A120-L205 HydrophobicContact CB-CD1 4.23Å; A120-L205 HydrophobicContact CB-CD2 3.85Å; A120-L205 HydrophobicContact CB-CG 4.46Å; E146-L205 HydrophobicContact CB-CD2 4.47Å; E146-L205 HydrophobicContact CG-CD2 3.93Å; I163-L205 HydrophobicContact CG2-CD1 4.03Å; A165-L205 HydrophobicContact CB-CB 4.11Å; A165-L205 HydrophobicContact CB-CD1 4.17Å; R185-L205 PolarHBondContact NE-O 3.29Å; R185-L205 PolarHBondContact NH2-O 2.97Å
206	P	91.8	Very high	92.1	Very high	5 Å²	5	42.8 Å²	42.8	3%	0.032	25%	0.254	C	S	.	.			trans	-62.4	142	-179.1	-18.3	31	0	0	0	111.4	L144 I163 Y204 E210 V212	L144-P206 WeakPolarHBondContact CD1-O 3.18Å; I163-P206 HydrophobicContact CG2-CG 4.39Å; Y204-P206 HydrophobicContact CD1-CG 4.47Å; Y204-P206 WeakPolarHBondContact O-CD 3.26Å; P206-E210 WeakPolarHBondContact CA-OE2 3.4Å; P206-E210 HydrophobicContact CB-CB 4.18Å; P206-V212 HydrophobicContact CB-CG2 3.93Å; P206-V212 HydrophobicContact CG-CG2 3.24Å
207	A	90.6	Very high	92.1	Very high	34 Å²	34	47.1 Å²	47.1	28%	0.281	28%	0.278	S	S	.	.			trans	-70.1	166.8	168.1	0	0	0	0	0	111.1	F209 E210	A207-F209 VanDerWaalsContact C-N 3.25Å; A207-F209 PolarHBondContact O-N 2.95Å; A207-F209 VanDerWaalsContact O-N 3.16Å; A207-E210 HydrophobicContact CB-CB 4.45Å; A207-E210 HydrophobicContact CB-CG 3.91Å; A207-E210 PolarHBondContact N-OE2 3.46Å; A207-E210 PolarHBondContact O-N 2.88Å
208	V	89.8	Confident	92.1	Very high	16 Å²	16	46.5 Å²	46.5	10%	0.097	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.3	-44.6	-177.2	-176.9	0	0	0	0	113.4	E142 W143 L144	E142-V208 HydrophobicContact CB-CG1 3.46Å; E142-V208 VanDerWaalsContact CB-CG1 3.46Å; W143-V208 VanDerWaalsContact CA-CG2 3.49Å; L144-V208 HydrophobicContact CD1-CG2 4.48Å; L144-V208 HydrophobicContact CD2-CG2 3.86Å; L144-V208 HydrophobicContact CG-CG2 3.62Å
209	F	90.7	Very high	92.1	Very high	54 Å²	54	48.2 Å²	48.2	24%	0.237	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	5.9	-174.2	-52.4	-51	0	0	0	112.6	E142 R179 K180 C182 A207	E142-F209 HydrophobicContact CB-CE1 4.25Å; E142-F209 HydrophobicContact CB-CZ 4.4Å; R179-F209 PolarHBondContact N-O 2.88Å; K180-F209 HydrophobicContact CB-CB 4.47Å; K180-F209 HydrophobicContact CB-CD1 4.31Å; K180-F209 HydrophobicContact CB-CG 4.26Å; K180-F209 HydrophobicContact CD-CD1 4.04Å; K180-F209 HydrophobicContact CD-CE1 3.94Å; K180-F209 HydrophobicContact CG-CD1 4.36Å; C182-F209 HydrophobicContact CB-CB 4.05Å; C182-F209 HydrophobicContact CB-CD2 4.08Å; A207-F209 VanDerWaalsContact C-N 3.25Å; A207-F209 PolarHBondContact O-N 2.95Å; A207-F209 VanDerWaalsContact O-N 3.16Å
210	E	92.3	Very high	92.3	Very high	10 Å²	10	49.6 Å²	49.6	5%	0.047	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	112.5	175.5	-66.6	176.3	165.5	0	0	109.5	L176 W196 Y204 P206 A207	L176-E210 HydrophobicContact CD1-CB 4.43Å; L176-E210 HydrophobicContact CD1-CG 4.45Å; W196-E210 HydrophobicContact CH2-CG 4.11Å; W196-E210 HydrophobicContact CZ2-CG 3.87Å; Y204-E210 PolarHBondContact OH-OE1 2.74Å; Y204-E210 PolarHBondContact OH-OE2 2.68Å; P206-E210 WeakPolarHBondContact CA-OE2 3.4Å; P206-E210 HydrophobicContact CB-CB 4.18Å; A207-E210 HydrophobicContact CB-CB 4.45Å; A207-E210 HydrophobicContact CB-CG 3.91Å; A207-E210 PolarHBondContact N-OE2 3.46Å; A207-E210 PolarHBondContact O-N 2.88Å
211	E	92.8	Very high	92.4	Very high	50 Å²	50	45.7 Å²	45.7	23%	0.234	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	121.7	172.2	-173.4	-176.9	-175.1	0	0	109.7	L176 R177 R179 L213	L176-E211 CarbonylContact C-O 3.55Å; L176-E211 WeakPolarHBondContact CA-O 3.22Å; R177-E211 HydrophobicContact CB-CB 4.34Å; R177-E211 IonicContact CZ-OE1 3.34Å; R177-E211 IonicContact CZ-OE2 3.57Å; R177-E211 PolarHBondContact N-O 3.4Å; R177-E211 IonicContact NE-OE2 3.95Å; R177-E211 PolarHBondContact NE-OE2 2.9Å; R177-E211 IonicContact NH2-OE1 2.72Å; R177-E211 PolarHBondContact NH2-OE1 3.19Å; R177-E211 IonicContact NH2-OE2 3.2Å; R177-E211 PolarHBondContact NH2-OE2 2.84Å; R177-E211 WeakPolarHBondContact O-CB 3.39Å; R177-E211 PolarHBondContact O-N 2.8Å; R179-E211 HydrophobicContact CG-CB 3.98Å; E211-L213 HydrophobicContact CG-CD2 4.47Å; E211-L213 PolarHBondContact O-N 2.65Å
212	V	93.9	Very high	92.4	Very high	57 Å²	57	44.2 Å²	44.2	35%	0.345	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	122.6	173.6	-179.8	0	0	0	0	109.8	L174 L176 P206	L174-V212 HydrophobicContact CD1-CG1 3.65Å; L174-V212 HydrophobicContact CD2-CG1 4.44Å; L174-V212 HydrophobicContact CD2-CG2 4.42Å; L174-V212 HydrophobicContact CG-CG1 4.31Å; L176-V212 HydrophobicContact CD2-CB 4.39Å; L176-V212 HydrophobicContact CD2-CG2 3.85Å; P206-V212 HydrophobicContact CB-CG2 3.93Å; P206-V212 HydrophobicContact CG-CG2 3.24Å
213	L	93.4	Very high	92.3	Very high	61 Å²	61	50.3 Å²	50.3	32%	0.319	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	-75.3	177.7	-64.7	-179.7	0	0	0	111.3	R175 R177 E195 E211	R175-L213 HydrophobicContact CB-CB 4.38Å; R175-L213 HydrophobicContact CG-CB 4.47Å; R175-L213 HydrophobicContact CG-CD1 4.16Å; R175-L213 PolarHBondContact O-N 2.91Å; R177-L213 HydrophobicContact CB-CD1 3.93Å; R177-L213 HydrophobicContact CB-CD2 4.43Å; R177-L213 HydrophobicContact CB-CG 4.15Å; E195-L213 HydrophobicContact CG-CD1 4.12Å; E211-L213 HydrophobicContact CG-CD2 4.47Å; E211-L213 PolarHBondContact O-N 2.65Å
214	D	93.4	Very high	92.4	Very high	74 Å²	74	55.1 Å²	55.1	40%	0.396	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	162	-173.2	58.7	-22	0	0	0	112.5	R175	R175-D214 VanDerWaalsContact CB-OD1 3.23Å; R175-D214 WeakPolarHBondContact CB-OD1 3.5Å; R175-D214 WeakPolarHBondContact CD-OD1 3.5Å; R175-D214 PolarHBondContact N-O 2.85Å
215	L	93.3	Very high	92.4	Very high	70 Å²	70	55.8 Å²	55.8	37%	0.366	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	126	169.3	-75.9	167.8	0	0	0	108.4	T166 I168 A173 L174	T166-L215 HydrophobicContact CG2-CD1 4.34Å; T166-L215 HydrophobicContact CG2-CD2 4.31Å; T166-L215 HydrophobicContact CG2-CG 4.42Å; I168-L215 HydrophobicContact CG1-CD2 4.39Å; A173-L215 CarbonylContact O-C 3.47Å; A173-L215 WeakPolarHBondContact O-CA 3.41Å; L174-L215 HydrophobicContact CB-CD2 4.26Å; L174-L215 HydrophobicContact CD1-CD2 3.71Å; L174-L215 HydrophobicContact CD1-CG 4.14Å
216	V	93.6	Very high	92.5	Very high	26 Å²	26	55.1 Å²	55.1	16%	0.158	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	118.4	178.9	-174.2	0	0	0	0	108.7	Q172 A173 R175 L197 V260	Q172-V216 CarbonylContact C-O 3.52Å; Q172-V216 WeakPolarHBondContact CA-O 3.3Å; A173-V216 PolarHBondContact N-O 2.58Å; A173-V216 PolarHBondContact O-N 3.25Å; R175-V216 HydrophobicContact CB-CG2 4.38Å; L197-V216 HydrophobicContact CD2-CG2 4.06Å; V216-V260 HydrophobicContact CB-CG1 4.1Å; V216-V260 HydrophobicContact CG1-CG1 3.8Å
217	D	93.4	Very high	92.7	Very high	101 Å²	101	54.9 Å²	54.9	54%	0.54	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	143.1	175.1	-68	-38.8	0	0	0	111.1	Q172	Q172-D217 WeakPolarHBondContact CG-OD1 3.44Å; Q172-D217 PolarHBondContact NE2-OD1 2.94Å
218	A	92.8	Very high	92.9	Very high	17 Å²	17	54.8 Å²	54.8	14%	0.14	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-70.9	139.9	172	0	0	0	0	0	111	N171 A258 H259 V260	N171-A218 HydrophobicContact CB-CB 3.83Å; N171-A218 WeakPolarHBondContact O-CB 3.48Å; N171-A218 PolarHBondContact O-N 3.42Å; A218-A258 HydrophobicContact CB-CB 3.92Å; A218-H259 CarbonylContact C-O 3.49Å; A218-H259 WeakPolarHBondContact CA-O 3.35Å; A218-V260 HydrophobicContact CB-CG2 3.52Å
219	V	92.6	Very high	93.1	Very high	43 Å²	43	54 Å²	54	26%	0.261	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	119.8	167.2	-174	0	0	0	0	108.4	L221 L227 A258 H259 P261	V219-L221 HydrophobicContact CG1-CD2 4.09Å; V219-L227 HydrophobicContact CB-CD1 4.35Å; V219-L227 HydrophobicContact CB-CD2 4.28Å; V219-L227 HydrophobicContact CG1-CD1 4.12Å; V219-L227 HydrophobicContact CG2-CD1 4.2Å; V219-L227 HydrophobicContact CG2-CD2 4.37Å; V219-A258 WeakPolarHBondContact O-CA 3.25Å; V219-H259 PolarHBondContact N-O 3.45Å; V219-H259 PolarHBondContact O-N 2.96Å; V219-P261 HydrophobicContact CG2-CG 4.4Å
220	I	91.9	Very high	93.3	Very high	124 Å²	124	55.6 Å²	55.6	64%	0.636	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.6	122.7	177.9	-57.4	167.2	0	0	0	108.5
221	L	92.1	Very high	93.4	Very high	8 Å²	8	55.2 Å²	55.2	4%	0.042	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-101.9	142.5	-179.6	-53.2	-179.1	0	0	0	110.3	V219 L227 V251 E257 H259	V219-L221 HydrophobicContact CG1-CD2 4.09Å; L221-L227 HydrophobicContact CD1-CB 4.48Å; L221-L227 HydrophobicContact CD2-CB 3.8Å; L221-V251 HydrophobicContact CD1-CB 4.23Å; L221-V251 HydrophobicContact CD1-CG1 3.76Å; L221-E257 PolarHBondContact N-O 3.23Å; L221-H259 HydrophobicContact CD1-CB 4.37Å
222	T	92.8	Very high	93.4	Very high	64 Å²	64	59.1 Å²	59.1	39%	0.393	30%	0.295	S	S	.	.	B	Isolated β-bridge	trans	-121.6	169.5	175.8	67.2	0	0	0	0	109.5	K224 T225	T222-K224 PolarHBondContact O-N 2.84Å; T222-K224 PolarHBondContact OG1-N 3.36Å; T222-T225 PolarHBondContact N-OG1 3.48Å; T222-T225 PolarHBondContact O-N 2.78Å; T222-T225 VanDerWaalsContact O-N 3.08Å; T222-T225 PolarHBondContact OG1-N 3.22Å; T222-T225 PolarHBondContact OG1-OG1 3.31Å
223	E	90.8	Very high	93.2	Very high	157 Å²	157	64 Å²	64	73%	0.734	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-18.4	171.6	-63.7	179.8	172.5	0	0	113.1	V253 I273 F309	E223-V253 HydrophobicContact CG-CG1 4.09Å; E223-I273 WeakPolarHBondContact O-CD1 3.43Å; E223-F309 WeakPolarHBondContact O-CZ 3.3Å
224	K	92.9	Very high	93.2	Very high	150 Å²	150	66.7 Å²	66.7	65%	0.652	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	-4.1	-178.8	-59.9	-174.4	-178.9	-176.8	0	114.2	T222 P272 I273	T222-K224 PolarHBondContact O-N 2.84Å; T222-K224 PolarHBondContact OG1-N 3.36Å; K224-P272 WeakPolarHBondContact O-CA 3.47Å; K224-I273 HydrophobicContact CB-CG2 3.9Å; K224-I273 HydrophobicContact CG-CG2 4.12Å; K224-I273 PolarHBondContact O-N 3.12Å
225	T	93.8	Very high	93.1	Very high	36 Å²	36	64.2 Å²	64.2	22%	0.221	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	127.3	-172	59	0	0	0	0	110.7	T222 V270	T222-T225 PolarHBondContact N-OG1 3.48Å; T222-T225 PolarHBondContact O-N 2.78Å; T222-T225 VanDerWaalsContact O-N 3.08Å; T222-T225 PolarHBondContact OG1-N 3.22Å; T222-T225 PolarHBondContact OG1-OG1 3.31Å; T225-V270 HydrophobicContact CG2-CG1 4.06Å
226	A	94.3	Very high	92.9	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	149.6	169.1	0	0	0	0	0	110.4	L250 V251 T252 V270 V271 F309	A226-L250 HydrophobicContact CB-CB 4.3Å; A226-L250 HydrophobicContact CB-CD1 4.31Å; A226-V251 CarbonylContact C-O 3.51Å; A226-V251 WeakPolarHBondContact CA-O 3.26Å; A226-T252 HydrophobicContact CB-CG2 4.05Å; A226-V270 CarbonylContact O-C 3.48Å; A226-V270 WeakPolarHBondContact O-CA 3.37Å; A226-V271 PolarHBondContact N-O 2.89Å; A226-V271 PolarHBondContact O-N 2.93Å; A226-F309 HydrophobicContact CB-CB 4.46Å; A226-F309 HydrophobicContact CB-CD1 3.61Å; A226-F309 HydrophobicContact CB-CD2 4.16Å; A226-F309 HydrophobicContact CB-CE1 3.76Å; A226-F309 HydrophobicContact CB-CE2 4.3Å; A226-F309 HydrophobicContact CB-CG 3.82Å; A226-F309 HydrophobicContact CB-CZ 4.11Å
227	L	95	Very high	92.7	Very high	0 Å²	0	68.9 Å²	68.9	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	125.4	175.2	-174.1	63.8	0	0	0	110	V219 L221 L229 L250 V251 H259 V267 V270	V219-L227 HydrophobicContact CB-CD1 4.35Å; V219-L227 HydrophobicContact CB-CD2 4.28Å; V219-L227 HydrophobicContact CG1-CD1 4.12Å; V219-L227 HydrophobicContact CG2-CD1 4.2Å; V219-L227 HydrophobicContact CG2-CD2 4.37Å; L221-L227 HydrophobicContact CD1-CB 4.48Å; L221-L227 HydrophobicContact CD2-CB 3.8Å; L227-L229 HydrophobicContact CD2-CD1 4.25Å; L227-L229 HydrophobicContact CD2-CD2 3.74Å; L227-L229 HydrophobicContact CD2-CG 4.1Å; L227-L229 HydrophobicContact CG-CD2 3.8Å; L227-L229 HydrophobicContact CG-CG 4.03Å; L227-L250 CarbonylContact O-C 3.58Å; L227-L250 VanDerWaalsContact O-CA 3.27Å; L227-L250 WeakPolarHBondContact O-CA 3.4Å; L227-V251 HydrophobicContact CB-CB 4.3Å; L227-V251 PolarHBondContact N-O 2.89Å; L227-V251 PolarHBondContact O-N 2.96Å; L227-H259 HydrophobicContact CD2-CB 4.11Å; L227-H259 VanDerWaalsContact CD2-CD2 3.49Å; L227-H259 WeakPolarHBondContact CD2-CD2 3.39Å; L227-V267 HydrophobicContact CD1-CG1 3.69Å; L227-V270 HydrophobicContact CD1-CG2 4.33Å
228	H	95.6	Very high	92.2	Very high	32 Å²	32	69.1 Å²	69.1	15%	0.148	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	115.7	176.8	-175.7	-168.3	0	0	0	110.1	E248 L250 L268 G269 V271	H228-E248 IonicContact CE1-OE2 2.76Å; H228-E248 PolarHBondContact CE1-OE2 2.82Å; H228-E248 VanDerWaalsContact CE1-OE2 3.31Å; H228-E248 IonicContact NE2-OE2 3Å; H228-E248 PolarHBondContact NE2-OE2 2.71Å; H228-L250 HydrophobicContact CB-CD2 3.74Å; H228-L268 HydrophobicContact CB-CB 4.46Å; H228-L268 PolarHBondContact O-N 3.34Å; H228-G269 PolarHBondContact N-O 2.99Å; H228-V271 HydrophobicContact CB-CG2 3.92Å
229	L	94.2	Very high	91.8	Very high	0 Å²	0	72 Å²	72	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	150.8	-176.8	-62.8	179.9	0	0	0	111.2	L227 E248 W249 V251 E265 E266 V267	L227-L229 HydrophobicContact CD2-CD1 4.25Å; L227-L229 HydrophobicContact CD2-CD2 3.74Å; L227-L229 HydrophobicContact CD2-CG 4.1Å; L227-L229 HydrophobicContact CG-CD2 3.8Å; L227-L229 HydrophobicContact CG-CG 4.03Å; L229-E248 VanDerWaalsContact O-CA 3.24Å; L229-E248 WeakPolarHBondContact O-CA 3.48Å; L229-W249 HydrophobicContact CB-CD2 4.29Å; L229-W249 HydrophobicContact CB-CH2 4.29Å; L229-W249 HydrophobicContact CB-CZ2 3.82Å; L229-W249 HydrophobicContact CD1-CZ2 4.01Å; L229-W249 PolarHBondContact N-O 3.48Å; L229-W249 PolarHBondContact O-N 2.8Å; L229-V251 HydrophobicContact CD1-CG2 3.63Å; L229-V251 HydrophobicContact CG-CG2 4.43Å; L229-E265 HydrophobicContact CD1-CG 4.46Å; L229-E265 HydrophobicContact CD2-CB 4.49Å; L229-E266 CarbonylContact C-O 3.57Å; L229-E266 WeakPolarHBondContact CA-O 3.37Å; L229-V267 HydrophobicContact CD2-CB 4.35Å; L229-V267 HydrophobicContact CD2-CG2 3.75Å
230	R	94.8	Very high	91.4	Very high	87 Å²	87	72.3 Å²	72.3	33%	0.328	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	135.9	170.3	-177.2	171.4	68.6	-174	2.7	110.7	E247 E248 E266 L268	R230-E247 WeakPolarHBondContact CA-O 3.08Å; R230-E248 HydrophobicContact CB-CG 4.05Å; R230-E248 HydrophobicContact CG-CG 3.98Å; R230-E266 HydrophobicContact CB-CB 4.39Å; R230-E266 IonicContact CZ-OE2 2.86Å; R230-E266 VanDerWaalsContact CZ-OE2 3.25Å; R230-E266 PolarHBondContact N-O 3.39Å; R230-E266 IonicContact NE-OE2 2.69Å; R230-E266 PolarHBondContact NE-OE2 2.81Å; R230-E266 VanDerWaalsContact NH2-CD 3.34Å; R230-E266 IonicContact NH2-OE1 3.73Å; R230-E266 IonicContact NH2-OE2 3.64Å; R230-E266 PolarHBondContact NH2-OE2 3.49Å; R230-E266 PolarHBondContact O-N 3Å; R230-L268 HydrophobicContact CB-CD1 3.94Å; R230-L268 HydrophobicContact CB-CG 4.13Å
231	A	94.1	Very high	91.2	Very high	2 Å²	2	69.5 Å²	69.5	2%	0.017	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	123.9	175.8	0	0	0	0	0	111.5	F235 R243 R244 G246 E247 W249	A231-F235 HydrophobicContact CB-CD1 4.44Å; A231-F235 HydrophobicContact CB-CE1 3.93Å; A231-R243 HydrophobicContact CB-CB 4.08Å; A231-R244 WeakPolarHBondContact CB-O 3.5Å; A231-G246 PolarHBondContact O-N 2.83Å; A231-E247 PolarHBondContact N-O 2.79Å; A231-W249 HydrophobicContact CB-CH2 3.91Å; A231-W249 HydrophobicContact CB-CZ3 3.61Å
232	R	92.1	Very high	91.2	Very high	132 Å²	132	72.7 Å²	72.7	50%	0.498	35%	0.345	S	S	.	.	S	Bend	trans	-81	-26.9	173.2	-71.1	-173.5	162.4	-175.8	0.5	113.3	T245 H264 E266	R232-T245 WeakPolarHBondContact O-CG2 3.36Å; R232-H264 PolarHBondContact N-O 2.99Å; R232-E266 HydrophobicContact CG-CB 4.05Å; R232-E266 IonicContact CZ-OE1 3.04Å; R232-E266 IonicContact NE-OE1 2.87Å; R232-E266 IonicContact NE-OE2 3.51Å; R232-E266 IonicContact NH2-OE1 2.94Å; R232-E266 PolarHBondContact NH2-OE1 2.92Å
233	R	89.7	Confident	91.2	Very high	160 Å²	160	71.7 Å²	71.7	60%	0.604	33%	0.334	S	S	*	.	S	Bend	trans	-142.5	170.5	179.2	-67.3	-172.6	-179.9	176.8	1.8	109.7	F235 T245	R233-F235 WeakPolarHBondContact O-CD1 3.16Å; R233-F235 PolarHBondContact O-N 2.65Å; R233-T245 WeakPolarHBondContact CA-OG1 3.26Å
234	N	92.9	Very high	91.2	Very high	117 Å²	117	72.4 Å²	72.4	63%	0.626	33%	0.33	S	S	*	.	S	Bend	trans	-75.5	118.9	171.2	-59.5	-11	0	0	0	108.9	R243 R244 T245	N234-R243 VanDerWaalsContact CA-O 3.28Å; N234-R243 WeakPolarHBondContact CA-O 3.24Å; N234-R244 VanDerWaalsContact OD1-CA 3.32Å; N234-R244 WeakPolarHBondContact OD1-CA 3.25Å; N234-T245 PolarHBondContact N-OG1 3.08Å; N234-T245 PolarHBondContact OD1-N 2.78Å; N234-T245 PolarHBondContact OD1-OG1 3.07Å
235	F	92	Very high	91.2	Very high	23 Å²	23	69.3 Å²	69.3	10%	0.101	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	176.7	179.2	78.8	-67.6	0	0	0	110.5	A231 R233 D237 R243 W249 H264 E265	A231-F235 HydrophobicContact CB-CD1 4.44Å; A231-F235 HydrophobicContact CB-CE1 3.93Å; R233-F235 WeakPolarHBondContact O-CD1 3.16Å; R233-F235 PolarHBondContact O-N 2.65Å; F235-D237 HydrophobicContact CE2-CB 4.3Å; F235-R243 HydrophobicContact CD1-CB 4.2Å; F235-R243 HydrophobicContact CE1-CB 3.9Å; F235-R243 HydrophobicContact CE1-CG 4.28Å; F235-R243 HydrophobicContact CZ-CG 4.46Å; F235-R243 PolarHBondContact N-O 3.09Å; F235-R243 VanDerWaalsContact N-O 3.1Å; F235-R243 PolarHBondContact O-N 2.96Å; F235-W249 AromaticContact CE1-CH2 3.92Å; F235-W249 HydrophobicContact CE1-CH2 3.92Å; F235-W249 AromaticContact CZ-CH2 3.9Å; F235-W249 HydrophobicContact CZ-CH2 3.9Å; F235-W249 HydrophobicContact CZ-CZ2 4.13Å; F235-H264 HydrophobicContact CB-CB 4.2Å; F235-H264 HydrophobicContact CD1-CB 3.62Å; F235-H264 HydrophobicContact CD2-CB 4.01Å; F235-H264 HydrophobicContact CE1-CB 3.97Å; F235-H264 HydrophobicContact CE2-CB 4.33Å; F235-H264 HydrophobicContact CG-CB 3.67Å; F235-H264 AromaticContact CG-CD2 3.95Å; F235-H264 HydrophobicContact CZ-CB 4.34Å; F235-E265 HydrophobicContact CE1-CG 4.2Å; F235-E265 HydrophobicContact CE2-CG 3.97Å; F235-E265 HydrophobicContact CZ-CG 3.37Å
236	R	90.3	Very high	91.1	Very high	186 Å²	186	69.8 Å²	69.8	70%	0.702	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.3	127.4	171.1	-68.5	-176.3	178.1	178.4	1.2	108.1	V241	R236-V241 WeakPolarHBondContact CA-O 3.23Å
237	D	87.5	Confident	90.9	Very high	8 Å²	8	73.2 Å²	73.2	4%	0.043	35%	0.352	C	S	.	.			trans	-68	173.4	177.5	73.3	7.1	0	0	0	111.3	F235 R239 G240 V241 R243	F235-D237 HydrophobicContact CE2-CB 4.3Å; D237-R239 PolarHBondContact O-N 3.29Å; D237-R239 VanDerWaalsContact O-N 3.07Å; D237-R239 WeakPolarHBondContact OD1-CA 3.25Å; D237-R239 WeakPolarHBondContact OD1-CB 3.41Å; D237-R239 PolarHBondContact OD1-N 3.01Å; D237-R239 IonicContact OD2-CZ 3.42Å; D237-R239 IonicContact OD2-NE 2.66Å; D237-R239 PolarHBondContact OD2-NE 2.78Å; D237-R239 IonicContact OD2-NH2 3.35Å; D237-R239 PolarHBondContact OD2-NH2 3.27Å; D237-G240 PolarHBondContact O-N 2.93Å; D237-G240 PolarHBondContact OD1-N 2.9Å; D237-G240 VanDerWaalsContact OD1-N 3.07Å; D237-V241 PolarHBondContact N-O 3.31Å; D237-V241 WeakPolarHBondContact OD1-CB 3.4Å; D237-V241 PolarHBondContact OD1-N 2.71Å; D237-R243 HydrophobicContact CB-CG 4.45Å; D237-R243 IonicContact OD2-CZ 2.62Å; D237-R243 IonicContact OD2-NE 3.02Å; D237-R243 PolarHBondContact OD2-NE 2.86Å; D237-R243 IonicContact OD2-NH2 3.37Å; D237-R243 PolarHBondContact OD2-NH2 2.96Å
238	F	83.3	Confident	90.8	Very high	105 Å²	105	76.9 Å²	76.9	46%	0.461	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-18.4	179.3	73.1	-85	0	0	0	113.9	V251 D255 T256 H259	F238-V251 HydrophobicContact CE1-CG1 4.38Å; F238-V251 HydrophobicContact CZ-CG1 4.29Å; F238-D255 HydrophobicContact CZ-CB 4.15Å; F238-T256 HydrophobicContact CE2-CG2 4.28Å; F238-T256 HydrophobicContact CZ-CG2 3.83Å; F238-H259 AromaticContact CD1-CE1 3.55Å; F238-H259 AromaticContact CD1-ND1 3.76Å; F238-H259 AromaticContact CE1-CE1 3.5Å; F238-H259 VanDerWaalsContact CE1-CE1 3.5Å; F238-H259 WeakPolarHBondContact CE1-CE1 3.36Å; F238-H259 AromaticContact CE1-ND1 3.36Å; F238-H259 WeakPolarHBondContact CE1-ND1 3.46Å
239	R	84	Confident	90.7	Very high	79 Å²	79	75.8 Å²	75.8	30%	0.298	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-4.9	174.9	-60.9	172.6	-67.4	-140.4	-12	112.6	D237 V241 D255	D237-R239 PolarHBondContact O-N 3.29Å; D237-R239 VanDerWaalsContact O-N 3.07Å; D237-R239 WeakPolarHBondContact OD1-CA 3.25Å; D237-R239 WeakPolarHBondContact OD1-CB 3.41Å; D237-R239 PolarHBondContact OD1-N 3.01Å; D237-R239 IonicContact OD2-CZ 3.42Å; D237-R239 IonicContact OD2-NE 2.66Å; D237-R239 PolarHBondContact OD2-NE 2.78Å; D237-R239 IonicContact OD2-NH2 3.35Å; D237-R239 PolarHBondContact OD2-NH2 3.27Å; R239-V241 HydrophobicContact CB-CG2 4.31Å; R239-D255 WeakPolarHBondContact CD-OD1 3.4Å; R239-D255 IonicContact CZ-OD1 2.63Å; R239-D255 IonicContact NE-OD1 3.69Å; R239-D255 IonicContact NH1-OD1 2.8Å; R239-D255 PolarHBondContact NH1-OD1 3.46Å; R239-D255 IonicContact NH1-OD2 3.51Å; R239-D255 PolarHBondContact NH1-OD2 2.98Å
240	G	85.6	Confident	90.7	Very high	49 Å²	49	76.5 Å²	76.5	51%	0.505	37%	0.367	S	S	.	.	S	Bend	trans	83.3	9.4	-176	0	0	0	0	0	114.6	D237	D237-G240 PolarHBondContact O-N 2.93Å; D237-G240 PolarHBondContact OD1-N 2.9Å; D237-G240 VanDerWaalsContact OD1-N 3.07Å
241	V	88.4	Confident	90.7	Very high	64 Å²	64	72.4 Å²	72.4	39%	0.388	35%	0.352	S	S	.	.			trans	-78	128.3	175.7	-176.3	0	0	0	0	109.1	R236 D237 R239 R243	R236-V241 WeakPolarHBondContact CA-O 3.23Å; D237-V241 PolarHBondContact N-O 3.31Å; D237-V241 WeakPolarHBondContact OD1-CB 3.4Å; D237-V241 PolarHBondContact OD1-N 2.71Å; R239-V241 HydrophobicContact CB-CG2 4.31Å; V241-R243 PolarHBondContact O-N 3.22Å
242	S	91.6	Very high	90.6	Very high	76 Å²	76	73.4 Å²	73.4	53%	0.531	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	120.3	177.7	-61.1	0	0	0	0	110.2
243	R	91.7	Very high	90.7	Very high	43 Å²	43	69.4 Å²	69.4	16%	0.162	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	136.9	177.4	-56.7	-61.9	179.2	173.2	-1.2	109.7	A231 N234 F235 D237 V241 E247 W249	A231-R243 HydrophobicContact CB-CB 4.08Å; N234-R243 VanDerWaalsContact CA-O 3.28Å; N234-R243 WeakPolarHBondContact CA-O 3.24Å; F235-R243 HydrophobicContact CD1-CB 4.2Å; F235-R243 HydrophobicContact CE1-CB 3.9Å; F235-R243 HydrophobicContact CE1-CG 4.28Å; F235-R243 HydrophobicContact CZ-CG 4.46Å; F235-R243 PolarHBondContact N-O 3.09Å; F235-R243 VanDerWaalsContact N-O 3.1Å; F235-R243 PolarHBondContact O-N 2.96Å; D237-R243 HydrophobicContact CB-CG 4.45Å; D237-R243 IonicContact OD2-CZ 2.62Å; D237-R243 IonicContact OD2-NE 3.02Å; D237-R243 PolarHBondContact OD2-NE 2.86Å; D237-R243 IonicContact OD2-NH2 3.37Å; D237-R243 PolarHBondContact OD2-NH2 2.96Å; V241-R243 PolarHBondContact O-N 3.22Å; R243-E247 WeakPolarHBondContact CA-OE2 3.38Å; R243-W249 HydrophobicContact CB-CH2 4.21Å; R243-W249 HydrophobicContact CB-CZ3 4.05Å; R243-W249 HydrophobicContact CG-CD2 4.49Å; R243-W249 HydrophobicContact CG-CE3 4.18Å; R243-W249 HydrophobicContact CG-CH2 3.85Å; R243-W249 HydrophobicContact CG-CZ2 4.15Å; R243-W249 HydrophobicContact CG-CZ3 3.85Å
244	R	92.3	Very high	90.7	Very high	172 Å²	172	70.5 Å²	70.5	65%	0.649	36%	0.36	S	S	*	.			trans	-98.6	156.2	173.7	-52.8	179.2	179.5	-177	0.2	110.7	A231 N234 G246 E247	A231-R244 WeakPolarHBondContact CB-O 3.5Å; N234-R244 VanDerWaalsContact OD1-CA 3.32Å; N234-R244 WeakPolarHBondContact OD1-CA 3.25Å; R244-G246 PolarHBondContact O-N 2.77Å; R244-E247 VanDerWaalsContact CB-CD 3.49Å; R244-E247 HydrophobicContact CB-CG 3.97Å; R244-E247 WeakPolarHBondContact CB-OE1 3.35Å; R244-E247 WeakPolarHBondContact CD-OE1 3.48Å; R244-E247 VanDerWaalsContact CG-OE1 3.31Å; R244-E247 WeakPolarHBondContact CG-OE1 3.34Å; R244-E247 VanDerWaalsContact N-CD 3.33Å; R244-E247 PolarHBondContact N-OE2 3.07Å; R244-E247 VanDerWaalsContact O-CB 3.27Å; R244-E247 WeakPolarHBondContact O-CB 3.25Å; R244-E247 WeakPolarHBondContact O-CG 3.38Å; R244-E247 PolarHBondContact O-N 2.82Å
245	T	93	Very high	90.6	Very high	85 Å²	85	68 Å²	68	52%	0.521	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	127.4	179.2	-53.1	0	0	0	0	110.9	R232 R233 N234 E247	R232-T245 WeakPolarHBondContact O-CG2 3.36Å; R233-T245 WeakPolarHBondContact CA-OG1 3.26Å; N234-T245 PolarHBondContact N-OG1 3.08Å; N234-T245 PolarHBondContact OD1-N 2.78Å; N234-T245 PolarHBondContact OD1-OG1 3.07Å; T245-E247 VanDerWaalsContact C-N 3.29Å; T245-E247 PolarHBondContact O-N 3.31Å
246	G	90.3	Very high	90.5	Very high	46 Å²	46	68.7 Å²	68.7	47%	0.474	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.1	-7	-178.2	0	0	0	0	0	115	A231 R244	A231-G246 PolarHBondContact O-N 2.83Å; R244-G246 PolarHBondContact O-N 2.77Å
247	E	91.3	Very high	90.5	Very high	72 Å²	72	67 Å²	67	34%	0.336	35%	0.353	S	S	.	.			trans	-67.1	139.8	171.8	-69.2	178.4	175.4	0	0	110.1	R230 A231 R243 R244 T245 W249	R230-E247 WeakPolarHBondContact CA-O 3.08Å; A231-E247 PolarHBondContact N-O 2.79Å; R243-E247 WeakPolarHBondContact CA-OE2 3.38Å; R244-E247 VanDerWaalsContact CB-CD 3.49Å; R244-E247 HydrophobicContact CB-CG 3.97Å; R244-E247 WeakPolarHBondContact CB-OE1 3.35Å; R244-E247 WeakPolarHBondContact CD-OE1 3.48Å; R244-E247 VanDerWaalsContact CG-OE1 3.31Å; R244-E247 WeakPolarHBondContact CG-OE1 3.34Å; R244-E247 VanDerWaalsContact N-CD 3.33Å; R244-E247 PolarHBondContact N-OE2 3.07Å; R244-E247 VanDerWaalsContact O-CB 3.27Å; R244-E247 WeakPolarHBondContact O-CB 3.25Å; R244-E247 WeakPolarHBondContact O-CG 3.38Å; R244-E247 PolarHBondContact O-N 2.82Å; T245-E247 VanDerWaalsContact C-N 3.29Å; T245-E247 PolarHBondContact O-N 3.31Å; E247-W249 WeakPolarHBondContact O-CZ3 3.41Å
248	E	93.1	Very high	90.7	Very high	76 Å²	76	67.7 Å²	67.7	36%	0.355	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	143.3	178.7	-61.9	-175.1	-174.8	0	0	109.8	H228 L229 R230 L268 P312	H228-E248 IonicContact CE1-OE2 2.76Å; H228-E248 PolarHBondContact CE1-OE2 2.82Å; H228-E248 VanDerWaalsContact CE1-OE2 3.31Å; H228-E248 IonicContact NE2-OE2 3Å; H228-E248 PolarHBondContact NE2-OE2 2.71Å; L229-E248 VanDerWaalsContact O-CA 3.24Å; L229-E248 WeakPolarHBondContact O-CA 3.48Å; R230-E248 HydrophobicContact CB-CG 4.05Å; R230-E248 HydrophobicContact CG-CG 3.98Å; E248-L268 HydrophobicContact CG-CD1 4.22Å; E248-P312 HydrophobicContact CB-CB 3.64Å; E248-P312 HydrophobicContact CB-CG 3.94Å
249	W	92.8	Very high	91.1	Very high	10 Å²	10	63 Å²	63	4%	0.038	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	168.2	176.2	67.4	94.5	0	0	0	111.3	L229 A231 F235 R243 E247 E265	L229-W249 HydrophobicContact CB-CD2 4.29Å; L229-W249 HydrophobicContact CB-CH2 4.29Å; L229-W249 HydrophobicContact CB-CZ2 3.82Å; L229-W249 HydrophobicContact CD1-CZ2 4.01Å; L229-W249 PolarHBondContact N-O 3.48Å; L229-W249 PolarHBondContact O-N 2.8Å; A231-W249 HydrophobicContact CB-CH2 3.91Å; A231-W249 HydrophobicContact CB-CZ3 3.61Å; F235-W249 AromaticContact CE1-CH2 3.92Å; F235-W249 HydrophobicContact CE1-CH2 3.92Å; F235-W249 AromaticContact CZ-CH2 3.9Å; F235-W249 HydrophobicContact CZ-CH2 3.9Å; F235-W249 HydrophobicContact CZ-CZ2 4.13Å; R243-W249 HydrophobicContact CB-CH2 4.21Å; R243-W249 HydrophobicContact CB-CZ3 4.05Å; R243-W249 HydrophobicContact CG-CD2 4.49Å; R243-W249 HydrophobicContact CG-CE3 4.18Å; R243-W249 HydrophobicContact CG-CH2 3.85Å; R243-W249 HydrophobicContact CG-CZ2 4.15Å; R243-W249 HydrophobicContact CG-CZ3 3.85Å; E247-W249 WeakPolarHBondContact O-CZ3 3.41Å; W249-E265 HydrophobicContact CH2-CG 4.27Å; W249-E265 HydrophobicContact CZ2-CG 4.09Å
250	L	93.7	Very high	91.6	Very high	15 Å²	15	60.8 Å²	60.8	8%	0.079	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	142.8	172.3	-59.9	-178.7	0	0	0	110.9	A226 L227 H228 V271 F309 L310 P312	A226-L250 HydrophobicContact CB-CB 4.3Å; A226-L250 HydrophobicContact CB-CD1 4.31Å; L227-L250 CarbonylContact O-C 3.58Å; L227-L250 VanDerWaalsContact O-CA 3.27Å; L227-L250 WeakPolarHBondContact O-CA 3.4Å; H228-L250 HydrophobicContact CB-CD2 3.74Å; L250-V271 HydrophobicContact CD2-CG2 4.02Å; L250-F309 HydrophobicContact CD1-CB 3.72Å; L250-L310 WeakPolarHBondContact CD1-O 3.39Å; L250-P312 HydrophobicContact CD2-CG 4.47Å; L250-P312 HydrophobicContact CG-CG 4.42Å
251	V	94.3	Very high	91.9	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	129	164.2	-175.6	0	0	0	0	107.5	L221 A226 L227 L229 F238 D255 T256 H259	L221-V251 HydrophobicContact CD1-CB 4.23Å; L221-V251 HydrophobicContact CD1-CG1 3.76Å; A226-V251 CarbonylContact C-O 3.51Å; A226-V251 WeakPolarHBondContact CA-O 3.26Å; L227-V251 HydrophobicContact CB-CB 4.3Å; L227-V251 PolarHBondContact N-O 2.89Å; L227-V251 PolarHBondContact O-N 2.96Å; L229-V251 HydrophobicContact CD1-CG2 3.63Å; L229-V251 HydrophobicContact CG-CG2 4.43Å; F238-V251 HydrophobicContact CE1-CG1 4.38Å; F238-V251 HydrophobicContact CZ-CG1 4.29Å; V251-D255 HydrophobicContact CG1-CB 4.02Å; V251-T256 HydrophobicContact CG1-CG2 3.93Å; V251-H259 HydrophobicContact CG1-CB 4.38Å
252	T	93.8	Very high	92	Very high	23 Å²	23	58.8 Å²	58.8	14%	0.141	31%	0.311	C	S	.	.			trans	-117.4	169.7	-177.6	66.9	0	0	0	0	110.5	A226 Q254 D255 T256 F309	A226-T252 HydrophobicContact CB-CG2 4.05Å; T252-Q254 PolarHBondContact O-N 3.41Å; T252-Q254 VanDerWaalsContact O-N 3.14Å; T252-Q254 PolarHBondContact OG1-N 3.35Å; T252-D255 PolarHBondContact N-OD2 2.99Å; T252-D255 WeakPolarHBondContact O-CB 3.43Å; T252-D255 PolarHBondContact O-N 3.15Å; T252-D255 PolarHBondContact OG1-OD2 3.44Å; T252-D255 VanDerWaalsContact OG1-OD2 3.1Å; T252-T256 PolarHBondContact O-N 3.28Å; T252-F309 HydrophobicContact CG2-CD2 3.96Å; T252-F309 HydrophobicContact CG2-CE2 4Å
253	V	93.8	Very high	92	Very high	48 Å²	48	56.1 Å²	56.1	29%	0.291	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-21.5	175.6	74.4	0	0	0	0	113.4	E223 D255 E257	E223-V253 HydrophobicContact CG-CG1 4.09Å; V253-D255 PolarHBondContact O-N 3.28Å; V253-E257 HydrophobicContact CG2-CG 4.41Å
254	Q	89.9	Confident	92	Very high	183 Å²	183	56.1 Å²	56.1	86%	0.855	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-24.5	174.5	-62.7	-177.7	-3.1	0	0	112.3	T252	T252-Q254 PolarHBondContact O-N 3.41Å; T252-Q254 VanDerWaalsContact O-N 3.14Å; T252-Q254 PolarHBondContact OG1-N 3.35Å
255	D	89.2	Confident	92	Very high	64 Å²	64	48.6 Å²	48.6	34%	0.342	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-51.3	179.5	-56.6	-71.6	0	0	0	111.5	F238 R239 V251 T252 V253	F238-D255 HydrophobicContact CZ-CB 4.15Å; R239-D255 WeakPolarHBondContact CD-OD1 3.4Å; R239-D255 IonicContact CZ-OD1 2.63Å; R239-D255 IonicContact NE-OD1 3.69Å; R239-D255 IonicContact NH1-OD1 2.8Å; R239-D255 PolarHBondContact NH1-OD1 3.46Å; R239-D255 IonicContact NH1-OD2 3.51Å; R239-D255 PolarHBondContact NH1-OD2 2.98Å; V251-D255 HydrophobicContact CG1-CB 4.02Å; T252-D255 PolarHBondContact N-OD2 2.99Å; T252-D255 WeakPolarHBondContact O-CB 3.43Å; T252-D255 PolarHBondContact O-N 3.15Å; T252-D255 PolarHBondContact OG1-OD2 3.44Å; T252-D255 VanDerWaalsContact OG1-OD2 3.1Å; V253-D255 PolarHBondContact O-N 3.28Å
256	T	90	Very high	92	Very high	38 Å²	38	46.8 Å²	46.8	23%	0.233	25%	0.251	C	S	.	.			trans	-158.8	144.5	178.3	-176.6	0	0	0	0	110.3	F238 V251 T252 A258 H259	F238-T256 HydrophobicContact CE2-CG2 4.28Å; F238-T256 HydrophobicContact CZ-CG2 3.83Å; V251-T256 HydrophobicContact CG1-CG2 3.93Å; T252-T256 PolarHBondContact O-N 3.28Å; T256-A258 PolarHBondContact OG1-N 3.34Å; T256-A258 PolarHBondContact OG1-O 2.83Å; T256-H259 HydrophobicContact CG2-CB 3.77Å
257	E	90.6	Very high	92.2	Very high	150 Å²	150	47.6 Å²	47.6	70%	0.701	25%	0.247	S	C	*	.	S	Bend	trans	-72.5	-30.9	174.2	-64.1	-179.6	177.2	0	0	112.3	L221 V253	L221-E257 PolarHBondContact N-O 3.23Å; V253-E257 HydrophobicContact CG2-CG 4.41Å
258	A	91.5	Very high	92.3	Very high	23 Å²	23	47.7 Å²	47.7	19%	0.19	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	119.2	-179.6	0	0	0	0	0	109.1	A218 V219 T256	A218-A258 HydrophobicContact CB-CB 3.92Å; V219-A258 WeakPolarHBondContact O-CA 3.25Å; T256-A258 PolarHBondContact OG1-N 3.34Å; T256-A258 PolarHBondContact OG1-O 2.83Å
259	H	93.1	Very high	92.3	Very high	8 Å²	8	45.3 Å²	45.3	4%	0.037	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	117.9	179.9	-173.9	73	0	0	0	110.1	A218 V219 L221 L227 F238 V251 T256 P261 E265	A218-H259 CarbonylContact C-O 3.49Å; A218-H259 WeakPolarHBondContact CA-O 3.35Å; V219-H259 PolarHBondContact N-O 3.45Å; V219-H259 PolarHBondContact O-N 2.96Å; L221-H259 HydrophobicContact CD1-CB 4.37Å; L227-H259 HydrophobicContact CD2-CB 4.11Å; L227-H259 VanDerWaalsContact CD2-CD2 3.49Å; L227-H259 WeakPolarHBondContact CD2-CD2 3.39Å; F238-H259 AromaticContact CD1-CE1 3.55Å; F238-H259 AromaticContact CD1-ND1 3.76Å; F238-H259 AromaticContact CE1-CE1 3.5Å; F238-H259 VanDerWaalsContact CE1-CE1 3.5Å; F238-H259 WeakPolarHBondContact CE1-CE1 3.36Å; F238-H259 AromaticContact CE1-ND1 3.36Å; F238-H259 WeakPolarHBondContact CE1-ND1 3.46Å; V251-H259 HydrophobicContact CG1-CB 4.38Å; T256-H259 HydrophobicContact CG2-CB 3.77Å; H259-P261 WeakPolarHBondContact O-CD 3.29Å; H259-E265 IonicContact CD2-OE2 3.01Å; H259-E265 IonicContact CE1-OE2 3.94Å; H259-E265 PolarHBondContact CE1-OE2 3.03Å; H259-E265 IonicContact NE2-OE1 3.75Å; H259-E265 IonicContact NE2-OE2 2.65Å; H259-E265 PolarHBondContact NE2-OE2 3.42Å
260	V	92.9	Very high	92.3	Very high	32 Å²	32	48.7 Å²	48.7	19%	0.194	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-86.3	116.9	168.1	-176	0	0	0	0	107.7	A173 L197 V216 A218 D262	A173-V260 HydrophobicContact CB-CG1 3.76Å; L197-V260 HydrophobicContact CD1-CG1 3.95Å; V216-V260 HydrophobicContact CB-CG1 4.1Å; V216-V260 HydrophobicContact CG1-CG1 3.8Å; A218-V260 HydrophobicContact CB-CG2 3.52Å; V260-D262 PolarHBondContact O-N 2.91Å
261	P	92.8	Very high	92.3	Very high	20 Å²	20	49.3 Å²	49.3	13%	0.13	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-61.5	123.4	178.2	-21.4	33.3	0	0	0	111.2	L197 V219 H259 E265 V267	L197-P261 WeakPolarHBondContact CD1-O 3.39Å; V219-P261 HydrophobicContact CG2-CG 4.4Å; H259-P261 WeakPolarHBondContact O-CD 3.29Å; P261-E265 WeakPolarHBondContact CA-OE2 3.42Å; P261-V267 HydrophobicContact CB-CG2 3.67Å; P261-V267 HydrophobicContact CG-CG2 3.44Å; P261-V267 VanDerWaalsContact CG-CG2 3.44Å
262	D	91.2	Very high	92.3	Very high	50 Å²	50	53.8 Å²	53.8	27%	0.267	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-72	163.9	178.3	-167.6	18.8	0	0	0	111.8	V260 H264 E265	V260-D262 PolarHBondContact O-N 2.91Å; D262-H264 PolarHBondContact O-N 3.33Å; D262-H264 VanDerWaalsContact O-N 3.16Å; D262-E265 HydrophobicContact CB-CB 4.49Å; D262-E265 HydrophobicContact CB-CG 4.01Å; D262-E265 PolarHBondContact N-OE2 3.1Å; D262-E265 WeakPolarHBondContact O-CA 3.19Å; D262-E265 WeakPolarHBondContact O-CB 3.43Å; D262-E265 PolarHBondContact O-N 3.32Å
263	V	90.7	Very high	92.4	Very high	20 Å²	20	54.6 Å²	54.6	12%	0.121	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-32.4	179.9	-179.1	0	0	0	0	112.3	R175 E195 L197 E265	R175-V263 HydrophobicContact CG-CG2 4.42Å; E195-V263 HydrophobicContact CB-CG1 3.57Å; E195-V263 HydrophobicContact CB-CG2 4.3Å; L197-V263 HydrophobicContact CD2-CG2 4.22Å; L197-V263 HydrophobicContact CG-CG2 3.99Å; V263-E265 VanDerWaalsContact C-N 3.3Å
264	H	91.8	Very high	92.4	Very high	44 Å²	44	53.1 Å²	53.1	20%	0.204	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-2	179	-56.1	-35.5	0	0	0	113.3	R232 F235 D262	R232-H264 PolarHBondContact N-O 2.99Å; F235-H264 HydrophobicContact CB-CB 4.2Å; F235-H264 HydrophobicContact CD1-CB 3.62Å; F235-H264 HydrophobicContact CD2-CB 4.01Å; F235-H264 HydrophobicContact CE1-CB 3.97Å; F235-H264 HydrophobicContact CE2-CB 4.33Å; F235-H264 HydrophobicContact CG-CB 3.67Å; F235-H264 AromaticContact CG-CD2 3.95Å; F235-H264 HydrophobicContact CZ-CB 4.34Å; D262-H264 PolarHBondContact O-N 3.33Å; D262-H264 VanDerWaalsContact O-N 3.16Å
265	E	92.8	Very high	92.5	Very high	13 Å²	13	48 Å²	48	6%	0.061	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	140.4	178.9	-63.2	174.2	164.7	0	0	110	L229 F235 W249 H259 P261 D262 V263	L229-E265 HydrophobicContact CD1-CG 4.46Å; L229-E265 HydrophobicContact CD2-CB 4.49Å; F235-E265 HydrophobicContact CE1-CG 4.2Å; F235-E265 HydrophobicContact CE2-CG 3.97Å; F235-E265 HydrophobicContact CZ-CG 3.37Å; W249-E265 HydrophobicContact CH2-CG 4.27Å; W249-E265 HydrophobicContact CZ2-CG 4.09Å; H259-E265 IonicContact CD2-OE2 3.01Å; H259-E265 IonicContact CE1-OE2 3.94Å; H259-E265 PolarHBondContact CE1-OE2 3.03Å; H259-E265 IonicContact NE2-OE1 3.75Å; H259-E265 IonicContact NE2-OE2 2.65Å; H259-E265 PolarHBondContact NE2-OE2 3.42Å; P261-E265 WeakPolarHBondContact CA-OE2 3.42Å; D262-E265 HydrophobicContact CB-CB 4.49Å; D262-E265 HydrophobicContact CB-CG 4.01Å; D262-E265 PolarHBondContact N-OE2 3.1Å; D262-E265 WeakPolarHBondContact O-CA 3.19Å; D262-E265 WeakPolarHBondContact O-CB 3.43Å; D262-E265 PolarHBondContact O-N 3.32Å; V263-E265 VanDerWaalsContact C-N 3.3Å
266	E	93.3	Very high	92.7	Very high	47 Å²	47	45.2 Å²	45.2	22%	0.22	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	121	172.5	179.4	166.8	-135.6	0	0	109	L229 R230 R232 L268	L229-E266 CarbonylContact C-O 3.57Å; L229-E266 WeakPolarHBondContact CA-O 3.37Å; R230-E266 HydrophobicContact CB-CB 4.39Å; R230-E266 IonicContact CZ-OE2 2.86Å; R230-E266 VanDerWaalsContact CZ-OE2 3.25Å; R230-E266 PolarHBondContact N-O 3.39Å; R230-E266 IonicContact NE-OE2 2.69Å; R230-E266 PolarHBondContact NE-OE2 2.81Å; R230-E266 VanDerWaalsContact NH2-CD 3.34Å; R230-E266 IonicContact NH2-OE1 3.73Å; R230-E266 IonicContact NH2-OE2 3.64Å; R230-E266 PolarHBondContact NH2-OE2 3.49Å; R230-E266 PolarHBondContact O-N 3Å; R232-E266 HydrophobicContact CG-CB 4.05Å; R232-E266 IonicContact CZ-OE1 3.04Å; R232-E266 IonicContact NE-OE1 2.87Å; R232-E266 IonicContact NE-OE2 3.51Å; R232-E266 IonicContact NH2-OE1 2.94Å; R232-E266 PolarHBondContact NH2-OE1 2.92Å; E266-L268 PolarHBondContact O-N 2.96Å
267	V	94.3	Very high	92.8	Very high	64 Å²	64	44.4 Å²	44.4	39%	0.388	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	113.8	176.3	-178	0	0	0	0	108.9	L227 L229 P261	L227-V267 HydrophobicContact CD1-CG1 3.69Å; L229-V267 HydrophobicContact CD2-CB 4.35Å; L229-V267 HydrophobicContact CD2-CG2 3.75Å; P261-V267 HydrophobicContact CB-CG2 3.67Å; P261-V267 HydrophobicContact CG-CG2 3.44Å; P261-V267 VanDerWaalsContact CG-CG2 3.44Å
268	L	93.4	Very high	92.8	Very high	73 Å²	73	41.4 Å²	41.4	38%	0.382	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	-34.6	173.6	-66.9	178.7	0	0	0	111.4	H228 R230 E248 E266	H228-L268 HydrophobicContact CB-CB 4.46Å; H228-L268 PolarHBondContact O-N 3.34Å; R230-L268 HydrophobicContact CB-CD1 3.94Å; R230-L268 HydrophobicContact CB-CG 4.13Å; E248-L268 HydrophobicContact CG-CD1 4.22Å; E266-L268 PolarHBondContact O-N 2.96Å
269	G	92.6	Very high	92.7	Very high	27 Å²	27	44.8 Å²	44.8	28%	0.278	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	165.6	-172.7	177.1	0	0	0	0	0	113.6	H228	H228-G269 PolarHBondContact N-O 2.99Å
270	V	93.2	Very high	92.7	Very high	81 Å²	81	46.4 Å²	46.4	49%	0.491	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	124.7	175	-178.5	0	0	0	0	108.7	T225 A226 L227	T225-V270 HydrophobicContact CG2-CG1 4.06Å; A226-V270 CarbonylContact O-C 3.48Å; A226-V270 WeakPolarHBondContact O-CA 3.37Å; L227-V270 HydrophobicContact CD1-CG2 4.33Å
271	V	93.8	Very high	92.8	Very high	28 Å²	28	45.1 Å²	45.1	17%	0.17	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	120.6	-178.5	178.6	0	0	0	0	109.3	A226 H228 L250	A226-V271 PolarHBondContact N-O 2.89Å; A226-V271 PolarHBondContact O-N 2.93Å; H228-V271 HydrophobicContact CB-CG2 3.92Å; L250-V271 HydrophobicContact CD2-CG2 4.02Å
272	P	94.3	Very high	92.8	Very high	93 Å²	93	44.2 Å²	44.2	60%	0.604	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.4	149.9	174.5	30.4	-33.9	0	0	0	111.2	K224	K224-P272 WeakPolarHBondContact O-CA 3.47Å
273	I	94.9	Very high	93	Very high	40 Å²	40	42.4 Å²	42.4	21%	0.205	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-65.7	136.1	173.3	-165.2	160.9	0	0	0	110.6	E223 K224 T275 F309	E223-I273 WeakPolarHBondContact O-CD1 3.43Å; K224-I273 HydrophobicContact CB-CG2 3.9Å; K224-I273 HydrophobicContact CG-CG2 4.12Å; K224-I273 PolarHBondContact O-N 3.12Å; I273-T275 HydrophobicContact CG1-CG2 4.39Å; I273-T275 HydrophobicContact CG2-CG2 3.98Å; I273-F309 HydrophobicContact CB-CD1 4.06Å; I273-F309 HydrophobicContact CB-CE1 3.55Å; I273-F309 HydrophobicContact CB-CZ 3.96Å; I273-F309 HydrophobicContact CD1-CE1 4.47Å; I273-F309 HydrophobicContact CD1-CE2 4.28Å; I273-F309 HydrophobicContact CD1-CZ 4.06Å; I273-F309 HydrophobicContact CG1-CD1 4.39Å; I273-F309 HydrophobicContact CG1-CE1 4.1Å; I273-F309 HydrophobicContact CG1-CZ 4.2Å
274	T	93.6	Very high	93.2	Very high	17 Å²	17	41.5 Å²	41.5	10%	0.104	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	116.8	170.6	-57.8	0	0	0	0	108.1	S307 F308 L316 I320	T274-S307 WeakPolarHBondContact O-CA 3.4Å; T274-F308 WeakPolarHBondContact CA-O 3.34Å; T274-F308 WeakPolarHBondContact CB-O 3.42Å; T274-F308 HydrophobicContact CG2-CE1 4.39Å; T274-F308 HydrophobicContact CG2-CZ 4.08Å; T274-F308 PolarHBondContact N-O 3.06Å; T274-F308 PolarHBondContact O-N 3.44Å; T274-L316 HydrophobicContact CG2-CD1 4.3Å; T274-I320 HydrophobicContact CG2-CD1 4.18Å; T274-I320 HydrophobicContact CG2-CG1 4.34Å
275	T	92.3	Very high	93.2	Very high	76 Å²	76	41.6 Å²	41.6	47%	0.466	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	119.5	-178.9	57.2	0	0	0	0	110.3	I273 S307	I273-T275 HydrophobicContact CG1-CG2 4.39Å; I273-T275 HydrophobicContact CG2-CG2 3.98Å; T275-S307 WeakPolarHBondContact CG2-OG 3.37Å
276	L	93.8	Very high	93.3	Very high	5 Å²	5	43.3 Å²	43.3	3%	0.026	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	130.1	171.8	-62.9	176	0	0	0	109.7	N280 C282 V302 G304 E305 K306 F308 I320	L276-N280 HydrophobicContact CB-CB 4.49Å; L276-N280 HydrophobicContact CD2-CB 4.3Å; L276-C282 HydrophobicContact CD2-CB 4.13Å; L276-V302 HydrophobicContact CD1-CB 4.14Å; L276-V302 HydrophobicContact CD1-CG1 3.76Å; L276-V302 WeakPolarHBondContact CD1-O 3.47Å; L276-G304 WeakPolarHBondContact CB-O 3.16Å; L276-E305 WeakPolarHBondContact O-CA 3.47Å; L276-K306 PolarHBondContact N-O 2.87Å; L276-K306 PolarHBondContact O-N 2.88Å; L276-F308 HydrophobicContact CD1-CE1 3.83Å; L276-F308 HydrophobicContact CG-CE1 4.14Å; L276-I320 HydrophobicContact CD2-CB 4.43Å; L276-I320 HydrophobicContact CD2-CG1 4.09Å; L276-I320 HydrophobicContact CD2-CG2 3.73Å
277	G	92.1	Very high	93.3	Very high	21 Å²	21	41.3 Å²	41.3	22%	0.216	25%	0.247	C	C	.	.			trans	-76.6	-179.5	169.2	0	0	0	0	0	113.1	H279 N280	G277-H279 VanDerWaalsContact C-N 3.34Å; G277-H279 PolarHBondContact O-N 3.06Å; G277-N280 PolarHBondContact O-N 2.88Å
278	P	89.6	Confident	93.1	Very high	88 Å²	88	39.5 Å²	39.5	57%	0.571	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-36.7	-178.2	23.2	-32	0	0	0	113.2
279	H	89.9	Confident	92.9	Very high	93 Å²	93	36.7 Å²	36.7	43%	0.431	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	25.9	178.5	-56.6	-65.7	0	0	0	112.7	G277 D322 V323 E364	G277-H279 VanDerWaalsContact C-N 3.34Å; G277-H279 PolarHBondContact O-N 3.06Å; H279-D322 WeakPolarHBondContact O-CA 3.46Å; H279-V323 WeakPolarHBondContact O-CB 3.41Å; H279-V323 WeakPolarHBondContact O-CG2 3.31Å; H279-V323 PolarHBondContact O-N 2.64Å; H279-E364 IonicContact CE1-OE1 3.35Å; H279-E364 PolarHBondContact CE1-OE1 3.21Å; H279-E364 IonicContact ND1-OE1 3.75Å; H279-E364 PolarHBondContact ND1-OE1 3.36Å; H279-E364 IonicContact ND1-OE2 3.93Å
280	N	93.2	Very high	92.6	Very high	42 Å²	42	41.6 Å²	41.6	23%	0.225	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	148.3	178.9	-61.3	27.1	0	0	0	110.4	L276 G277 I320 Q321	L276-N280 HydrophobicContact CB-CB 4.49Å; L276-N280 HydrophobicContact CD2-CB 4.3Å; G277-N280 PolarHBondContact O-N 2.88Å; N280-I320 HydrophobicContact CB-CG2 3.83Å; N280-I320 WeakPolarHBondContact ND2-CG2 3.38Å; N280-Q321 CarbonylContact C-O 3.55Å; N280-Q321 VanDerWaalsContact CA-O 3.28Å; N280-Q321 WeakPolarHBondContact CA-O 3.3Å
281	Y	94.6	Very high	92.1	Very high	6 Å²	6	44.7 Å²	44.7	2%	0.024	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	166.4	170.3	78.1	-78.4	0	0	0	110	V283 V301 V302 Q321 D322 V323 V366	Y281-V283 HydrophobicContact CE2-CG2 4.26Å; Y281-V301 HydrophobicContact CD2-CG1 4.1Å; Y281-V302 WeakPolarHBondContact CA-O 3.44Å; Y281-V302 WeakPolarHBondContact CB-O 3.42Å; Y281-Q321 HydrophobicContact CD1-CB 4.11Å; Y281-Q321 HydrophobicContact CE1-CB 3.7Å; Y281-Q321 HydrophobicContact CE2-CB 4.46Å; Y281-Q321 PolarHBondContact N-O 3Å; Y281-Q321 PolarHBondContact O-N 3.38Å; Y281-Q321 VanDerWaalsContact O-O 3.06Å; Y281-Q321 PolarHBondContact OH-OE1 2.71Å; Y281-D322 VanDerWaalsContact CE1-O 3.28Å; Y281-D322 WeakPolarHBondContact CE1-O 3.46Å; Y281-V323 HydrophobicContact CD1-CG2 3.95Å; Y281-V366 HydrophobicContact CD1-CG1 4.24Å; Y281-V366 HydrophobicContact CD1-CG2 4.44Å; Y281-V366 HydrophobicContact CD2-CG1 3.55Å; Y281-V366 HydrophobicContact CE2-CG1 4.05Å; Y281-V366 HydrophobicContact CG-CG1 3.64Å; Y281-V366 HydrophobicContact CG-CG2 4.41Å
282	C	94.1	Very high	91.6	Very high	0 Å²	0	46 Å²	46	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	161.4	170.6	68.1	0	0	0	0	110.8	L276 V302 L316 G319	L276-C282 HydrophobicContact CD2-CB 4.13Å; C282-V302 PolarHBondContact N-O 3.22Å; C282-V302 PolarHBondContact O-N 3.25Å; C282-L316 HydrophobicContact CB-CD2 3.95Å; C282-G319 WeakPolarHBondContact CB-O 3.08Å
283	V	94.2	Very high	91.3	Very high	13 Å²	13	49 Å²	49	8%	0.079	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	117.5	176.9	-172.6	0	0	0	0	108.1	Y281 K299 V301 L316 E317	Y281-V283 HydrophobicContact CE2-CG2 4.26Å; V283-K299 HydrophobicContact CG1-CB 3.91Å; V283-K299 HydrophobicContact CG1-CD 4.18Å; V283-K299 HydrophobicContact CG1-CG 4.43Å; V283-V301 HydrophobicContact CG2-CG2 4.25Å; V283-L316 WeakPolarHBondContact O-CA 3.4Å; V283-E317 HydrophobicContact CB-CB 4.22Å; V283-E317 PolarHBondContact O-N 3.26Å
284	I	94.9	Very high	91.1	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.005	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	122.9	176.7	-57.6	174.1	0	0	0	108.3	P287 K299 R300 V302 F308 L310 E314 Q315 L316	I284-P287 HydrophobicContact CG2-CB 4.4Å; I284-K299 CarbonylContact O-C 3.53Å; I284-K299 WeakPolarHBondContact O-CA 3.24Å; I284-R300 PolarHBondContact N-O 3.43Å; I284-R300 PolarHBondContact O-N 2.87Å; I284-V302 HydrophobicContact CD1-CG2 3.62Å; I284-V302 HydrophobicContact CG1-CG2 4.29Å; I284-F308 HydrophobicContact CD1-CD2 4.46Å; I284-F308 HydrophobicContact CD1-CE2 3.6Å; I284-F308 HydrophobicContact CD1-CZ 3.96Å; I284-F308 HydrophobicContact CG1-CE2 4.43Å; I284-L310 HydrophobicContact CG1-CD2 4.44Å; I284-E314 HydrophobicContact CG2-CB 3.76Å; I284-E314 HydrophobicContact CG2-CG 3.83Å; I284-Q315 CarbonylContact C-O 3.57Å; I284-Q315 WeakPolarHBondContact CA-O 3.46Å; I284-L316 HydrophobicContact CG1-CD2 4.1Å
285	L	93.4	Very high	91	Very high	46 Å²	46	52.2 Å²	52.2	24%	0.241	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	143.8	169.8	-58.3	-178.9	0	0	0	110	K299 Q315 E317	L285-K299 HydrophobicContact CD2-CD 4.14Å; L285-K299 HydrophobicContact CD2-CG 3.86Å; L285-Q315 PolarHBondContact N-O 3.22Å; L285-Q315 PolarHBondContact O-N 2.65Å; L285-E317 HydrophobicContact CD1-CB 4.16Å; L285-E317 HydrophobicContact CD1-CG 4.34Å; L285-E317 HydrophobicContact CD2-CB 3.94Å; L285-E317 HydrophobicContact CD2-CG 4.14Å; L285-E317 HydrophobicContact CG-CB 3.97Å; L285-E317 HydrophobicContact CG-CG 4.48Å
286	D	93.3	Very high	90.8	Very high	48 Å²	48	55.5 Å²	55.5	26%	0.257	32%	0.317	S	S	.	.	S	Bend	trans	51.4	50.9	177.9	-56	-30.8	0	0	0	113.6	N294 L296 G297 Q298	D286-N294 HydrophobicContact CB-CB 4.4Å; D286-N294 PolarHBondContact O-ND2 3.4Å; D286-N294 VanDerWaalsContact O-ND2 3.16Å; D286-L296 HydrophobicContact CB-CD2 4.37Å; D286-L296 WeakPolarHBondContact OD1-CA 3.49Å; D286-G297 PolarHBondContact OD1-N 2.86Å; D286-Q298 PolarHBondContact N-O 3.2Å
287	P	93.4	Very high	90.4	Very high	5 Å²	5	58.7 Å²	58.7	3%	0.032	35%	0.351	C	S	.	.			trans	-60.1	142.4	-173.2	28.5	-36.8	0	0	0	111.2	I284 G289 Q295 Q298 R300 E314	I284-P287 HydrophobicContact CG2-CB 4.4Å; P287-G289 PolarHBondContact O-N 2.86Å; P287-Q295 PolarHBondContact O-N 3.13Å; P287-Q298 VanDerWaalsContact CD-O 3.23Å; P287-Q298 WeakPolarHBondContact CD-O 3.4Å; P287-Q298 HydrophobicContact CG-CB 4.37Å; P287-R300 HydrophobicContact CB-CB 3.72Å; P287-R300 HydrophobicContact CG-CB 3.83Å; P287-E314 WeakPolarHBondContact CA-OE1 3.22Å
288	V	91.5	Very high	90.2	Very high	27 Å²	27	62.8 Å²	62.8	16%	0.164	37%	0.365	C	S	.	.	B	Isolated β-bridge	trans	-73.7	125.8	175.3	177.6	0	0	0	0	109.6	R300 Q311 E314	V288-R300 PolarHBondContact O-NH1 2.88Å; V288-Q311 HydrophobicContact CB-CB 4.16Å; V288-Q311 HydrophobicContact CB-CG 4.3Å; V288-Q311 HydrophobicContact CG2-CB 3.56Å; V288-Q311 HydrophobicContact CG2-CG 4.25Å; V288-E314 HydrophobicContact CG2-CG 4.11Å; V288-E314 PolarHBondContact N-OE1 2.87Å
289	G	88.6	Confident	90.3	Very high	13 Å²	13	62.7 Å²	62.7	13%	0.134	36%	0.355	C	S	.	.			trans	-79.7	177.4	176.8	0	0	0	0	0	113.7	P287 D291 G292 K293 Q295	P287-G289 PolarHBondContact O-N 2.86Å; G289-D291 PolarHBondContact O-N 2.85Å; G289-D291 VanDerWaalsContact O-N 3.17Å; G289-G292 PolarHBondContact O-N 3.14Å; G289-K293 PolarHBondContact N-O 2.99Å; G289-Q295 VanDerWaalsContact CA-NE2 3.28Å
290	P	86.4	Confident	90.3	Very high	130 Å²	130	63 Å²	63	84%	0.844	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-23.5	175.3	26.8	-34.7	0	0	0	112.9	G292	P290-G292 PolarHBondContact O-N 2.84Å
291	D	82.4	Confident	90.3	Very high	146 Å²	146	62.9 Å²	62.9	78%	0.781	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-0	176.6	-57.6	-23.2	0	0	0	113.3	G289 K293	G289-D291 PolarHBondContact O-N 2.85Å; G289-D291 VanDerWaalsContact O-N 3.17Å; D291-K293 VanDerWaalsContact C-N 3.26Å; D291-K293 PolarHBondContact O-N 3.23Å
292	G	83.2	Confident	90.2	Very high	55 Å²	55	63.5 Å²	63.5	57%	0.567	36%	0.358	S	S	*	.	S	Bend	trans	73.1	15.2	-178.4	0	0	0	0	0	114.3	G289 P290	G289-G292 PolarHBondContact O-N 3.14Å; P290-G292 PolarHBondContact O-N 2.84Å
293	K	88.1	Confident	90	Very high	158 Å²	158	69.7 Å²	69.7	69%	0.687	39%	0.385	S	S	*	.	S	Bend	trans	-117.2	147.2	178.6	-64.5	-176.8	-178.7	178.6	0	111.9	G289 D291	G289-K293 PolarHBondContact N-O 2.99Å; D291-K293 VanDerWaalsContact C-N 3.26Å; D291-K293 PolarHBondContact O-N 3.23Å
294	N	90.4	Very high	89.6	Confident	57 Å²	57	70.5 Å²	70.5	31%	0.305	40%	0.396	S	S	.	.	B	Isolated β-bridge	trans	-67.8	132.2	175.8	-58.2	68.7	0	0	0	111.2	D286 L296 P312 G313	D286-N294 HydrophobicContact CB-CB 4.4Å; D286-N294 PolarHBondContact O-ND2 3.4Å; D286-N294 VanDerWaalsContact O-ND2 3.16Å; N294-L296 HydrophobicContact CB-CD2 4.41Å; N294-L296 PolarHBondContact O-N 3.25Å; N294-P312 PolarHBondContact ND2-O 3.02Å; N294-P312 PolarHBondContact OD1-O 3.38Å; N294-G313 VanDerWaalsContact ND2-C 3.34Å; N294-G313 WeakPolarHBondContact ND2-CA 3.49Å
295	Q	90.9	Very high	89.5	Confident	67 Å²	67	78.2 Å²	78.2	31%	0.313	43%	0.432	S	S	.	.			trans	-89.8	84	175.7	-62.2	177	15	0	0	109.5	P287 G289 G297 Q298	P287-Q295 PolarHBondContact O-N 3.13Å; G289-Q295 VanDerWaalsContact CA-NE2 3.28Å; Q295-G297 PolarHBondContact O-N 2.88Å; Q295-Q298 HydrophobicContact CB-CB 4.05Å; Q295-Q298 HydrophobicContact CB-CG 4.03Å; Q295-Q298 WeakPolarHBondContact O-CB 3.32Å; Q295-Q298 PolarHBondContact O-N 3.45Å
296	L	88.3	Confident	89.4	Confident	144 Å²	144	81.6 Å²	81.6	75%	0.754	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	130.5	-174.5	-59.9	178.4	0	0	0	112.4	D286 N294 Q298	D286-L296 HydrophobicContact CB-CD2 4.37Å; D286-L296 WeakPolarHBondContact OD1-CA 3.49Å; N294-L296 HydrophobicContact CB-CD2 4.41Å; N294-L296 PolarHBondContact O-N 3.25Å; L296-Q298 VanDerWaalsContact C-N 3.26Å; L296-Q298 PolarHBondContact O-N 3.33Å
297	G	85.7	Confident	89.3	Confident	73 Å²	73	83 Å²	83	75%	0.753	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.5	-0.9	-179	0	0	0	0	0	114.8	D286 Q295	D286-G297 PolarHBondContact OD1-N 2.86Å; Q295-G297 PolarHBondContact O-N 2.88Å
298	Q	88.6	Confident	89.3	Confident	107 Å²	107	84.6 Å²	84.6	50%	0.5	47%	0.465	S	S	.	.			trans	-91.8	157.5	174.7	-59.5	-161.5	26.6	0	0	111.7	D286 P287 Q295 L296	D286-Q298 PolarHBondContact N-O 3.2Å; P287-Q298 VanDerWaalsContact CD-O 3.23Å; P287-Q298 WeakPolarHBondContact CD-O 3.4Å; P287-Q298 HydrophobicContact CG-CB 4.37Å; Q295-Q298 HydrophobicContact CB-CB 4.05Å; Q295-Q298 HydrophobicContact CB-CG 4.03Å; Q295-Q298 WeakPolarHBondContact O-CB 3.32Å; Q295-Q298 PolarHBondContact O-N 3.45Å; L296-Q298 VanDerWaalsContact C-N 3.26Å; L296-Q298 PolarHBondContact O-N 3.33Å
299	K	91	Very high	89.5	Confident	85 Å²	85	84.8 Å²	84.8	37%	0.37	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	135.5	178.3	-57.6	-172.4	176.3	-167.9	0	109.7	V283 I284 L285 E317 A369	V283-K299 HydrophobicContact CG1-CB 3.91Å; V283-K299 HydrophobicContact CG1-CD 4.18Å; V283-K299 HydrophobicContact CG1-CG 4.43Å; I284-K299 CarbonylContact O-C 3.53Å; I284-K299 WeakPolarHBondContact O-CA 3.24Å; L285-K299 HydrophobicContact CD2-CD 4.14Å; L285-K299 HydrophobicContact CD2-CG 3.86Å; K299-E317 WeakPolarHBondContact CE-OE2 3.38Å; K299-E317 IonicContact NZ-OE1 3.92Å; K299-E317 PolarHBondContact NZ-OE1 2.9Å; K299-E317 IonicContact NZ-OE2 3.49Å; K299-E317 PolarHBondContact NZ-OE2 3.09Å; K299-A369 HydrophobicContact CB-CB 4.04Å
300	R	91	Very high	89.7	Confident	99 Å²	99	85.9 Å²	85.9	37%	0.374	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	120.3	173.9	-177.8	173.6	68.1	-155.1	-6.2	109.9	I284 P287 V288 V302 E314	I284-R300 PolarHBondContact N-O 3.43Å; I284-R300 PolarHBondContact O-N 2.87Å; P287-R300 HydrophobicContact CB-CB 3.72Å; P287-R300 HydrophobicContact CG-CB 3.83Å; V288-R300 PolarHBondContact O-NH1 2.88Å; R300-V302 HydrophobicContact CG-CG2 4.47Å; R300-E314 IonicContact CZ-OE1 2.8Å; R300-E314 IonicContact NH2-OE1 2.88Å; R300-E314 PolarHBondContact NH2-OE1 2.73Å; R300-E314 IonicContact NH2-OE2 3.8Å
301	V	92.6	Very high	90.1	Very high	41 Å²	41	83.2 Å²	83.2	25%	0.248	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	126.9	174.6	-175.2	0	0	0	0	109	Y281 V283 V366 A369	Y281-V301 HydrophobicContact CD2-CG1 4.1Å; V283-V301 HydrophobicContact CG2-CG2 4.25Å; V301-V366 HydrophobicContact CG1-CG1 3.71Å; V301-A369 HydrophobicContact CG2-CB 4.08Å
302	V	92.6	Very high	90.6	Very high	19 Å²	19	77 Å²	77	12%	0.115	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	122	173.2	-174.6	0	0	0	0	107.9	L276 Y281 C282 I284 R300 K306 F308	L276-V302 HydrophobicContact CD1-CB 4.14Å; L276-V302 HydrophobicContact CD1-CG1 3.76Å; L276-V302 WeakPolarHBondContact CD1-O 3.47Å; Y281-V302 WeakPolarHBondContact CA-O 3.44Å; Y281-V302 WeakPolarHBondContact CB-O 3.42Å; C282-V302 PolarHBondContact N-O 3.22Å; C282-V302 PolarHBondContact O-N 3.25Å; I284-V302 HydrophobicContact CD1-CG2 3.62Å; I284-V302 HydrophobicContact CG1-CG2 4.29Å; R300-V302 HydrophobicContact CG-CG2 4.47Å; V302-K306 HydrophobicContact CG1-CD 3.95Å; V302-F308 HydrophobicContact CB-CE1 4.41Å; V302-F308 HydrophobicContact CG1-CD1 4.4Å; V302-F308 HydrophobicContact CG1-CE1 3.9Å; V302-F308 HydrophobicContact CG1-CZ 4.47Å
303	K	90.2	Very high	90.9	Very high	130 Å²	130	76.5 Å²	76.5	57%	0.565	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.5	158.2	-179.5	66.8	178	-178.1	176.3	0	111.9	V366	K303-V366 HydrophobicContact CB-CG1 4.27Å; K303-V366 HydrophobicContact CB-CG2 4.26Å; K303-V366 HydrophobicContact CD-CB 4.09Å; K303-V366 HydrophobicContact CD-CG1 4.3Å; K303-V366 HydrophobicContact CD-CG2 4.09Å
304	G	86.1	Confident	91.2	Very high	29 Å²	29	69.6 Å²	69.6	30%	0.299	38%	0.375	S	S	.	.	S	Bend	trans	84.1	172.3	178.9	0	0	0	0	0	113.1	L276 K306	L276-G304 WeakPolarHBondContact CB-O 3.16Å; G304-K306 PolarHBondContact O-N 3.25Å
305	E	90.9	Very high	91.3	Very high	164 Å²	164	73.2 Å²	73.2	77%	0.766	39%	0.39	S	S	*	.	S	Bend	trans	-63.2	101.4	-178.6	-171.4	178.4	-175.4	0	0	110.7	L276	L276-E305 WeakPolarHBondContact O-CA 3.47Å
306	K	91.5	Very high	91.4	Very high	116 Å²	116	72.2 Å²	72.2	50%	0.504	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	138.7	-176.7	-74.2	-175.4	179.6	175.8	0	110.1	L276 V302 G304 F308	L276-K306 PolarHBondContact N-O 2.87Å; L276-K306 PolarHBondContact O-N 2.88Å; V302-K306 HydrophobicContact CG1-CD 3.95Å; G304-K306 PolarHBondContact O-N 3.25Å; K306-F308 HydrophobicContact CB-CD1 4.48Å
307	S	92.5	Very high	91.5	Very high	78 Å²	78	69.1 Å²	69.1	55%	0.545	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	123.1	172.5	-57.7	0	0	0	0	108.2	T274 T275	T274-S307 WeakPolarHBondContact O-CA 3.4Å; T275-S307 WeakPolarHBondContact CG2-OG 3.37Å
308	F	93.4	Very high	91.7	Very high	39 Å²	39	72.1 Å²	72.1	17%	0.171	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	158.9	-177.9	65.1	-85.3	0	0	0	111.1	T274 L276 I284 V302 K306 L310	T274-F308 WeakPolarHBondContact CA-O 3.34Å; T274-F308 WeakPolarHBondContact CB-O 3.42Å; T274-F308 HydrophobicContact CG2-CE1 4.39Å; T274-F308 HydrophobicContact CG2-CZ 4.08Å; T274-F308 PolarHBondContact N-O 3.06Å; T274-F308 PolarHBondContact O-N 3.44Å; L276-F308 HydrophobicContact CD1-CE1 3.83Å; L276-F308 HydrophobicContact CG-CE1 4.14Å; I284-F308 HydrophobicContact CD1-CD2 4.46Å; I284-F308 HydrophobicContact CD1-CE2 3.6Å; I284-F308 HydrophobicContact CD1-CZ 3.96Å; I284-F308 HydrophobicContact CG1-CE2 4.43Å; V302-F308 HydrophobicContact CB-CE1 4.41Å; V302-F308 HydrophobicContact CG1-CD1 4.4Å; V302-F308 HydrophobicContact CG1-CE1 3.9Å; V302-F308 HydrophobicContact CG1-CZ 4.47Å; K306-F308 HydrophobicContact CB-CD1 4.48Å; F308-L310 HydrophobicContact CE2-CD2 3.95Å
309	F	94.6	Very high	91.9	Very high	31 Å²	31	68.3 Å²	68.3	14%	0.136	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-96.3	137.5	171.9	-61	-78.2	0	0	0	109.8	E223 A226 L250 T252 I273 Q311	E223-F309 WeakPolarHBondContact O-CZ 3.3Å; A226-F309 HydrophobicContact CB-CB 4.46Å; A226-F309 HydrophobicContact CB-CD1 3.61Å; A226-F309 HydrophobicContact CB-CD2 4.16Å; A226-F309 HydrophobicContact CB-CE1 3.76Å; A226-F309 HydrophobicContact CB-CE2 4.3Å; A226-F309 HydrophobicContact CB-CG 3.82Å; A226-F309 HydrophobicContact CB-CZ 4.11Å; L250-F309 HydrophobicContact CD1-CB 3.72Å; T252-F309 HydrophobicContact CG2-CD2 3.96Å; T252-F309 HydrophobicContact CG2-CE2 4Å; I273-F309 HydrophobicContact CB-CD1 4.06Å; I273-F309 HydrophobicContact CB-CE1 3.55Å; I273-F309 HydrophobicContact CB-CZ 3.96Å; I273-F309 HydrophobicContact CD1-CE1 4.47Å; I273-F309 HydrophobicContact CD1-CE2 4.28Å; I273-F309 HydrophobicContact CD1-CZ 4.06Å; I273-F309 HydrophobicContact CG1-CD1 4.39Å; I273-F309 HydrophobicContact CG1-CE1 4.1Å; I273-F309 HydrophobicContact CG1-CZ 4.2Å; F309-Q311 PolarHBondContact O-N 2.88Å
310	L	94.3	Very high	92	Very high	35 Å²	35	68 Å²	68	18%	0.183	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-66.7	121.2	170.2	-67.9	171.1	0	0	0	108.8	L250 I284 F308 E314 L316	L250-L310 WeakPolarHBondContact CD1-O 3.39Å; I284-L310 HydrophobicContact CG1-CD2 4.44Å; F308-L310 HydrophobicContact CE2-CD2 3.95Å; L310-E314 HydrophobicContact CB-CB 4.45Å; L310-E314 HydrophobicContact CD2-CB 4.36Å; L310-L316 HydrophobicContact CD1-CD1 4.34Å; L310-L316 HydrophobicContact CD1-CG 4.05Å; L310-L316 HydrophobicContact CD2-CD2 3.85Å; L310-L316 HydrophobicContact CD2-CG 4.12Å
311	Q	93.7	Very high	92	Very high	75 Å²	75	64.8 Å²	64.8	35%	0.35	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-68.8	161	178.5	-61	-61.1	-46.8	0	0	110.9	V288 F309 G313 E314	V288-Q311 HydrophobicContact CB-CB 4.16Å; V288-Q311 HydrophobicContact CB-CG 4.3Å; V288-Q311 HydrophobicContact CG2-CB 3.56Å; V288-Q311 HydrophobicContact CG2-CG 4.25Å; F309-Q311 PolarHBondContact O-N 2.88Å; Q311-G313 PolarHBondContact O-N 3.29Å; Q311-E314 HydrophobicContact CB-CG 3.96Å; Q311-E314 WeakPolarHBondContact CB-OE2 2.96Å; Q311-E314 PolarHBondContact N-OE2 2.78Å; Q311-E314 VanDerWaalsContact O-CB 3.31Å; Q311-E314 WeakPolarHBondContact O-CB 3.48Å; Q311-E314 PolarHBondContact O-N 3.34Å
312	P	93.1	Very high	92	Very high	15 Å²	15	68.5 Å²	68.5	10%	0.097	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54	129.7	176.7	-26.7	37.3	0	0	0	111.3	E248 L250 N294 E314	E248-P312 HydrophobicContact CB-CB 3.64Å; E248-P312 HydrophobicContact CB-CG 3.94Å; L250-P312 HydrophobicContact CD2-CG 4.47Å; L250-P312 HydrophobicContact CG-CG 4.42Å; N294-P312 PolarHBondContact ND2-O 3.02Å; N294-P312 PolarHBondContact OD1-O 3.38Å; P312-E314 VanDerWaalsContact C-N 3.29Å; P312-E314 PolarHBondContact O-N 2.87Å
313	G	89.5	Confident	92	Very high	45 Å²	45	68.2 Å²	68.2	46%	0.464	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	81	-8.3	-176.3	0	0	0	0	0	115.8	N294 Q311	N294-G313 VanDerWaalsContact ND2-C 3.34Å; N294-G313 WeakPolarHBondContact ND2-CA 3.49Å; Q311-G313 PolarHBondContact O-N 3.29Å
314	E	93.9	Very high	92.1	Very high	13 Å²	13	65.4 Å²	65.4	6%	0.061	35%	0.346	C	S	.	.			trans	-78.2	140.9	172.6	-67.7	-175.3	155.5	0	0	111.1	I284 P287 V288 R300 L310 Q311 P312	I284-E314 HydrophobicContact CG2-CB 3.76Å; I284-E314 HydrophobicContact CG2-CG 3.83Å; P287-E314 WeakPolarHBondContact CA-OE1 3.22Å; V288-E314 HydrophobicContact CG2-CG 4.11Å; V288-E314 PolarHBondContact N-OE1 2.87Å; R300-E314 IonicContact CZ-OE1 2.8Å; R300-E314 IonicContact NH2-OE1 2.88Å; R300-E314 PolarHBondContact NH2-OE1 2.73Å; R300-E314 IonicContact NH2-OE2 3.8Å; L310-E314 HydrophobicContact CB-CB 4.45Å; L310-E314 HydrophobicContact CD2-CB 4.36Å; Q311-E314 HydrophobicContact CB-CG 3.96Å; Q311-E314 WeakPolarHBondContact CB-OE2 2.96Å; Q311-E314 PolarHBondContact N-OE2 2.78Å; Q311-E314 VanDerWaalsContact O-CB 3.31Å; Q311-E314 WeakPolarHBondContact O-CB 3.48Å; Q311-E314 PolarHBondContact O-N 3.34Å; P312-E314 VanDerWaalsContact C-N 3.29Å; P312-E314 PolarHBondContact O-N 2.87Å
315	Q	92	Very high	92.3	Very high	133 Å²	133	68 Å²	68	62%	0.621	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.1	150.9	175.4	-62.3	-175.1	3.5	0	0	110.5	I284 L285	I284-Q315 CarbonylContact C-O 3.57Å; I284-Q315 WeakPolarHBondContact CA-O 3.46Å; L285-Q315 PolarHBondContact N-O 3.22Å; L285-Q315 PolarHBondContact O-N 2.65Å
316	L	93.3	Very high	92.4	Very high	45 Å²	45	60.5 Å²	60.5	24%	0.236	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	128.6	173.3	-62.4	177.4	0	0	0	109.6	T274 C282 V283 I284 L310	T274-L316 HydrophobicContact CG2-CD1 4.3Å; C282-L316 HydrophobicContact CB-CD2 3.95Å; V283-L316 WeakPolarHBondContact O-CA 3.4Å; I284-L316 HydrophobicContact CG1-CD2 4.1Å; L310-L316 HydrophobicContact CD1-CD1 4.34Å; L310-L316 HydrophobicContact CD1-CG 4.05Å; L310-L316 HydrophobicContact CD2-CD2 3.85Å; L310-L316 HydrophobicContact CD2-CG 4.12Å
317	E	90.9	Very high	92.4	Very high	79 Å²	79	58.1 Å²	58.1	37%	0.369	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	-47.9	-176.5	-172	173	-173.7	0	0	112.6	V283 L285 K299	V283-E317 HydrophobicContact CB-CB 4.22Å; V283-E317 PolarHBondContact O-N 3.26Å; L285-E317 HydrophobicContact CD1-CB 4.16Å; L285-E317 HydrophobicContact CD1-CG 4.34Å; L285-E317 HydrophobicContact CD2-CB 3.94Å; L285-E317 HydrophobicContact CD2-CG 4.14Å; L285-E317 HydrophobicContact CG-CB 3.97Å; L285-E317 HydrophobicContact CG-CG 4.48Å; K299-E317 WeakPolarHBondContact CE-OE2 3.38Å; K299-E317 IonicContact NZ-OE1 3.92Å; K299-E317 PolarHBondContact NZ-OE1 2.9Å; K299-E317 IonicContact NZ-OE2 3.49Å; K299-E317 PolarHBondContact NZ-OE2 3.09Å
318	Q	90.6	Very high	92.2	Very high	136 Å²	136	61.8 Å²	61.8	64%	0.636	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133	31.1	178.5	-58.6	-175.8	-18.8	0	0	111.4	Q321	Q318-Q321 HydrophobicContact CB-CG 4.3Å
319	G	92.4	Very high	92	Very high	28 Å²	28	65.4 Å²	65.4	29%	0.289	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	66.5	-148.1	-174.7	0	0	0	0	0	113.1	C282	C282-G319 WeakPolarHBondContact CB-O 3.08Å
320	I	93.2	Very high	91.8	Very high	77 Å²	77	65.8 Å²	65.8	40%	0.395	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	125.4	174.4	-59.1	169.9	0	0	0	107.7	T274 L276 N280	T274-I320 HydrophobicContact CG2-CD1 4.18Å; T274-I320 HydrophobicContact CG2-CG1 4.34Å; L276-I320 HydrophobicContact CD2-CB 4.43Å; L276-I320 HydrophobicContact CD2-CG1 4.09Å; L276-I320 HydrophobicContact CD2-CG2 3.73Å; N280-I320 HydrophobicContact CB-CG2 3.83Å; N280-I320 WeakPolarHBondContact ND2-CG2 3.38Å
321	Q	91.6	Very high	91.7	Very high	32 Å²	32	64.1 Å²	64.1	15%	0.15	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	153	-177.5	-64.5	175.5	60.8	0	0	110.5	N280 Y281 Q318	N280-Q321 CarbonylContact C-O 3.55Å; N280-Q321 VanDerWaalsContact CA-O 3.28Å; N280-Q321 WeakPolarHBondContact CA-O 3.3Å; Y281-Q321 HydrophobicContact CD1-CB 4.11Å; Y281-Q321 HydrophobicContact CE1-CB 3.7Å; Y281-Q321 HydrophobicContact CE2-CB 4.46Å; Y281-Q321 PolarHBondContact N-O 3Å; Y281-Q321 PolarHBondContact O-N 3.38Å; Y281-Q321 VanDerWaalsContact O-O 3.06Å; Y281-Q321 PolarHBondContact OH-OE1 2.71Å; Q318-Q321 HydrophobicContact CB-CG 4.3Å
322	D	92.3	Very high	91.6	Very high	119 Å²	119	60.6 Å²	60.6	64%	0.636	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.5	137.1	175.1	-61.1	-33.4	0	0	0	110.1	H279 Y281	H279-D322 WeakPolarHBondContact O-CA 3.46Å; Y281-D322 VanDerWaalsContact CE1-O 3.28Å; Y281-D322 WeakPolarHBondContact CE1-O 3.46Å
323	V	92.3	Very high	91.6	Very high	14 Å²	14	60.3 Å²	60.3	9%	0.085	32%	0.32	C	S	.	.			trans	-61.8	141.2	175.7	176.1	0	0	0	0	109.3	H279 Y281 V325 E364 Y365 V366	H279-V323 WeakPolarHBondContact O-CB 3.41Å; H279-V323 WeakPolarHBondContact O-CG2 3.31Å; H279-V323 PolarHBondContact O-N 2.64Å; Y281-V323 HydrophobicContact CD1-CG2 3.95Å; V323-V325 PolarHBondContact O-N 3.19Å; V323-V325 VanDerWaalsContact O-N 3.09Å; V323-E364 HydrophobicContact CG1-CB 3.99Å; V323-Y365 WeakPolarHBondContact CG1-O 3.38Å; V323-V366 HydrophobicContact CB-CG2 4.27Å; V323-V366 HydrophobicContact CG1-CG2 3.7Å; V323-V366 HydrophobicContact CG2-CG2 3.72Å
324	Y	91.7	Very high	91.7	Very high	71 Å²	71	58.2 Å²	58.2	28%	0.278	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	105.3	177.7	-66.7	-89.8	0	0	0	110	L332 E364 Y365 P367 V373	Y324-L332 HydrophobicContact CD1-CD1 3.96Å; Y324-L332 HydrophobicContact CD1-CD2 4.07Å; Y324-L332 HydrophobicContact CD2-CD1 4.23Å; Y324-L332 HydrophobicContact CE1-CD2 4.47Å; Y324-L332 HydrophobicContact CG-CD1 3.7Å; Y324-E364 CarbonylContact O-C 3.46Å; Y324-E364 WeakPolarHBondContact O-CA 3.4Å; Y324-Y365 WeakPolarHBondContact CB-O 3.44Å; Y324-Y365 PolarHBondContact N-O 2.73Å; Y324-Y365 PolarHBondContact O-N 2.77Å; Y324-P367 HydrophobicContact CD2-CG 4.09Å; Y324-P367 HydrophobicContact CE2-CG 3.75Å; Y324-V373 HydrophobicContact CE2-CG2 4.08Å
325	V	91.7	Very high	91.6	Very high	83 Å²	83	61.7 Å²	61.7	50%	0.503	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	103.1	174.6	-174.7	0	0	0	0	108.4	V323 E364	V323-V325 PolarHBondContact O-N 3.19Å; V323-V325 VanDerWaalsContact O-N 3.09Å; V325-E364 HydrophobicContact CG2-CG 4.32Å
326	L	92	Very high	91.5	Very high	6 Å²	6	55.4 Å²	55.4	3%	0.031	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	126.4	-177	-56.3	175.6	0	0	0	110.4	Q330 L332 I359 P362 L363	L326-Q330 HydrophobicContact CB-CB 4.39Å; L326-Q330 HydrophobicContact CD2-CB 4.22Å; L326-L332 HydrophobicContact CD1-CD1 3.98Å; L326-L332 HydrophobicContact CD1-CG 3.82Å; L326-L332 HydrophobicContact CD2-CD1 4Å; L326-L332 HydrophobicContact CD2-CD2 3.93Å; L326-L332 HydrophobicContact CD2-CG 3.62Å; L326-L332 HydrophobicContact CG-CD1 4.36Å; L326-L332 HydrophobicContact CG-CG 4.28Å; L326-I359 HydrophobicContact CD1-CD1 3.91Å; L326-I359 HydrophobicContact CD1-CG1 4.16Å; L326-P362 VanDerWaalsContact O-CA 3.26Å; L326-P362 WeakPolarHBondContact O-CA 3.41Å; L326-L363 HydrophobicContact CD1-CD1 4.16Å; L326-L363 PolarHBondContact N-O 2.85Å; L326-L363 PolarHBondContact O-N 2.8Å
327	S	90.7	Very high	91.2	Very high	67 Å²	67	57.5 Å²	57.5	47%	0.469	29%	0.292	S	S	.	.			trans	-75.5	167.6	168.1	-53.7	0	0	0	0	111.4	Q329 Q330 G361	S327-Q329 PolarHBondContact O-N 2.92Å; S327-Q330 VanDerWaalsContact CB-OE1 3.28Å; S327-Q330 VanDerWaalsContact N-OE1 3.07Å; S327-Q330 PolarHBondContact O-N 2.86Å; S327-Q330 PolarHBondContact OG-OE1 3.42Å; S327-G361 WeakPolarHBondContact O-CA 3.24Å
328	E	88.3	Confident	91	Very high	155 Å²	155	58.8 Å²	58.8	72%	0.724	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-26.8	174.6	-62.6	-177.2	173.7	0	0	113.7	P362	E328-P362 HydrophobicContact CG-CB 4.16Å; E328-P362 HydrophobicContact CG-CG 3.93Å
329	Q	89.5	Confident	90.8	Very high	115 Å²	115	56.6 Å²	56.6	54%	0.537	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	1.6	180	-61.8	-179.2	2.4	0	0	113.5	S327 A379 M407	S327-Q329 PolarHBondContact O-N 2.92Å; Q329-A379 HydrophobicContact CB-CB 4.12Å; Q329-A379 WeakPolarHBondContact O-CB 3.48Å; Q329-A379 PolarHBondContact O-N 3.42Å; Q329-M407 VanDerWaalsContact C-CE 3.48Å; Q329-M407 VanDerWaalsContact O-CE 3.27Å; Q329-M407 WeakPolarHBondContact O-CE 3.35Å
330	Q	91.4	Very high	90.4	Very high	39 Å²	39	56.2 Å²	56.2	18%	0.182	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	151.2	178.4	-73.1	170.5	-60.6	0	0	110.5	L326 S327 G361 E376 R377	L326-Q330 HydrophobicContact CB-CB 4.39Å; L326-Q330 HydrophobicContact CD2-CB 4.22Å; S327-Q330 VanDerWaalsContact CB-OE1 3.28Å; S327-Q330 VanDerWaalsContact N-OE1 3.07Å; S327-Q330 PolarHBondContact O-N 2.86Å; S327-Q330 PolarHBondContact OG-OE1 3.42Å; Q330-G361 PolarHBondContact O-N 2.81Å; Q330-E376 PolarHBondContact NE2-OE1 3.16Å; Q330-R377 CarbonylContact C-O 3.6Å; Q330-R377 WeakPolarHBondContact CA-O 3.28Å
331	G	91.6	Very high	89.7	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	161.2	172.9	0	0	0	0	0	111.1	I359 R377	G331-I359 CarbonylContact C-O 3.55Å; G331-I359 WeakPolarHBondContact CA-O 3.49Å; G331-R377 PolarHBondContact N-O 2.62Å; G331-R377 PolarHBondContact O-N 3.32Å
332	L	92.6	Very high	88.6	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	129	175.5	-61.3	174.6	0	0	0	109.5	Y324 L326 L334 L358 I359 Y365 V373 E376	Y324-L332 HydrophobicContact CD1-CD1 3.96Å; Y324-L332 HydrophobicContact CD1-CD2 4.07Å; Y324-L332 HydrophobicContact CD2-CD1 4.23Å; Y324-L332 HydrophobicContact CE1-CD2 4.47Å; Y324-L332 HydrophobicContact CG-CD1 3.7Å; L326-L332 HydrophobicContact CD1-CD1 3.98Å; L326-L332 HydrophobicContact CD1-CG 3.82Å; L326-L332 HydrophobicContact CD2-CD1 4Å; L326-L332 HydrophobicContact CD2-CD2 3.93Å; L326-L332 HydrophobicContact CD2-CG 3.62Å; L326-L332 HydrophobicContact CG-CD1 4.36Å; L326-L332 HydrophobicContact CG-CG 4.28Å; L332-L334 HydrophobicContact CB-CD2 4.04Å; L332-L334 HydrophobicContact CB-CG 4.42Å; L332-L358 WeakPolarHBondContact O-CA 3.47Å; L332-L358 WeakPolarHBondContact O-CD1 3.49Å; L332-I359 HydrophobicContact CB-CD1 4.04Å; L332-I359 HydrophobicContact CB-CG1 3.76Å; L332-I359 HydrophobicContact CD1-CD1 4.1Å; L332-I359 HydrophobicContact CG-CD1 4.42Å; L332-I359 PolarHBondContact N-O 3.37Å; L332-I359 PolarHBondContact O-N 3.13Å; L332-Y365 HydrophobicContact CD1-CD1 3.84Å; L332-Y365 HydrophobicContact CD1-CG 4.4Å; L332-V373 HydrophobicContact CB-CG1 4.39Å; L332-V373 HydrophobicContact CD2-CG1 3.99Å; L332-E376 HydrophobicContact CD2-CB 3.98Å; L332-E376 HydrophobicContact CD2-CG 3.91Å
333	L	91.9	Very high	87	Confident	10 Å²	10	56.4 Å²	56.4	5%	0.052	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	115.8	166.7	-173.1	68.7	0	0	0	108.3	H356 V374 E375 Q410	L333-H356 HydrophobicContact CD1-CB 4.43Å; L333-V374 HydrophobicContact CD2-CB 4.25Å; L333-V374 HydrophobicContact CD2-CG1 4.17Å; L333-V374 HydrophobicContact CG-CB 4.36Å; L333-V374 PolarHBondContact O-N 2.65Å; L333-E375 HydrophobicContact CB-CB 4.07Å; L333-E375 HydrophobicContact CD2-CB 4.28Å; L333-E375 PolarHBondContact N-O 3.17Å; L333-E375 PolarHBondContact O-N 3.01Å; L333-Q410 HydrophobicContact CD1-CB 4.06Å
334	L	91.9	Very high	85.1	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	147.9	-177.2	-59.2	178.1	0	0	0	110.1	L332 H356 W357 I359 Y365 V371 E372 V373	L332-L334 HydrophobicContact CB-CD2 4.04Å; L332-L334 HydrophobicContact CB-CG 4.42Å; L334-H356 VanDerWaalsContact O-CA 3.24Å; L334-H356 WeakPolarHBondContact O-CA 3.27Å; L334-W357 HydrophobicContact CB-CD2 3.98Å; L334-W357 HydrophobicContact CB-CE3 4.37Å; L334-W357 HydrophobicContact CB-CH2 4.13Å; L334-W357 HydrophobicContact CB-CZ2 3.72Å; L334-W357 HydrophobicContact CB-CZ3 4.45Å; L334-W357 HydrophobicContact CD1-CZ2 3.93Å; L334-W357 PolarHBondContact N-O 3.4Å; L334-W357 PolarHBondContact O-N 3.02Å; L334-W357 VanDerWaalsContact O-N 3.08Å; L334-I359 HydrophobicContact CD1-CD1 3.82Å; L334-I359 HydrophobicContact CD1-CG1 3.88Å; L334-I359 HydrophobicContact CD1-CG2 3.88Å; L334-I359 HydrophobicContact CG-CD1 4.47Å; L334-I359 HydrophobicContact CG-CG1 4.29Å; L334-Y365 HydrophobicContact CD1-CE1 3.74Å; L334-Y365 HydrophobicContact CD1-CE2 4.13Å; L334-Y365 VanDerWaalsContact CD1-CZ 3.48Å; L334-Y365 WeakPolarHBondContact CD1-OH 3.49Å; L334-Y365 HydrophobicContact CD2-CD1 4.38Å; L334-Y365 HydrophobicContact CD2-CE1 3.66Å; L334-Y365 HydrophobicContact CG-CE1 4.37Å; L334-V371 HydrophobicContact CB-CG1 3.83Å; L334-V371 HydrophobicContact CD1-CG1 4.24Å; L334-V371 HydrophobicContact CD2-CG1 3.94Å; L334-V371 HydrophobicContact CG-CG1 4.21Å; L334-E372 WeakPolarHBondContact CA-O 3.4Å; L334-V373 HydrophobicContact CD2-CB 4.41Å; L334-V373 HydrophobicContact CD2-CG2 3.86Å
335	R	90.8	Very high	83.3	Confident	87 Å²	87	68 Å²	68	33%	0.328	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	130.1	173	178.7	174.2	73.7	-178.6	2.7	110.3	D355 V371 E372 V374	R335-D355 WeakPolarHBondContact CA-O 3.25Å; R335-V371 WeakPolarHBondContact O-CA 3.37Å; R335-E372 IonicContact CZ-OE2 2.86Å; R335-E372 PolarHBondContact N-O 2.91Å; R335-E372 IonicContact NE-OE2 3.97Å; R335-E372 PolarHBondContact NE-OE2 3.19Å; R335-E372 VanDerWaalsContact NH2-CD 3.34Å; R335-E372 IonicContact NH2-OE1 2.8Å; R335-E372 PolarHBondContact NH2-OE1 2.87Å; R335-E372 IonicContact NH2-OE2 3.79Å; R335-E372 PolarHBondContact NH2-OE2 2.85Å; R335-E372 PolarHBondContact O-N 3.34Å; R335-V374 HydrophobicContact CB-CG2 3.45Å; R335-V374 VanDerWaalsContact CB-CG2 3.45Å
336	A	90.1	Very high	80.8	Confident	1 Å²	1	73.6 Å²	73.6	1%	0.008	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	122.9	174.2	0	0	0	0	0	110.2	L340 H351 Q352 G354 D355 W357	A336-L340 HydrophobicContact CB-CD2 4.09Å; A336-H351 HydrophobicContact CB-CB 4.14Å; A336-Q352 VanDerWaalsContact CB-O 3.26Å; A336-Q352 WeakPolarHBondContact CB-O 2.95Å; A336-G354 PolarHBondContact O-N 3.33Å; A336-D355 PolarHBondContact N-O 3Å; A336-W357 HydrophobicContact CB-CH2 3.86Å; A336-W357 HydrophobicContact CB-CZ3 3.58Å; A336-W357 VanDerWaalsContact N-CZ3 3.31Å
337	L	87.8	Confident	79	Confident	89 Å²	89	81.3 Å²	81.3	47%	0.466	41%	0.412	S	S	.	.	S	Bend	trans	-82.5	-29.7	171	-61.6	176	0	0	0	111.7	K370 E372	L337-K370 WeakPolarHBondContact CB-O 3.42Å; L337-K370 PolarHBondContact N-O 2.85Å; L337-E372 HydrophobicContact CD1-CB 4.43Å; L337-E372 HydrophobicContact CD2-CB 4.44Å; L337-E372 HydrophobicContact CG-CB 4.36Å
338	Q	86	Confident	78	Confident	105 Å²	105	84.2 Å²	84.2	49%	0.491	42%	0.416	S	S	.	.	S	Bend	trans	-138.8	157	-179.6	-70	-177.9	2.4	0	0	109.3	L340 K370	Q338-L340 PolarHBondContact O-N 2.83Å; Q338-K370 HydrophobicContact CB-CB 4.2Å; Q338-K370 HydrophobicContact CB-CD 4Å; Q338-K370 HydrophobicContact CB-CG 4.06Å
339	P	86.9	Confident	77.6	Confident	91 Å²	91	80.7 Å²	80.7	59%	0.591	41%	0.405	S	S	*	.			trans	-58.3	128.9	173.1	25.2	-33.7	0	0	0	110.1	H351	P339-H351 WeakPolarHBondContact CA-O 2.96Å
340	L	84.1	Confident	77.3	Confident	19 Å²	19	79.4 Å²	79.4	10%	0.099	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	152.6	-178.4	68.6	93.4	0	0	0	110.2	A336 Q338 E342 H351 W357 K370 V371	A336-L340 HydrophobicContact CB-CD2 4.09Å; Q338-L340 PolarHBondContact O-N 2.83Å; L340-E342 HydrophobicContact CD1-CB 3.69Å; L340-H351 HydrophobicContact CD1-CB 4.44Å; L340-H351 HydrophobicContact CG-CB 4.36Å; L340-H351 PolarHBondContact N-O 2.95Å; L340-H351 PolarHBondContact O-N 3.36Å; L340-W357 HydrophobicContact CD2-CH2 4.34Å; L340-K370 HydrophobicContact CB-CD 4.12Å; L340-K370 HydrophobicContact CD2-CB 3.81Å; L340-V371 HydrophobicContact CD1-CG2 4.44Å; L340-V371 HydrophobicContact CD2-CG2 3.37Å
341	E	79	Confident	77	Confident	141 Å²	141	78.6 Å²	78.6	66%	0.659	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.5	120.1	170.2	-64.4	176.4	-178.3	0	0	106.4	V349	E341-V349 WeakPolarHBondContact CA-O 3.45Å
342	E	67.3	Low	76.8	Confident	45 Å²	45	85.3 Å²	85.3	21%	0.21	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	133.3	179	-158.9	171.1	-145.3	0	0	109.2	L340 V349 W357 Y365	L340-E342 HydrophobicContact CD1-CB 3.69Å; E342-V349 PolarHBondContact N-O 3.06Å; E342-V349 PolarHBondContact O-N 2.69Å; E342-W357 VanDerWaalsContact OE2-CZ2 3.23Å; E342-W357 WeakPolarHBondContact OE2-CZ2 3.44Å; E342-W357 PolarHBondContact OE2-NE1 2.77Å; E342-Y365 VanDerWaalsContact OE1-CE2 3.24Å; E342-Y365 WeakPolarHBondContact OE1-CE2 3.48Å; E342-Y365 PolarHBondContact OE1-OH 2.94Å
343	G	60.4	Low	76.6	Confident	46 Å²	46	88.3 Å²	88.3	47%	0.474	46%	0.461	S	S	.	.	S	Bend	trans	144.2	150.2	-178	0	0	0	0	0	113
344	E	51.8	Low	76.2	Confident	185 Å²	185	89.8 Å²	89.8	86%	0.864	48%	0.478	S	S	*	.	S	Bend	trans	-89	131.7	167.8	-68.5	-174.5	165.7	0	0	109	E346	E344-E346 PolarHBondContact O-N 3.04Å
345	D	52.6	Low	76.1	Confident	144 Å²	144	92.7 Å²	92.7	77%	0.77	49%	0.494	S	S	*	.	G	3₁₀ helix	trans	47.7	-118.5	179.4	-66.5	-33.5	0	0	0	116.9	E347	D345-E347 VanDerWaalsContact C-N 3.33Å; D345-E347 PolarHBondContact O-N 3.06Å
346	E	39.4	Very low	76	Confident	201 Å²	201	92 Å²	92	94%	0.939	49%	0.494	S	S	*	.	G	3₁₀ helix	trans	-77.5	-7.4	-161.7	-64.7	-174.5	165	0	0	114.8	E344	E344-E346 PolarHBondContact O-N 3.04Å
347	E	55.7	Low	76	Confident	167 Å²	167	92.8 Å²	92.8	78%	0.78	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-112	43.4	-180	-64.1	-172.9	169.5	0	0	112.7	D345 V349	D345-E347 VanDerWaalsContact C-N 3.33Å; D345-E347 PolarHBondContact O-N 3.06Å; E347-V349 PolarHBondContact O-N 2.94Å; E347-V349 VanDerWaalsContact O-N 3.15Å
348	K	69.9	Low	76.2	Confident	128 Å²	128	89.8 Å²	89.8	56%	0.557	48%	0.482	S	S	*	.			trans	-68.3	112	172.8	-72.7	176.7	-172.5	-178.7	0	110.5
349	V	78.3	Confident	76.4	Confident	81 Å²	81	86 Å²	86	49%	0.491	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	120.5	172.1	-173.4	0	0	0	0	107.8	E341 E342 E347 H351	E341-V349 WeakPolarHBondContact CA-O 3.45Å; E342-V349 PolarHBondContact N-O 3.06Å; E342-V349 PolarHBondContact O-N 2.69Å; E347-V349 PolarHBondContact O-N 2.94Å; E347-V349 VanDerWaalsContact O-N 3.15Å; V349-H351 WeakPolarHBondContact CG1-NE2 3.5Å; V349-H351 PolarHBondContact O-CD2 2.85Å
350	S	83.6	Confident	76.5	Confident	88 Å²	88	88 Å²	88	62%	0.615	46%	0.46	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.4	122.2	174.8	65.2	0	0	0	0	109.8
351	H	84.9	Confident	76.7	Confident	22 Å²	22	87.9 Å²	87.9	10%	0.102	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	132.2	174.7	-63.2	-76.5	0	0	0	109.9	A336 P339 L340 V349 D355 W357	A336-H351 HydrophobicContact CB-CB 4.14Å; P339-H351 WeakPolarHBondContact CA-O 2.96Å; L340-H351 HydrophobicContact CD1-CB 4.44Å; L340-H351 HydrophobicContact CG-CB 4.36Å; L340-H351 PolarHBondContact N-O 2.95Å; L340-H351 PolarHBondContact O-N 3.36Å; V349-H351 WeakPolarHBondContact CG1-NE2 3.5Å; V349-H351 PolarHBondContact O-CD2 2.85Å; H351-D355 HydrophobicContact CB-CB 4.47Å; H351-W357 HydrophobicContact CB-CE3 4.35Å; H351-W357 HydrophobicContact CB-CH2 4.31Å; H351-W357 HydrophobicContact CB-CZ3 3.96Å; H351-W357 AromaticContact CD2-CE2 3.98Å; H351-W357 AromaticContact CE1-CD1 3.84Å; H351-W357 AromaticContact CE1-CD2 3.38Å; H351-W357 AromaticContact CE1-CE2 3.86Å; H351-W357 AromaticContact CE1-CE3 3.7Å; H351-W357 AromaticContact CE1-CG 3.42Å; H351-W357 VanDerWaalsContact CE1-CG 3.42Å; H351-W357 AromaticContact CG-CE3 3.76Å; H351-W357 AromaticContact CG-CZ3 3.77Å; H351-W357 AromaticContact ND1-CD2 3.59Å; H351-W357 AromaticContact ND1-CE3 3.38Å; H351-W357 AromaticContact ND1-CZ3 3.88Å; H351-W357 AromaticContact NE2-CD1 3.95Å; H351-W357 AromaticContact NE2-CD2 3.75Å; H351-W357 AromaticContact NE2-CE2 3.72Å; H351-W357 AromaticContact NE2-CG 3.94Å; H351-W357 AromaticContact NE2-NE1 3.79Å
352	Q	87.9	Confident	77.3	Confident	141 Å²	141	85.8 Å²	85.8	66%	0.659	46%	0.462	S	S	*	.			trans	-81.4	161.7	171.4	-56.3	-172.1	-0.6	0	0	110.4	A336 G354 D355	A336-Q352 VanDerWaalsContact CB-O 3.26Å; A336-Q352 WeakPolarHBondContact CB-O 2.95Å; Q352-G354 PolarHBondContact O-N 3.14Å; Q352-D355 WeakPolarHBondContact CA-OD2 3.32Å; Q352-D355 VanDerWaalsContact CB-OD2 3.31Å; Q352-D355 WeakPolarHBondContact CB-OD2 3.48Å; Q352-D355 PolarHBondContact N-OD2 2.93Å; Q352-D355 WeakPolarHBondContact O-CB 3.33Å; Q352-D355 PolarHBondContact O-N 3.49Å; Q352-D355 VanDerWaalsContact O-N 3.11Å
353	A	87.6	Confident	78.4	Confident	63 Å²	63	87 Å²	87	52%	0.521	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	126	176	0	0	0	0	0	110.5
354	G	85.4	Confident	79.8	Confident	41 Å²	41	90 Å²	90	42%	0.423	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.4	-5.9	-176.7	0	0	0	0	0	114.8	A336 Q352 H356	A336-G354 PolarHBondContact O-N 3.33Å; Q352-G354 PolarHBondContact O-N 3.14Å; G354-H356 PolarHBondContact O-CE1 2.89Å; G354-H356 VanDerWaalsContact O-CE1 3.25Å; G354-H356 PolarHBondContact O-ND1 2.91Å
355	D	88.2	Confident	81.7	Confident	61 Å²	61	82.2 Å²	82.2	33%	0.326	43%	0.434	S	S	.	.			trans	-68.2	142.4	176.9	-72.1	-11	0	0	0	110.9	R335 A336 H351 Q352 W357	R335-D355 WeakPolarHBondContact CA-O 3.25Å; A336-D355 PolarHBondContact N-O 3Å; H351-D355 HydrophobicContact CB-CB 4.47Å; Q352-D355 WeakPolarHBondContact CA-OD2 3.32Å; Q352-D355 VanDerWaalsContact CB-OD2 3.31Å; Q352-D355 WeakPolarHBondContact CB-OD2 3.48Å; Q352-D355 PolarHBondContact N-OD2 2.93Å; Q352-D355 WeakPolarHBondContact O-CB 3.33Å; Q352-D355 PolarHBondContact O-N 3.49Å; Q352-D355 VanDerWaalsContact O-N 3.11Å; D355-W357 WeakPolarHBondContact O-CZ3 3.44Å
356	H	88.6	Confident	83.5	Confident	73 Å²	73	76.6 Å²	76.6	34%	0.338	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	134.9	175.8	-61	70.9	0	0	0	109.7	L333 L334 G354 Q410	L333-H356 HydrophobicContact CD1-CB 4.43Å; L334-H356 VanDerWaalsContact O-CA 3.24Å; L334-H356 WeakPolarHBondContact O-CA 3.27Å; G354-H356 PolarHBondContact O-CE1 2.89Å; G354-H356 VanDerWaalsContact O-CE1 3.25Å; G354-H356 PolarHBondContact O-ND1 2.91Å; H356-Q410 PolarHBondContact O-OE1 2.92Å
357	W	90.5	Very high	85.9	Confident	17 Å²	17	67.7 Å²	67.7	6%	0.064	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	159.2	173.1	68.6	106.9	0	0	0	111.4	L334 A336 L340 E342 H351 D355 V371	L334-W357 HydrophobicContact CB-CD2 3.98Å; L334-W357 HydrophobicContact CB-CE3 4.37Å; L334-W357 HydrophobicContact CB-CH2 4.13Å; L334-W357 HydrophobicContact CB-CZ2 3.72Å; L334-W357 HydrophobicContact CB-CZ3 4.45Å; L334-W357 HydrophobicContact CD1-CZ2 3.93Å; L334-W357 PolarHBondContact N-O 3.4Å; L334-W357 PolarHBondContact O-N 3.02Å; L334-W357 VanDerWaalsContact O-N 3.08Å; A336-W357 HydrophobicContact CB-CH2 3.86Å; A336-W357 HydrophobicContact CB-CZ3 3.58Å; A336-W357 VanDerWaalsContact N-CZ3 3.31Å; L340-W357 HydrophobicContact CD2-CH2 4.34Å; E342-W357 VanDerWaalsContact OE2-CZ2 3.23Å; E342-W357 WeakPolarHBondContact OE2-CZ2 3.44Å; E342-W357 PolarHBondContact OE2-NE1 2.77Å; H351-W357 HydrophobicContact CB-CE3 4.35Å; H351-W357 HydrophobicContact CB-CH2 4.31Å; H351-W357 HydrophobicContact CB-CZ3 3.96Å; H351-W357 AromaticContact CD2-CE2 3.98Å; H351-W357 AromaticContact CE1-CD1 3.84Å; H351-W357 AromaticContact CE1-CD2 3.38Å; H351-W357 AromaticContact CE1-CE2 3.86Å; H351-W357 AromaticContact CE1-CE3 3.7Å; H351-W357 AromaticContact CE1-CG 3.42Å; H351-W357 VanDerWaalsContact CE1-CG 3.42Å; H351-W357 AromaticContact CG-CE3 3.76Å; H351-W357 AromaticContact CG-CZ3 3.77Å; H351-W357 AromaticContact ND1-CD2 3.59Å; H351-W357 AromaticContact ND1-CE3 3.38Å; H351-W357 AromaticContact ND1-CZ3 3.88Å; H351-W357 AromaticContact NE2-CD1 3.95Å; H351-W357 AromaticContact NE2-CD2 3.75Å; H351-W357 AromaticContact NE2-CE2 3.72Å; H351-W357 AromaticContact NE2-CG 3.94Å; H351-W357 AromaticContact NE2-NE1 3.79Å; D355-W357 WeakPolarHBondContact O-CZ3 3.44Å; W357-V371 HydrophobicContact CH2-CG1 4.09Å; W357-V371 HydrophobicContact CH2-CG2 4.05Å; W357-V371 HydrophobicContact CZ2-CG1 4.09Å; W357-V371 HydrophobicContact CZ2-CG2 4.14Å
358	L	91.4	Very high	87.5	Confident	27 Å²	27	62.5 Å²	62.5	14%	0.141	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	122.3	-179	176.5	69.6	0	0	0	109.4	L332 R360 R377 M407 L408 Q410	L332-L358 WeakPolarHBondContact O-CA 3.47Å; L332-L358 WeakPolarHBondContact O-CD1 3.49Å; L358-R360 HydrophobicContact CD2-CG 4.34Å; L358-R360 HydrophobicContact CG-CG 4.32Å; L358-R377 HydrophobicContact CD1-CB 4.49Å; L358-M407 HydrophobicContact CD2-CG 4.35Å; L358-M407 HydrophobicContact CD2-SD 3.95Å; L358-L408 WeakPolarHBondContact CD2-O 3.23Å; L358-Q410 HydrophobicContact CB-CB 4.16Å
359	I	90.9	Very high	88.3	Confident	25 Å²	25	58.2 Å²	58.2	13%	0.128	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	143.2	165.5	57.3	165.6	0	0	0	109.6	L326 G331 L332 L334 L363 Y365	L326-I359 HydrophobicContact CD1-CD1 3.91Å; L326-I359 HydrophobicContact CD1-CG1 4.16Å; G331-I359 CarbonylContact C-O 3.55Å; G331-I359 WeakPolarHBondContact CA-O 3.49Å; L332-I359 HydrophobicContact CB-CD1 4.04Å; L332-I359 HydrophobicContact CB-CG1 3.76Å; L332-I359 HydrophobicContact CD1-CD1 4.1Å; L332-I359 HydrophobicContact CG-CD1 4.42Å; L332-I359 PolarHBondContact N-O 3.37Å; L332-I359 PolarHBondContact O-N 3.13Å; L334-I359 HydrophobicContact CD1-CD1 3.82Å; L334-I359 HydrophobicContact CD1-CG1 3.88Å; L334-I359 HydrophobicContact CD1-CG2 3.88Å; L334-I359 HydrophobicContact CG-CD1 4.47Å; L334-I359 HydrophobicContact CG-CG1 4.29Å; I359-L363 HydrophobicContact CD1-CD1 4.44Å; I359-Y365 HydrophobicContact CD1-CD1 3.66Å; I359-Y365 HydrophobicContact CD1-CD2 3.43Å; I359-Y365 VanDerWaalsContact CD1-CD2 3.43Å; I359-Y365 HydrophobicContact CD1-CE1 4.1Å; I359-Y365 HydrophobicContact CD1-CE2 3.9Å; I359-Y365 HydrophobicContact CD1-CG 3.3Å
360	R	89.9	Confident	88.8	Confident	134 Å²	134	58.3 Å²	58.3	51%	0.506	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	144.8	-179.2	-62.6	-177.2	177.2	172	-2.1	109.7	L358 L363 M407	L358-R360 HydrophobicContact CD2-CG 4.34Å; L358-R360 HydrophobicContact CG-CG 4.32Å; R360-L363 VanDerWaalsContact O-CD2 3.27Å; R360-L363 WeakPolarHBondContact O-CD2 3.41Å; R360-M407 HydrophobicContact CG-SD 3.91Å
361	G	88.1	Confident	89.1	Confident	16 Å²	16	54.6 Å²	54.6	17%	0.165	30%	0.303	C	S	.	.	S	Bend	trans	-71	174.5	172.1	0	0	0	0	0	113.1	S327 Q330	S327-G361 WeakPolarHBondContact O-CA 3.24Å; Q330-G361 PolarHBondContact O-N 2.81Å
362	P	91.3	Very high	89.4	Confident	97 Å²	97	57.2 Å²	57.2	63%	0.63	32%	0.315	S	S	*	.	S	Bend	cis	-89.1	113.4	8.3	32.2	-27.4	0	0	0	112.2	L326 E328	L326-P362 VanDerWaalsContact O-CA 3.26Å; L326-P362 WeakPolarHBondContact O-CA 3.41Å; E328-P362 HydrophobicContact CG-CB 4.16Å; E328-P362 HydrophobicContact CG-CG 3.93Å
363	L	90.8	Very high	89.6	Confident	70 Å²	70	52.2 Å²	52.2	37%	0.366	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	160.3	176.6	66.3	85.7	0	0	0	112.1	L326 I359 R360 Y365	L326-L363 HydrophobicContact CD1-CD1 4.16Å; L326-L363 PolarHBondContact N-O 2.85Å; L326-L363 PolarHBondContact O-N 2.8Å; I359-L363 HydrophobicContact CD1-CD1 4.44Å; R360-L363 VanDerWaalsContact O-CD2 3.27Å; R360-L363 WeakPolarHBondContact O-CD2 3.41Å; L363-Y365 HydrophobicContact CD1-CD2 4.48Å
364	E	89.4	Confident	89.8	Confident	110 Å²	110	52.4 Å²	52.4	51%	0.514	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	124	170.6	-63.3	-174.3	-177.7	0	0	109.8	H279 V323 Y324 V325	H279-E364 IonicContact CE1-OE1 3.35Å; H279-E364 PolarHBondContact CE1-OE1 3.21Å; H279-E364 IonicContact ND1-OE1 3.75Å; H279-E364 PolarHBondContact ND1-OE1 3.36Å; H279-E364 IonicContact ND1-OE2 3.93Å; V323-E364 HydrophobicContact CG1-CB 3.99Å; Y324-E364 CarbonylContact O-C 3.46Å; Y324-E364 WeakPolarHBondContact O-CA 3.4Å; V325-E364 HydrophobicContact CG2-CG 4.32Å
365	Y	90.4	Very high	90	Very high	21 Å²	21	54.6 Å²	54.6	8%	0.082	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	131.1	-177.4	-170.3	-106.2	0	0	0	112.2	V323 Y324 L332 L334 E342 I359 L363 P367	V323-Y365 WeakPolarHBondContact CG1-O 3.38Å; Y324-Y365 WeakPolarHBondContact CB-O 3.44Å; Y324-Y365 PolarHBondContact N-O 2.73Å; Y324-Y365 PolarHBondContact O-N 2.77Å; L332-Y365 HydrophobicContact CD1-CD1 3.84Å; L332-Y365 HydrophobicContact CD1-CG 4.4Å; L334-Y365 HydrophobicContact CD1-CE1 3.74Å; L334-Y365 HydrophobicContact CD1-CE2 4.13Å; L334-Y365 VanDerWaalsContact CD1-CZ 3.48Å; L334-Y365 WeakPolarHBondContact CD1-OH 3.49Å; L334-Y365 HydrophobicContact CD2-CD1 4.38Å; L334-Y365 HydrophobicContact CD2-CE1 3.66Å; L334-Y365 HydrophobicContact CG-CE1 4.37Å; E342-Y365 VanDerWaalsContact OE1-CE2 3.24Å; E342-Y365 WeakPolarHBondContact OE1-CE2 3.48Å; E342-Y365 PolarHBondContact OE1-OH 2.94Å; I359-Y365 HydrophobicContact CD1-CD1 3.66Å; I359-Y365 HydrophobicContact CD1-CD2 3.43Å; I359-Y365 VanDerWaalsContact CD1-CD2 3.43Å; I359-Y365 HydrophobicContact CD1-CE1 4.1Å; I359-Y365 HydrophobicContact CD1-CE2 3.9Å; I359-Y365 HydrophobicContact CD1-CG 3.3Å; L363-Y365 HydrophobicContact CD1-CD2 4.48Å; Y365-P367 HydrophobicContact CD1-CG 4.25Å; Y365-P367 HydrophobicContact CE1-CB 4.22Å; Y365-P367 HydrophobicContact CE1-CG 4.02Å
366	V	90.7	Very high	90.2	Very high	26 Å²	26	57 Å²	57	16%	0.158	30%	0.297	C	S	.	.			trans	-117.7	115.6	170.6	179.8	0	0	0	0	108.1	Y281 V301 K303 V323 S368	Y281-V366 HydrophobicContact CD1-CG1 4.24Å; Y281-V366 HydrophobicContact CD1-CG2 4.44Å; Y281-V366 HydrophobicContact CD2-CG1 3.55Å; Y281-V366 HydrophobicContact CE2-CG1 4.05Å; Y281-V366 HydrophobicContact CG-CG1 3.64Å; Y281-V366 HydrophobicContact CG-CG2 4.41Å; V301-V366 HydrophobicContact CG1-CG1 3.71Å; K303-V366 HydrophobicContact CB-CG1 4.27Å; K303-V366 HydrophobicContact CB-CG2 4.26Å; K303-V366 HydrophobicContact CD-CB 4.09Å; K303-V366 HydrophobicContact CD-CG1 4.3Å; K303-V366 HydrophobicContact CD-CG2 4.09Å; V323-V366 HydrophobicContact CB-CG2 4.27Å; V323-V366 HydrophobicContact CG1-CG2 3.7Å; V323-V366 HydrophobicContact CG2-CG2 3.72Å; V366-S368 PolarHBondContact O-N 2.9Å
367	P	89.8	Confident	90.4	Very high	13 Å²	13	54.4 Å²	54.4	8%	0.084	28%	0.284	C	S	.	.			trans	-57	130.7	178	-24.2	33.8	0	0	0	111.3	Y324 Y365 V373	Y324-P367 HydrophobicContact CD2-CG 4.09Å; Y324-P367 HydrophobicContact CE2-CG 3.75Å; Y365-P367 HydrophobicContact CD1-CG 4.25Å; Y365-P367 HydrophobicContact CE1-CB 4.22Å; Y365-P367 HydrophobicContact CE1-CG 4.02Å; P367-V373 HydrophobicContact CB-CG2 4.22Å; P367-V373 HydrophobicContact CG-CG2 3.5Å
368	S	89.1	Confident	90.4	Very high	58 Å²	58	60 Å²	60	41%	0.406	31%	0.311	S	S	.	.			trans	-69.8	159.1	170.5	-177.9	0	0	0	0	110.5	V366 K370 V371	V366-S368 PolarHBondContact O-N 2.9Å; S368-K370 PolarHBondContact O-N 2.77Å; S368-V371 PolarHBondContact O-N 2.94Å; S368-V371 VanDerWaalsContact O-O 3.13Å
369	A	87.1	Confident	90.3	Very high	39 Å²	39	59.3 Å²	59.3	32%	0.322	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-20.7	177.5	0	0	0	0	0	113.9	K299 V301	K299-A369 HydrophobicContact CB-CB 4.04Å; V301-A369 HydrophobicContact CG2-CB 4.08Å
370	K	88.6	Confident	90.3	Very high	82 Å²	82	59.9 Å²	59.9	36%	0.357	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-2.8	-179.5	-61.7	-180	175.8	-176.6	0	113.6	L337 Q338 L340 S368	L337-K370 WeakPolarHBondContact CB-O 3.42Å; L337-K370 PolarHBondContact N-O 2.85Å; Q338-K370 HydrophobicContact CB-CB 4.2Å; Q338-K370 HydrophobicContact CB-CD 4Å; Q338-K370 HydrophobicContact CB-CG 4.06Å; L340-K370 HydrophobicContact CB-CD 4.12Å; L340-K370 HydrophobicContact CD2-CB 3.81Å; S368-K370 PolarHBondContact O-N 2.77Å
371	V	90.3	Very high	90.3	Very high	10 Å²	10	57.9 Å²	57.9	6%	0.061	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	139.7	-175.5	-177.2	0	0	0	0	108.9	L334 R335 L340 W357 S368	L334-V371 HydrophobicContact CB-CG1 3.83Å; L334-V371 HydrophobicContact CD1-CG1 4.24Å; L334-V371 HydrophobicContact CD2-CG1 3.94Å; L334-V371 HydrophobicContact CG-CG1 4.21Å; R335-V371 WeakPolarHBondContact O-CA 3.37Å; L340-V371 HydrophobicContact CD1-CG2 4.44Å; L340-V371 HydrophobicContact CD2-CG2 3.37Å; W357-V371 HydrophobicContact CH2-CG1 4.09Å; W357-V371 HydrophobicContact CH2-CG2 4.05Å; W357-V371 HydrophobicContact CZ2-CG1 4.09Å; W357-V371 HydrophobicContact CZ2-CG2 4.14Å; S368-V371 PolarHBondContact O-N 2.94Å; S368-V371 VanDerWaalsContact O-O 3.13Å
372	E	91.1	Very high	90.4	Very high	78 Å²	78	57.5 Å²	57.5	36%	0.364	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	136	171.8	-174.3	-179.3	177.2	0	0	109.7	L334 R335 L337 V374	L334-E372 WeakPolarHBondContact CA-O 3.4Å; R335-E372 IonicContact CZ-OE2 2.86Å; R335-E372 PolarHBondContact N-O 2.91Å; R335-E372 IonicContact NE-OE2 3.97Å; R335-E372 PolarHBondContact NE-OE2 3.19Å; R335-E372 VanDerWaalsContact NH2-CD 3.34Å; R335-E372 IonicContact NH2-OE1 2.8Å; R335-E372 PolarHBondContact NH2-OE1 2.87Å; R335-E372 IonicContact NH2-OE2 3.79Å; R335-E372 PolarHBondContact NH2-OE2 2.85Å; R335-E372 PolarHBondContact O-N 3.34Å; L337-E372 HydrophobicContact CD1-CB 4.43Å; L337-E372 HydrophobicContact CD2-CB 4.44Å; L337-E372 HydrophobicContact CG-CB 4.36Å; E372-V374 PolarHBondContact O-N 3.36Å
373	V	92.7	Very high	90.1	Very high	36 Å²	36	58.3 Å²	58.3	22%	0.218	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	113.3	172.6	-173.7	0	0	0	0	107.8	Y324 L332 L334 P367	Y324-V373 HydrophobicContact CE2-CG2 4.08Å; L332-V373 HydrophobicContact CB-CG1 4.39Å; L332-V373 HydrophobicContact CD2-CG1 3.99Å; L334-V373 HydrophobicContact CD2-CB 4.41Å; L334-V373 HydrophobicContact CD2-CG2 3.86Å; P367-V373 HydrophobicContact CB-CG2 4.22Å; P367-V373 HydrophobicContact CG-CG2 3.5Å
374	V	91.8	Very high	89.8	Confident	67 Å²	67	62.9 Å²	62.9	41%	0.406	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	-45.9	-177.8	179.4	0	0	0	0	111	L333 R335 E372	L333-V374 HydrophobicContact CD2-CB 4.25Å; L333-V374 HydrophobicContact CD2-CG1 4.17Å; L333-V374 HydrophobicContact CG-CB 4.36Å; L333-V374 PolarHBondContact O-N 2.65Å; R335-V374 HydrophobicContact CB-CG2 3.45Å; R335-V374 VanDerWaalsContact CB-CG2 3.45Å; E372-V374 PolarHBondContact O-N 3.36Å
375	E	90.4	Very high	89.6	Confident	87 Å²	87	62.9 Å²	62.9	41%	0.407	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	133.9	-172.6	-171.1	-172.9	-171.1	0	0	110.1	L333 R377	L333-E375 HydrophobicContact CB-CB 4.07Å; L333-E375 HydrophobicContact CD2-CB 4.28Å; L333-E375 PolarHBondContact N-O 3.17Å; L333-E375 PolarHBondContact O-N 3.01Å; E375-R377 HydrophobicContact CG-CG 4.13Å; E375-R377 IonicContact OE2-CZ 2.61Å; E375-R377 IonicContact OE2-NE 2.71Å; E375-R377 PolarHBondContact OE2-NE 3.02Å; E375-R377 IonicContact OE2-NH2 2.96Å; E375-R377 PolarHBondContact OE2-NH2 3.02Å
376	E	92.1	Very high	89.3	Confident	112 Å²	112	65.3 Å²	65.3	52%	0.523	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	120.7	164.3	-174.7	180	168	0	0	108.9	Q330 L332	Q330-E376 PolarHBondContact NE2-OE1 3.16Å; L332-E376 HydrophobicContact CD2-CB 3.98Å; L332-E376 HydrophobicContact CD2-CG 3.91Å
377	R	91.1	Very high	89.3	Confident	17 Å²	17	64.2 Å²	64.2	6%	0.064	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	134.7	-176.9	-70.5	-172.6	171.1	-162.8	-2.2	110.9	Q330 G331 L358 E375 L408 T409 E412	Q330-R377 CarbonylContact C-O 3.6Å; Q330-R377 WeakPolarHBondContact CA-O 3.28Å; G331-R377 PolarHBondContact N-O 2.62Å; G331-R377 PolarHBondContact O-N 3.32Å; L358-R377 HydrophobicContact CD1-CB 4.49Å; E375-R377 HydrophobicContact CG-CG 4.13Å; E375-R377 IonicContact OE2-CZ 2.61Å; E375-R377 IonicContact OE2-NE 2.71Å; E375-R377 PolarHBondContact OE2-NE 3.02Å; E375-R377 IonicContact OE2-NH2 2.96Å; E375-R377 PolarHBondContact OE2-NH2 3.02Å; R377-L408 VanDerWaalsContact NH1-CB 3.29Å; R377-L408 PolarHBondContact NH1-O 3.01Å; R377-T409 PolarHBondContact NH1-O 2.79Å; R377-E412 PolarHBondContact NH1-O 3.08Å; R377-E412 PolarHBondContact NH2-O 3.5Å
378	Q	90.6	Very high	89.5	Confident	136 Å²	136	63.7 Å²	63.7	64%	0.636	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.2	139.6	172.4	-163.9	169.5	18.1	0	0	109.9	I380	Q378-I380 PolarHBondContact O-N 2.87Å
379	A	90.9	Very high	89.7	Confident	11 Å²	11	60.9 Å²	60.9	9%	0.091	32%	0.316	C	S	.	.			trans	-63.2	130.7	170.9	0	0	0	0	0	109.3	Q329 P381 T405 M407	Q329-A379 HydrophobicContact CB-CB 4.12Å; Q329-A379 WeakPolarHBondContact O-CB 3.48Å; Q329-A379 PolarHBondContact O-N 3.42Å; A379-P381 WeakPolarHBondContact O-CD 3.49Å; A379-T405 HydrophobicContact CB-CG2 3.87Å; A379-M407 HydrophobicContact CB-CB 4.11Å; A379-M407 HydrophobicContact CB-CE 4.03Å
380	I	90.6	Very high	90	Very high	38 Å²	38	59 Å²	59	20%	0.195	30%	0.3	C	S	.	.	B	Isolated β-bridge	trans	-89.2	115.6	-179.3	-58	166.4	0	0	0	106.9	Q378 L382 I388 T405 Y406 L408 L414	Q378-I380 PolarHBondContact O-N 2.87Å; I380-L382 HydrophobicContact CG2-CD2 3.9Å; I380-L382 HydrophobicContact CG2-CG 4.31Å; I380-L382 PolarHBondContact O-N 3.16Å; I380-I388 HydrophobicContact CD1-CD1 3.76Å; I380-I388 HydrophobicContact CG2-CG2 4.49Å; I380-T405 WeakPolarHBondContact O-CA 3.28Å; I380-Y406 PolarHBondContact N-O 2.8Å; I380-Y406 PolarHBondContact O-N 2.63Å; I380-L408 HydrophobicContact CD1-CD1 4.47Å; I380-L414 HydrophobicContact CD1-CD1 4.25Å; I380-L414 HydrophobicContact CD1-CD2 4.08Å
381	P	89.2	Confident	90.2	Very high	91 Å²	91	58 Å²	58	59%	0.591	30%	0.297	S	S	*	.			trans	-68.7	127	174.6	28.6	-32.8	0	0	0	109.1	A379	A379-P381 WeakPolarHBondContact O-CD 3.49Å
382	L	89.8	Confident	90.3	Very high	9 Å²	9	59 Å²	59	5%	0.047	30%	0.301	C	S	.	.			trans	-128	126	179.5	-58.9	170.9	0	0	0	108.8	I380 I388 S404	I380-L382 HydrophobicContact CG2-CD2 3.9Å; I380-L382 HydrophobicContact CG2-CG 4.31Å; I380-L382 PolarHBondContact O-N 3.16Å; L382-I388 HydrophobicContact CD1-CD1 4.26Å; L382-I388 HydrophobicContact CD1-CG1 3.96Å; L382-I388 HydrophobicContact CD2-CG2 3.99Å; L382-S404 WeakPolarHBondContact CD1-O 3.32Å
383	D	86.6	Confident	90.3	Very high	113 Å²	113	60.1 Å²	60.1	60%	0.604	31%	0.314	S	S	*	.			trans	-74.2	167.1	171.3	-69.8	-27.6	0	0	0	111.2	N385 E386 G403	D383-N385 PolarHBondContact O-N 3.42Å; D383-E386 HydrophobicContact CB-CB 4.38Å; D383-E386 HydrophobicContact CB-CG 4.12Å; D383-E386 PolarHBondContact O-N 3.35Å; D383-G403 WeakPolarHBondContact O-CA 3.24Å
384	E	84.2	Confident	90	Very high	167 Å²	167	65.2 Å²	65.2	78%	0.78	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	-34.7	-177.7	-67	-177.1	171.9	0	0	114.2
385	N	84	Confident	89.9	Confident	109 Å²	109	66.5 Å²	66.5	58%	0.583	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	1.8	-178.2	-66.4	-51.6	0	0	0	113.6	D383 L486	D383-N385 PolarHBondContact O-N 3.42Å; N385-L486 HydrophobicContact CB-CD2 4Å
386	E	85.6	Confident	89.8	Confident	72 Å²	72	64.2 Å²	64.2	34%	0.336	34%	0.341	S	S	.	.			trans	-105.6	157.2	179.1	-64	-164.2	146.3	0	0	111.2	D383 I402 G403 R456	D383-E386 HydrophobicContact CB-CB 4.38Å; D383-E386 HydrophobicContact CB-CG 4.12Å; D383-E386 PolarHBondContact O-N 3.35Å; E386-I402 VanDerWaalsContact O-CA 3.3Å; E386-I402 WeakPolarHBondContact O-CA 3.49Å; E386-G403 PolarHBondContact O-N 3.25Å; E386-R456 IonicContact OE1-NH1 2.78Å; E386-R456 PolarHBondContact OE1-NH1 2.82Å; E386-R456 IonicContact OE2-CZ 2.65Å; E386-R456 IonicContact OE2-NH1 3.98Å; E386-R456 PolarHBondContact OE2-NH1 2.89Å; E386-R456 IonicContact OE2-NH2 3.69Å
387	G	89.8	Confident	89.7	Confident	3 Å²	3	65 Å²	65	3%	0.031	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.2	172.9	176.5	0	0	0	0	0	113.4	V401 R456 V457	G387-V401 CarbonylContact C-O 3.53Å; G387-V401 WeakPolarHBondContact CA-O 3.47Å; G387-R456 CarbonylContact O-C 3.54Å; G387-R456 WeakPolarHBondContact O-CA 3.38Å; G387-V457 VanDerWaalsContact C-CG2 3.42Å; G387-V457 PolarHBondContact O-N 3.15Å
388	I	93.5	Very high	89.7	Confident	2 Å²	2	65 Å²	65	1%	0.01	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	151.3	175.6	54.3	177.5	0	0	0	110.4	I380 L382 V390 A400 V401 Y406 L414 T455 R456	I380-I388 HydrophobicContact CD1-CD1 3.76Å; I380-I388 HydrophobicContact CG2-CG2 4.49Å; L382-I388 HydrophobicContact CD1-CD1 4.26Å; L382-I388 HydrophobicContact CD1-CG1 3.96Å; L382-I388 HydrophobicContact CD2-CG2 3.99Å; I388-V390 HydrophobicContact CD1-CG1 3.95Å; I388-V390 HydrophobicContact CG1-CG1 4.03Å; I388-A400 WeakPolarHBondContact O-CA 3.49Å; I388-V401 HydrophobicContact CG1-CB 4.47Å; I388-V401 PolarHBondContact N-O 3Å; I388-V401 PolarHBondContact O-N 3Å; I388-Y406 HydrophobicContact CD1-CD1 4.25Å; I388-L414 HydrophobicContact CB-CD2 4Å; I388-L414 HydrophobicContact CD1-CD2 3.91Å; I388-L414 HydrophobicContact CG1-CD2 4.44Å; I388-L414 HydrophobicContact CG2-CD2 4.26Å; I388-T455 CarbonylContact C-O 3.56Å; I388-T455 WeakPolarHBondContact CA-O 3.38Å; I388-R456 HydrophobicContact CG2-CG 4.46Å
389	Y	93.6	Very high	89.7	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	126.3	167.2	-61.1	-66.8	0	0	0	109.6	R399 A400 W415 K417 T455 V457 V458 L489 P491	Y389-R399 WeakPolarHBondContact CA-O 3.43Å; Y389-A400 HydrophobicContact CD1-CB 3.94Å; Y389-A400 HydrophobicContact CE1-CB 3.89Å; Y389-W415 WeakPolarHBondContact CB-O 3.47Å; Y389-W415 HydrophobicContact CD2-CE3 4.37Å; Y389-W415 HydrophobicContact CG-CE3 4.04Å; Y389-W415 HydrophobicContact CG-CZ3 4.48Å; Y389-W415 PolarHBondContact O-N 3.09Å; Y389-K417 HydrophobicContact CD2-CB 3.82Å; Y389-K417 HydrophobicContact CD2-CD 4.47Å; Y389-K417 HydrophobicContact CE1-CD 4.41Å; Y389-K417 HydrophobicContact CE2-CB 3.61Å; Y389-K417 HydrophobicContact CE2-CD 3.58Å; Y389-K417 HydrophobicContact CE2-CG 4.26Å; Y389-K417 WeakPolarHBondContact OH-CD 3.38Å; Y389-T455 PolarHBondContact N-O 2.86Å; Y389-V457 HydrophobicContact CD1-CG2 4.23Å; Y389-V457 HydrophobicContact CE1-CG2 3.97Å; Y389-V457 HydrophobicContact CE2-CG2 4.36Å; Y389-V458 HydrophobicContact CE2-CG2 4.4Å; Y389-V458 PolarHBondContact OH-N 3.49Å; Y389-L489 WeakPolarHBondContact CE1-O 3.32Å; Y389-L489 PolarHBondContact OH-O 2.84Å; Y389-P491 HydrophobicContact CD1-CB 4.43Å; Y389-P491 HydrophobicContact CD1-CG 4.04Å; Y389-P491 HydrophobicContact CE1-CG 4.29Å
390	V	93.4	Very high	89.7	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	134.6	176.2	-56.4	0	0	0	0	109	I388 V398 R399 V401 Y406 L408 V413	I388-V390 HydrophobicContact CD1-CG1 3.95Å; I388-V390 HydrophobicContact CG1-CG1 4.03Å; V390-V398 WeakPolarHBondContact O-CA 3.43Å; V390-R399 HydrophobicContact CG2-CG 3.56Å; V390-R399 PolarHBondContact N-O 3.41Å; V390-R399 PolarHBondContact O-N 2.86Å; V390-V401 HydrophobicContact CG1-CG2 4.33Å; V390-V401 HydrophobicContact CG2-CG2 3.72Å; V390-Y406 HydrophobicContact CG1-CE1 4.31Å; V390-L408 HydrophobicContact CB-CD2 4.28Å; V390-L408 HydrophobicContact CG1-CD2 3.66Å; V390-V413 WeakPolarHBondContact CA-O 3.48Å
391	Q	93.3	Very high	89.8	Confident	60 Å²	60	62.9 Å²	62.9	28%	0.28	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	127.2	172	178.3	174.8	31.4	0	0	108.7	V398 E412 V413 W415	Q391-V398 HydrophobicContact CB-CG2 4.09Å; Q391-V398 HydrophobicContact CG-CG2 4.03Å; Q391-E412 WeakPolarHBondContact O-CA 3.32Å; Q391-V413 HydrophobicContact CB-CG1 4.2Å; Q391-V413 PolarHBondContact N-O 2.96Å; Q391-V413 PolarHBondContact O-N 2.84Å; Q391-W415 HydrophobicContact CB-CB 3.91Å; Q391-W415 HydrophobicContact CB-CG 4.31Å
392	D	92.9	Very high	89.8	Confident	30 Å²	30	63.2 Å²	63.2	16%	0.16	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	122.4	167.8	175.5	-15.4	0	0	0	108.9	K394 T395 G396 K397 D411	D392-K394 WeakPolarHBondContact OD1-CA 3.26Å; D392-K394 WeakPolarHBondContact OD1-CB 3.32Å; D392-K394 PolarHBondContact OD1-N 2.97Å; D392-T395 VanDerWaalsContact CB-OG1 3.3Å; D392-T395 WeakPolarHBondContact CB-OG1 3.31Å; D392-T395 PolarHBondContact OD1-N 2.91Å; D392-T395 VanDerWaalsContact OD1-N 3.13Å; D392-T395 VanDerWaalsContact OD2-CG2 3.32Å; D392-T395 WeakPolarHBondContact OD2-CG2 3.26Å; D392-T395 PolarHBondContact OD2-OG1 2.91Å; D392-G396 CarbonylContact O-C 3.55Å; D392-G396 WeakPolarHBondContact O-CA 3.38Å; D392-G396 PolarHBondContact O-N 3.03Å; D392-K397 PolarHBondContact N-O 2.79Å; D392-K397 VanDerWaalsContact N-O 3.14Å; D392-D411 CarbonylContact C-O 3.53Å; D392-D411 WeakPolarHBondContact CA-O 3.47Å
393	V	89.7	Confident	89.5	Confident	103 Å²	103	64.2 Å²	64.2	62%	0.624	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-30.5	-177	179.9	0	0	0	0	111.5	D411 V413	V393-D411 WeakPolarHBondContact CG2-O 3.27Å; V393-D411 PolarHBondContact N-O 2.9Å; V393-V413 HydrophobicContact CG2-CB 4.39Å; V393-V413 HydrophobicContact CG2-CG1 3.93Å
394	K	87.9	Confident	89.5	Confident	143 Å²	143	62.1 Å²	62.1	62%	0.622	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-44.6	178.6	-73.4	-179.3	175.3	151.8	0	111.7	D392 D411	D392-K394 WeakPolarHBondContact OD1-CA 3.26Å; D392-K394 WeakPolarHBondContact OD1-CB 3.32Å; D392-K394 PolarHBondContact OD1-N 2.97Å; K394-D411 HydrophobicContact CD-CB 4.3Å; K394-D411 WeakPolarHBondContact CD-OD1 3.37Å; K394-D411 VanDerWaalsContact CE-CG 3.47Å; K394-D411 WeakPolarHBondContact CE-OD1 3.35Å; K394-D411 HydrophobicContact CG-CB 4.37Å; K394-D411 IonicContact NZ-OD1 2.92Å; K394-D411 PolarHBondContact NZ-OD1 2.84Å; K394-D411 IonicContact NZ-OD2 3.2Å; K394-D411 PolarHBondContact NZ-OD2 2.99Å
395	T	89.1	Confident	89.7	Confident	93 Å²	93	58 Å²	58	57%	0.571	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-16.2	-176.3	65.3	0	0	0	0	113.6	D392 K397	D392-T395 VanDerWaalsContact CB-OG1 3.3Å; D392-T395 WeakPolarHBondContact CB-OG1 3.31Å; D392-T395 PolarHBondContact OD1-N 2.91Å; D392-T395 VanDerWaalsContact OD1-N 3.13Å; D392-T395 VanDerWaalsContact OD2-CG2 3.32Å; D392-T395 WeakPolarHBondContact OD2-CG2 3.26Å; D392-T395 PolarHBondContact OD2-OG1 2.91Å; T395-K397 PolarHBondContact O-N 3.11Å; T395-K397 WeakPolarHBondContact OG1-CB 3.46Å; T395-K397 PolarHBondContact OG1-N 3.27Å
396	G	88.1	Confident	90	Very high	39 Å²	39	55 Å²	55	40%	0.402	31%	0.306	S	S	.	.			trans	69.4	1.8	-171.2	0	0	0	0	0	113.7	D392 V398	D392-G396 CarbonylContact O-C 3.55Å; D392-G396 WeakPolarHBondContact O-CA 3.38Å; D392-G396 PolarHBondContact O-N 3.03Å; G396-V398 PolarHBondContact O-N 2.77Å
397	K	89.5	Confident	90.1	Very high	128 Å²	128	52.4 Å²	52.4	56%	0.557	29%	0.294	S	S	*	.			trans	-76.8	118.9	-172.4	-172.3	178.8	179.9	-178.7	0	110.5	D392 T395	D392-K397 PolarHBondContact N-O 2.79Å; D392-K397 VanDerWaalsContact N-O 3.14Å; T395-K397 PolarHBondContact O-N 3.11Å; T395-K397 WeakPolarHBondContact OG1-CB 3.46Å; T395-K397 PolarHBondContact OG1-N 3.27Å
398	V	92.4	Very high	90.2	Very high	18 Å²	18	53 Å²	53	11%	0.109	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	135.6	172.6	-167.4	0	0	0	0	110	V390 Q391 G396 W415 P491	V390-V398 WeakPolarHBondContact O-CA 3.43Å; Q391-V398 HydrophobicContact CB-CG2 4.09Å; Q391-V398 HydrophobicContact CG-CG2 4.03Å; G396-V398 PolarHBondContact O-N 2.77Å; V398-W415 HydrophobicContact CG1-CB 4.03Å; V398-W415 HydrophobicContact CG1-CD2 3.62Å; V398-W415 HydrophobicContact CG1-CE3 3.62Å; V398-W415 HydrophobicContact CG1-CG 3.81Å; V398-W415 HydrophobicContact CG1-CZ3 4.23Å; V398-W415 HydrophobicContact CG2-CD2 4.22Å; V398-W415 HydrophobicContact CG2-CG 4.15Å; V398-P491 HydrophobicContact CB-CB 3.98Å; V398-P491 HydrophobicContact CB-CG 4.2Å; V398-P491 HydrophobicContact CG1-CB 3.62Å; V398-P491 HydrophobicContact CG1-CG 3.79Å
399	R	90.3	Very high	90.1	Very high	83 Å²	83	55 Å²	55	31%	0.313	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	157	173.1	68.1	-177.1	-169.2	-93.8	3.1	111.3	Y389 V390 V401 Y406 E412	Y389-R399 WeakPolarHBondContact CA-O 3.43Å; V390-R399 HydrophobicContact CG2-CG 3.56Å; V390-R399 PolarHBondContact N-O 3.41Å; V390-R399 PolarHBondContact O-N 2.86Å; R399-V401 HydrophobicContact CG-CG2 4.48Å; R399-Y406 PolarHBondContact NH2-OH 2.85Å; R399-E412 IonicContact CZ-OE1 3.88Å; R399-E412 VanDerWaalsContact CZ-OE1 3.23Å; R399-E412 IonicContact NH1-OE1 2.77Å; R399-E412 PolarHBondContact NH1-OE1 2.97Å; R399-E412 IonicContact NH2-OE1 3.46Å; R399-E412 PolarHBondContact NH2-OE1 2.84Å; R399-E412 IonicContact NH2-OE2 3.32Å
400	A	91.1	Very high	89.8	Confident	38 Å²	38	58.5 Å²	58.5	31%	0.314	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	130.7	169.8	0	0	0	0	0	109.3	I388 Y389 V457	I388-A400 WeakPolarHBondContact O-CA 3.49Å; Y389-A400 HydrophobicContact CD1-CB 3.94Å; Y389-A400 HydrophobicContact CE1-CB 3.89Å; A400-V457 HydrophobicContact CB-CG2 3.81Å
401	V	91.2	Very high	89.6	Confident	20 Å²	20	60.2 Å²	60.2	12%	0.121	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	122.8	171.3	-179.4	0	0	0	0	107.3	G387 I388 V390 R399 Y406	G387-V401 CarbonylContact C-O 3.53Å; G387-V401 WeakPolarHBondContact CA-O 3.47Å; I388-V401 HydrophobicContact CG1-CB 4.47Å; I388-V401 PolarHBondContact N-O 3Å; I388-V401 PolarHBondContact O-N 3Å; V390-V401 HydrophobicContact CG1-CG2 4.33Å; V390-V401 HydrophobicContact CG2-CG2 3.72Å; R399-V401 HydrophobicContact CG-CG2 4.48Å; V401-Y406 HydrophobicContact CG1-CD1 4.23Å; V401-Y406 HydrophobicContact CG1-CD2 3.79Å; V401-Y406 HydrophobicContact CG1-CE2 4.22Å; V401-Y406 HydrophobicContact CG1-CG 3.79Å; V401-Y406 HydrophobicContact CG2-CE1 4.27Å
402	I	89.6	Confident	89.6	Confident	97 Å²	97	57.8 Å²	57.8	50%	0.497	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	146.5	-173.9	49.4	168.5	0	0	0	110.9	E386 V457	E386-I402 VanDerWaalsContact O-CA 3.3Å; E386-I402 WeakPolarHBondContact O-CA 3.49Å; I402-V457 HydrophobicContact CG2-CG2 4.26Å
403	G	83.3	Confident	89.6	Confident	31 Å²	31	59.4 Å²	59.4	32%	0.32	33%	0.334	S	S	.	.	S	Bend	trans	88.3	-3.4	160.1	0	0	0	0	0	118.5	D383 E386	D383-G403 WeakPolarHBondContact O-CA 3.24Å; E386-G403 PolarHBondContact O-N 3.25Å
404	S	87.2	Confident	89.7	Confident	69 Å²	69	57.4 Å²	57.4	48%	0.483	32%	0.319	S	S	.	.	S	Bend	trans	-147	149.1	174.6	61.2	0	0	0	0	112.2	L382 Y406	L382-S404 WeakPolarHBondContact CD1-O 3.32Å; S404-Y406 PolarHBondContact O-N 2.65Å; S404-Y406 VanDerWaalsContact O-N 3.16Å
405	T	88.7	Confident	90	Very high	79 Å²	79	53.3 Å²	53.3	49%	0.485	30%	0.3	S	S	.	.			trans	-51.6	121.6	174	-58.5	0	0	0	0	110.1	A379 I380	A379-T405 HydrophobicContact CB-CG2 3.87Å; I380-T405 WeakPolarHBondContact O-CA 3.28Å
406	Y	89.6	Confident	90.2	Very high	46 Å²	46	54 Å²	54	18%	0.18	30%	0.297	C	S	.	.	B	Isolated β-bridge	trans	-125.6	131.5	-172.1	-163.6	-106.2	0	0	0	111.3	I380 I388 V390 R399 V401 S404 E412	I380-Y406 PolarHBondContact N-O 2.8Å; I380-Y406 PolarHBondContact O-N 2.63Å; I388-Y406 HydrophobicContact CD1-CD1 4.25Å; V390-Y406 HydrophobicContact CG1-CE1 4.31Å; R399-Y406 PolarHBondContact NH2-OH 2.85Å; V401-Y406 HydrophobicContact CG1-CD1 4.23Å; V401-Y406 HydrophobicContact CG1-CD2 3.79Å; V401-Y406 HydrophobicContact CG1-CE2 4.22Å; V401-Y406 HydrophobicContact CG1-CG 3.79Å; V401-Y406 HydrophobicContact CG2-CE1 4.27Å; S404-Y406 PolarHBondContact O-N 2.65Å; S404-Y406 VanDerWaalsContact O-N 3.16Å; Y406-E412 WeakPolarHBondContact CE1-OE2 3.48Å; Y406-E412 PolarHBondContact OH-OE2 3.02Å
407	M	88.6	Confident	90.3	Very high	18 Å²	18	52.3 Å²	52.3	9%	0.089	28%	0.278	C	S	.	.			trans	-108	124.4	169.6	-175.3	-174.2	-72.8	0	0	108.3	Q329 L358 R360 A379 T409	Q329-M407 VanDerWaalsContact C-CE 3.48Å; Q329-M407 VanDerWaalsContact O-CE 3.27Å; Q329-M407 WeakPolarHBondContact O-CE 3.35Å; L358-M407 HydrophobicContact CD2-CG 4.35Å; L358-M407 HydrophobicContact CD2-SD 3.95Å; R360-M407 HydrophobicContact CG-SD 3.91Å; A379-M407 HydrophobicContact CB-CB 4.11Å; A379-M407 HydrophobicContact CB-CE 4.03Å; M407-T409 PolarHBondContact O-N 2.85Å
408	L	91.4	Very high	90.2	Very high	15 Å²	15	52.4 Å²	52.4	8%	0.079	28%	0.281	C	S	.	.			trans	-54.9	131.6	178	-66.5	149.2	0	0	0	110.2	L358 R377 I380 V390 E412 L414	L358-L408 WeakPolarHBondContact CD2-O 3.23Å; R377-L408 VanDerWaalsContact NH1-CB 3.29Å; R377-L408 PolarHBondContact NH1-O 3.01Å; I380-L408 HydrophobicContact CD1-CD1 4.47Å; V390-L408 HydrophobicContact CB-CD2 4.28Å; V390-L408 HydrophobicContact CG1-CD2 3.66Å; L408-E412 HydrophobicContact CB-CB 4.33Å; L408-E412 HydrophobicContact CD2-CB 4.05Å; L408-L414 HydrophobicContact CD1-CD1 4.37Å; L408-L414 HydrophobicContact CD1-CD2 4.48Å; L408-L414 HydrophobicContact CD1-CG 3.96Å; L408-L414 HydrophobicContact CD2-CD2 4.32Å; L408-L414 HydrophobicContact CD2-CG 4.28Å
409	T	90.9	Very high	89.9	Confident	44 Å²	44	52.2 Å²	52.2	27%	0.27	28%	0.279	S	S	.	.			trans	-73.5	166.4	175.2	70.9	0	0	0	0	111.8	R377 M407 D411 E412	R377-T409 PolarHBondContact NH1-O 2.79Å; M407-T409 PolarHBondContact O-N 2.85Å; T409-D411 PolarHBondContact O-N 3.46Å; T409-E412 WeakPolarHBondContact CG2-OE2 3.48Å; T409-E412 PolarHBondContact N-OE2 3.02Å; T409-E412 PolarHBondContact O-N 3.03Å; T409-E412 VanDerWaalsContact OG1-CG 3.25Å; T409-E412 WeakPolarHBondContact OG1-CG 3.46Å; T409-E412 PolarHBondContact OG1-OE1 2.84Å; T409-E412 PolarHBondContact OG1-OE2 2.81Å
410	Q	88	Confident	89.7	Confident	75 Å²	75	51.3 Å²	51.3	35%	0.35	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-29.8	-175.8	73.2	-164.7	17.7	0	0	114.7	L333 H356 L358	L333-Q410 HydrophobicContact CD1-CB 4.06Å; H356-Q410 PolarHBondContact O-OE1 2.92Å; L358-Q410 HydrophobicContact CB-CB 4.16Å
411	D	89.9	Confident	89.3	Confident	35 Å²	35	54 Å²	54	19%	0.187	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102	6.4	-177	-62.9	-52.6	0	0	0	112.1	D392 V393 K394 T409	D392-D411 CarbonylContact C-O 3.53Å; D392-D411 WeakPolarHBondContact CA-O 3.47Å; V393-D411 WeakPolarHBondContact CG2-O 3.27Å; V393-D411 PolarHBondContact N-O 2.9Å; K394-D411 HydrophobicContact CD-CB 4.3Å; K394-D411 WeakPolarHBondContact CD-OD1 3.37Å; K394-D411 VanDerWaalsContact CE-CG 3.47Å; K394-D411 WeakPolarHBondContact CE-OD1 3.35Å; K394-D411 HydrophobicContact CG-CB 4.37Å; K394-D411 IonicContact NZ-OD1 2.92Å; K394-D411 PolarHBondContact NZ-OD1 2.84Å; K394-D411 IonicContact NZ-OD2 3.2Å; K394-D411 PolarHBondContact NZ-OD2 2.99Å; T409-D411 PolarHBondContact O-N 3.46Å
412	E	91.4	Very high	88.8	Confident	9 Å²	9	53.3 Å²	53.3	4%	0.042	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	142.9	-177.4	-75.9	166.8	-176.9	0	0	112.6	R377 Q391 R399 Y406 L408 T409	R377-E412 PolarHBondContact NH1-O 3.08Å; R377-E412 PolarHBondContact NH2-O 3.5Å; Q391-E412 WeakPolarHBondContact O-CA 3.32Å; R399-E412 IonicContact CZ-OE1 3.88Å; R399-E412 VanDerWaalsContact CZ-OE1 3.23Å; R399-E412 IonicContact NH1-OE1 2.77Å; R399-E412 PolarHBondContact NH1-OE1 2.97Å; R399-E412 IonicContact NH2-OE1 3.46Å; R399-E412 PolarHBondContact NH2-OE1 2.84Å; R399-E412 IonicContact NH2-OE2 3.32Å; Y406-E412 WeakPolarHBondContact CE1-OE2 3.48Å; Y406-E412 PolarHBondContact OH-OE2 3.02Å; L408-E412 HydrophobicContact CB-CB 4.33Å; L408-E412 HydrophobicContact CD2-CB 4.05Å; T409-E412 WeakPolarHBondContact CG2-OE2 3.48Å; T409-E412 PolarHBondContact N-OE2 3.02Å; T409-E412 PolarHBondContact O-N 3.03Å; T409-E412 VanDerWaalsContact OG1-CG 3.25Å; T409-E412 WeakPolarHBondContact OG1-CG 3.46Å; T409-E412 PolarHBondContact OG1-OE1 2.84Å; T409-E412 PolarHBondContact OG1-OE2 2.81Å
413	V	92.9	Very high	88.6	Confident	65 Å²	65	48.9 Å²	48.9	39%	0.394	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	152.9	171.9	67	0	0	0	0	109.6	V390 Q391 V393 W415	V390-V413 WeakPolarHBondContact CA-O 3.48Å; Q391-V413 HydrophobicContact CB-CG1 4.2Å; Q391-V413 PolarHBondContact N-O 2.96Å; Q391-V413 PolarHBondContact O-N 2.84Å; V393-V413 HydrophobicContact CG2-CB 4.39Å; V393-V413 HydrophobicContact CG2-CG1 3.93Å; V413-W415 PolarHBondContact O-N 2.93Å
414	L	92.9	Very high	88.5	Confident	61 Å²	61	49.8 Å²	49.8	32%	0.319	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	131.9	172.4	-72.2	165.7	0	0	0	110	I380 I388 L408 T455	I380-L414 HydrophobicContact CD1-CD1 4.25Å; I380-L414 HydrophobicContact CD1-CD2 4.08Å; I388-L414 HydrophobicContact CB-CD2 4Å; I388-L414 HydrophobicContact CD1-CD2 3.91Å; I388-L414 HydrophobicContact CG1-CD2 4.44Å; I388-L414 HydrophobicContact CG2-CD2 4.26Å; L408-L414 HydrophobicContact CD1-CD1 4.37Å; L408-L414 HydrophobicContact CD1-CD2 4.48Å; L408-L414 HydrophobicContact CD1-CG 3.96Å; L408-L414 HydrophobicContact CD2-CD2 4.32Å; L408-L414 HydrophobicContact CD2-CG 4.28Å; L414-T455 HydrophobicContact CB-CG2 3.87Å
415	W	94.6	Very high	88.1	Confident	57 Å²	57	51.7 Å²	51.7	22%	0.216	27%	0.269	C	S	.	.			trans	-105.3	131.8	178.9	-175.2	77.6	0	0	0	110.9	Y389 Q391 V398 V413 K417 T455 P491	Y389-W415 WeakPolarHBondContact CB-O 3.47Å; Y389-W415 HydrophobicContact CD2-CE3 4.37Å; Y389-W415 HydrophobicContact CG-CE3 4.04Å; Y389-W415 HydrophobicContact CG-CZ3 4.48Å; Y389-W415 PolarHBondContact O-N 3.09Å; Q391-W415 HydrophobicContact CB-CB 3.91Å; Q391-W415 HydrophobicContact CB-CG 4.31Å; V398-W415 HydrophobicContact CG1-CB 4.03Å; V398-W415 HydrophobicContact CG1-CD2 3.62Å; V398-W415 HydrophobicContact CG1-CE3 3.62Å; V398-W415 HydrophobicContact CG1-CG 3.81Å; V398-W415 HydrophobicContact CG1-CZ3 4.23Å; V398-W415 HydrophobicContact CG2-CD2 4.22Å; V398-W415 HydrophobicContact CG2-CG 4.15Å; V413-W415 PolarHBondContact O-N 2.93Å; W415-K417 HydrophobicContact CE3-CB 4.07Å; W415-K417 HydrophobicContact CH2-CB 4.23Å; W415-K417 HydrophobicContact CH2-CG 4.26Å; W415-K417 HydrophobicContact CZ3-CB 3.51Å; W415-K417 HydrophobicContact CZ3-CD 4.4Å; W415-K417 HydrophobicContact CZ3-CG 3.86Å; W415-T455 WeakPolarHBondContact O-CA 3.5Å; W415-P491 HydrophobicContact CZ3-CB 4.15Å
416	E	92.2	Very high	87.7	Confident	108 Å²	108	49.5 Å²	49.5	51%	0.505	25%	0.254	S	S	.	.			trans	-88.4	121.7	177.5	-67.4	-172	-178.7	0	0	110.7	K454 T455	E416-K454 HydrophobicContact CB-CB 3.9Å; E416-K454 HydrophobicContact CB-CD 4.36Å; E416-K454 HydrophobicContact CG-CB 4.02Å; E416-T455 HydrophobicContact CG-CG2 3.76Å
417	K	89.8	Confident	87.2	Confident	2 Å²	2	48.4 Å²	48.4	1%	0.009	25%	0.252	C	S	.	.			trans	-90.3	114.8	172.6	-175.8	174	174.8	112.2	0	110.3	Y389 W415 K454 V458 G490 P491 E493	Y389-K417 HydrophobicContact CD2-CB 3.82Å; Y389-K417 HydrophobicContact CD2-CD 4.47Å; Y389-K417 HydrophobicContact CE1-CD 4.41Å; Y389-K417 HydrophobicContact CE2-CB 3.61Å; Y389-K417 HydrophobicContact CE2-CD 3.58Å; Y389-K417 HydrophobicContact CE2-CG 4.26Å; Y389-K417 WeakPolarHBondContact OH-CD 3.38Å; W415-K417 HydrophobicContact CE3-CB 4.07Å; W415-K417 HydrophobicContact CH2-CB 4.23Å; W415-K417 HydrophobicContact CH2-CG 4.26Å; W415-K417 HydrophobicContact CZ3-CB 3.51Å; W415-K417 HydrophobicContact CZ3-CD 4.4Å; W415-K417 HydrophobicContact CZ3-CG 3.86Å; K417-K454 PolarHBondContact N-O 3.02Å; K417-V458 HydrophobicContact CD-CG2 3.8Å; K417-G490 PolarHBondContact NZ-O 2.91Å; K417-P491 PolarHBondContact NZ-O 2.61Å; K417-E493 WeakPolarHBondContact CE-O 3.49Å; K417-E493 PolarHBondContact NZ-O 2.91Å
418	E	87.4	Confident	86.5	Confident	131 Å²	131	50.7 Å²	50.7	61%	0.612	26%	0.264	S	S	*	.			trans	-84.6	133.6	172.2	-56.5	-151	128.7	0	0	111.3	K454	E418-K454 IonicContact OE1-NZ 3.11Å; E418-K454 PolarHBondContact OE1-NZ 2.91Å
419	L	85.9	Confident	85.5	Confident	14 Å²	14	55.7 Å²	55.7	7%	0.073	29%	0.285	C	S	.	.			trans	-114.1	151	173.7	-66.4	177.3	0	0	0	109.5	V423 E424 L427 V458 L489	L419-V423 HydrophobicContact CD1-CG1 4.32Å; L419-E424 HydrophobicContact CB-CG 3.67Å; L419-E424 HydrophobicContact CD1-CG 4.4Å; L419-L427 HydrophobicContact CD1-CD1 3.7Å; L419-V458 HydrophobicContact CD1-CG1 3.94Å; L419-V458 HydrophobicContact CD1-CG2 3.83Å; L419-V458 HydrophobicContact CD2-CG2 4.45Å; L419-V458 HydrophobicContact CG-CG2 4.38Å; L419-L489 HydrophobicContact CD2-CD1 4.43Å
420	P	87.1	Confident	83.9	Confident	64 Å²	64	57 Å²	57	42%	0.416	31%	0.307	S	S	.	.			trans	-57.9	141.2	170.8	-22.8	33.2	0	0	0	110.7	G422 V423 E424	P420-G422 PolarHBondContact O-N 2.72Å; P420-G422 VanDerWaalsContact O-N 3.09Å; P420-V423 HydrophobicContact CB-CG2 4.2Å; P420-V423 HydrophobicContact CG-CG2 4.27Å; P420-V423 WeakPolarHBondContact O-CA 3.35Å; P420-V423 WeakPolarHBondContact O-CB 3.37Å; P420-V423 PolarHBondContact O-N 2.83Å; P420-E424 PolarHBondContact O-N 3.37Å
421	P	82.9	Confident	82.7	Confident	94 Å²	94	58.2 Å²	58.2	61%	0.61	31%	0.313	S	S	*	.	H	α-helix	trans	-59.2	-34.5	-171.4	21.6	-33.5	0	0	0	112.6	V423 E424 E425	P421-V423 VanDerWaalsContact C-N 3.28Å; P421-V423 PolarHBondContact O-N 3.23Å; P421-E424 PolarHBondContact O-N 3.25Å; P421-E425 WeakPolarHBondContact O-CG 3.43Å; P421-E425 PolarHBondContact O-N 2.79Å
422	G	81.2	Confident	81.3	Confident	5 Å²	5	59.5 Å²	59.5	5%	0.052	32%	0.32	C	S	.	.	H	α-helix	trans	-68.3	-22.2	176	0	0	0	0	0	114.7	P420 L426	P420-G422 PolarHBondContact O-N 2.72Å; P420-G422 VanDerWaalsContact O-N 3.09Å; G422-L426 WeakPolarHBondContact O-CD1 3.5Å; G422-L426 WeakPolarHBondContact O-CG 3.45Å
423	V	83.8	Confident	80	Confident	4 Å²	4	60 Å²	60	2%	0.024	32%	0.324	C	S	.	.	H	α-helix	trans	-79	-43.3	172.6	178.5	0	0	0	0	109.5	L419 P420 P421 E425 L426 L427 F495 V497 L514	L419-V423 HydrophobicContact CD1-CG1 4.32Å; P420-V423 HydrophobicContact CB-CG2 4.2Å; P420-V423 HydrophobicContact CG-CG2 4.27Å; P420-V423 WeakPolarHBondContact O-CA 3.35Å; P420-V423 WeakPolarHBondContact O-CB 3.37Å; P420-V423 PolarHBondContact O-N 2.83Å; P421-V423 VanDerWaalsContact C-N 3.28Å; P421-V423 PolarHBondContact O-N 3.23Å; V423-E425 VanDerWaalsContact C-N 3.33Å; V423-E425 PolarHBondContact O-N 3.44Å; V423-L426 PolarHBondContact O-N 2.79Å; V423-L426 VanDerWaalsContact O-N 3.08Å; V423-L427 HydrophobicContact CG1-CD1 3.93Å; V423-L427 HydrophobicContact CG1-CG 4.27Å; V423-L427 WeakPolarHBondContact O-CG 3.31Å; V423-L427 PolarHBondContact O-N 2.94Å; V423-F495 HydrophobicContact CG1-CD2 4.12Å; V423-V497 HydrophobicContact CG2-CG2 3.44Å; V423-V497 VanDerWaalsContact CG2-CG2 3.44Å; V423-L514 HydrophobicContact CG1-CD1 4.26Å
424	E	81.7	Confident	78.5	Confident	50 Å²	50	60.9 Å²	60.9	23%	0.234	33%	0.326	C	S	.	.	H	α-helix	trans	-58.5	-46.5	177.3	-62.8	-173.4	158.8	0	0	111	L419 P420 P421 L426 L427 N428	L419-E424 HydrophobicContact CB-CG 3.67Å; L419-E424 HydrophobicContact CD1-CG 4.4Å; P420-E424 PolarHBondContact O-N 3.37Å; P421-E424 PolarHBondContact O-N 3.25Å; E424-L426 VanDerWaalsContact C-N 3.28Å; E424-L426 PolarHBondContact O-N 2.87Å; E424-L427 PolarHBondContact O-N 2.8Å; E424-N428 WeakPolarHBondContact O-CB 3.42Å; E424-N428 PolarHBondContact O-N 2.96Å; E424-N428 PolarHBondContact O-ND2 3.5Å
425	E	80.1	Confident	76.7	Confident	110 Å²	110	61.6 Å²	61.6	51%	0.514	34%	0.341	S	S	.	.	H	α-helix	trans	-55.1	-41.1	173.5	-75.1	176.2	-162.9	0	0	112.9	P421 V423 K429	P421-E425 WeakPolarHBondContact O-CG 3.43Å; P421-E425 PolarHBondContact O-N 2.79Å; V423-E425 VanDerWaalsContact C-N 3.33Å; V423-E425 PolarHBondContact O-N 3.44Å; E425-K429 VanDerWaalsContact O-CG 3.26Å; E425-K429 WeakPolarHBondContact O-CG 3.23Å; E425-K429 PolarHBondContact O-N 3.01Å
426	L	78.3	Confident	75	Confident	32 Å²	32	61.4 Å²	61.4	17%	0.168	34%	0.344	C	S	.	.	H	α-helix	trans	-74.1	-39.5	-177.8	-72	172.4	0	0	0	112.5	G422 V423 E424 N428 V497 R512	G422-L426 WeakPolarHBondContact O-CD1 3.5Å; G422-L426 WeakPolarHBondContact O-CG 3.45Å; V423-L426 PolarHBondContact O-N 2.79Å; V423-L426 VanDerWaalsContact O-N 3.08Å; E424-L426 VanDerWaalsContact C-N 3.28Å; E424-L426 PolarHBondContact O-N 2.87Å; L426-N428 VanDerWaalsContact C-N 3.3Å; L426-V497 HydrophobicContact CD1-CG1 4.07Å; L426-R512 HydrophobicContact CD1-CB 4.14Å
427	L	80.8	Confident	73.5	Confident	24 Å²	24	61.2 Å²	61.2	13%	0.126	34%	0.339	C	S	.	.	H	α-helix	trans	-63.8	-41.2	174.6	-70.4	171.7	0	0	0	111	L419 V423 E424 G430 V458 Y460 F495 L514	L419-L427 HydrophobicContact CD1-CD1 3.7Å; V423-L427 HydrophobicContact CG1-CD1 3.93Å; V423-L427 HydrophobicContact CG1-CG 4.27Å; V423-L427 WeakPolarHBondContact O-CG 3.31Å; V423-L427 PolarHBondContact O-N 2.94Å; E424-L427 PolarHBondContact O-N 2.8Å; L427-G430 PolarHBondContact O-N 3.33Å; L427-V458 HydrophobicContact CD1-CG1 3.67Å; L427-Y460 HydrophobicContact CD2-CD2 3.59Å; L427-Y460 HydrophobicContact CD2-CE2 4.43Å; L427-Y460 HydrophobicContact CD2-CG 4.09Å; L427-F495 HydrophobicContact CD1-CE2 4.35Å; L427-F495 HydrophobicContact CD2-CD2 4.38Å; L427-F495 HydrophobicContact CD2-CE2 3.89Å; L427-L514 HydrophobicContact CD2-CD2 3.55Å; L427-L514 HydrophobicContact CG-CD2 4.3Å
428	N	73	Confident	71.5	Confident	65 Å²	65	64.6 Å²	64.6	35%	0.348	37%	0.373	S	S	.	.	H	α-helix	trans	-70.4	-30.8	-178.3	-84.9	-3.8	0	0	0	113.7	E424 L426 G430 L449	E424-N428 WeakPolarHBondContact O-CB 3.42Å; E424-N428 PolarHBondContact O-N 2.96Å; E424-N428 PolarHBondContact O-ND2 3.5Å; L426-N428 VanDerWaalsContact C-N 3.3Å; N428-G430 PolarHBondContact O-N 2.64Å; N428-L449 HydrophobicContact CB-CD2 3.26Å; N428-L449 WeakPolarHBondContact O-CD2 3.43Å
429	K	69.7	Low	69.8	Low	121 Å²	121	62.9 Å²	62.9	53%	0.526	37%	0.366	S	S	.	.	H	α-helix	trans	-61.5	-27.7	177	-82.9	171	-175	-178	0	112.6	E425 Q431	E425-K429 VanDerWaalsContact O-CG 3.26Å; E425-K429 WeakPolarHBondContact O-CG 3.23Å; E425-K429 PolarHBondContact O-N 3.01Å; K429-Q431 PolarHBondContact O-N 2.85Å
430	G	58.4	Low	67.8	Low	70 Å²	70	70.8 Å²	70.8	72%	0.722	40%	0.399	S	S	*	.			trans	55.5	9.3	175.5	0	0	0	0	0	115.4	L427 N428	L427-G430 PolarHBondContact O-N 3.33Å; N428-G430 PolarHBondContact O-N 2.64Å
431	Q	61.9	Low	65.9	Low	102 Å²	102	75.5 Å²	75.5	48%	0.477	42%	0.421	S	S	.	.			trans	-74.6	131.6	-174.3	-81.6	175.4	-16.9	0	0	109.4	K429 P433 D436	K429-Q431 PolarHBondContact O-N 2.85Å; Q431-P433 VanDerWaalsContact O-CD 3.25Å; Q431-P433 WeakPolarHBondContact O-CD 3.39Å; Q431-D436 VanDerWaalsContact CA-OD2 3.23Å; Q431-D436 WeakPolarHBondContact CA-OD2 3.36Å; Q431-D436 WeakPolarHBondContact CB-OD2 3.46Å
432	D	60.9	Low	63.8	Low	61 Å²	61	75.8 Å²	75.8	33%	0.326	42%	0.421	S	S	.	.			trans	-75.3	113.8	168.9	-174.6	-25.7	0	0	0	107.4	L434 A435 D436	D432-L434 PolarHBondContact O-N 2.91Å; D432-L434 WeakPolarHBondContact OD1-CB 3.35Å; D432-L434 PolarHBondContact OD1-N 2.95Å; D432-A435 HydrophobicContact CB-CB 3.9Å; D432-A435 PolarHBondContact O-N 3.06Å; D432-D436 PolarHBondContact N-OD2 3.27Å; D432-D436 WeakPolarHBondContact O-CB 3.48Å; D432-D436 PolarHBondContact O-N 2.83Å
433	P	64.3	Low	62	Low	20 Å²	20	80.2 Å²	80.2	13%	0.13	46%	0.458	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-11.5	-177.3	-6.8	17.5	0	0	0	114	Q431 R437 P463 C515 L517	Q431-P433 VanDerWaalsContact O-CD 3.25Å; Q431-P433 WeakPolarHBondContact O-CD 3.39Å; P433-R437 WeakPolarHBondContact O-CD 3.33Å; P433-R437 WeakPolarHBondContact O-CG 3.5Å; P433-R437 PolarHBondContact O-NE 3.18Å; P433-P463 HydrophobicContact CG-CG 4.03Å; P433-C515 VanDerWaalsContact CG-SG 3.5Å; P433-L517 HydrophobicContact CB-CD1 4.26Å; P433-L517 HydrophobicContact CB-CD2 4.32Å
434	L	61.8	Low	60	Low	84 Å²	84	87 Å²	87	44%	0.44	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-49.9	174.2	-131.2	87.1	0	0	0	111.7	D432 L517	D432-L434 PolarHBondContact O-N 2.91Å; D432-L434 WeakPolarHBondContact OD1-CB 3.35Å; D432-L434 PolarHBondContact OD1-N 2.95Å; L434-L517 HydrophobicContact CD1-CD1 4.34Å; L434-L517 HydrophobicContact CD1-CD2 3.73Å
435	A	55.9	Low	58	Low	76 Å²	76	88.5 Å²	88.5	63%	0.628	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-33.7	-173.1	0	0	0	0	0	113.1	D432 R437	D432-A435 HydrophobicContact CB-CB 3.9Å; D432-A435 PolarHBondContact O-N 3.06Å; A435-R437 VanDerWaalsContact C-N 3.25Å; A435-R437 PolarHBondContact O-N 3.42Å
436	D	58.8	Low	56.2	Low	53 Å²	53	92.1 Å²	92.1	28%	0.283	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	15.6	-174.5	-60.8	-34.6	0	0	0	113.1	Q431 D432 G438 E439	Q431-D436 VanDerWaalsContact CA-OD2 3.23Å; Q431-D436 WeakPolarHBondContact CA-OD2 3.36Å; Q431-D436 WeakPolarHBondContact CB-OD2 3.46Å; D432-D436 PolarHBondContact N-OD2 3.27Å; D432-D436 WeakPolarHBondContact O-CB 3.48Å; D432-D436 PolarHBondContact O-N 2.83Å; D436-G438 PolarHBondContact O-N 3.44Å; D436-E439 PolarHBondContact O-N 2.67Å
437	R	59.7	Low	54.6	Low	104 Å²	104	97.4 Å²	97.4	39%	0.392	55%	0.549	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	94.2	179.2	-74.9	178	167.6	-141	-0.9	111.3	P433 A435 D521	P433-R437 WeakPolarHBondContact O-CD 3.33Å; P433-R437 WeakPolarHBondContact O-CG 3.5Å; P433-R437 PolarHBondContact O-NE 3.18Å; A435-R437 VanDerWaalsContact C-N 3.25Å; A435-R437 PolarHBondContact O-N 3.42Å; R437-D521 IonicContact CZ-OD1 2.81Å; R437-D521 IonicContact CZ-OD2 3.9Å; R437-D521 IonicContact NH1-OD1 3.97Å; R437-D521 PolarHBondContact NH1-OD1 3.17Å; R437-D521 IonicContact NH1-OD2 2.84Å; R437-D521 PolarHBondContact NH1-OD2 3.32Å; R437-D521 IonicContact NH2-OD1 2.74Å; R437-D521 IonicContact NH2-OD2 3.81Å; R437-D521 PolarHBondContact NH2-OD2 2.79Å
438	G	47.6	Very low	52.9	Low	72 Å²	72	102.3 Å²	102.3	74%	0.742	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	124.8	-8.3	175	0	0	0	0	0	113.9	D436 K440	D436-G438 PolarHBondContact O-N 3.44Å; G438-K440 VanDerWaalsContact C-N 3.32Å; G438-K440 PolarHBondContact O-N 3.36Å
439	E	51.5	Low	52.3	Low	96 Å²	96	104.3 Å²	104.3	45%	0.449	59%	0.592	S	S	.	*			trans	-63.7	101.5	156.3	-68.2	-160.4	160.5	0	0	106.3	D436 K444	D436-E439 PolarHBondContact O-N 2.67Å; E439-K444 IonicContact OE1-NZ 2.68Å; E439-K444 PolarHBondContact OE1-NZ 2.86Å; E439-K444 IonicContact OE2-NZ 2.82Å; E439-K444 PolarHBondContact OE2-NZ 3.03Å
440	K	44.8	Very low	52	Low	179 Å²	179	102.3 Å²	102.3	78%	0.778	60%	0.598	S	S	*	*			trans	-51.6	156.5	156	-75.2	-178.2	176.3	177.5	0	106.5	G438 T442	G438-K440 VanDerWaalsContact C-N 3.32Å; G438-K440 PolarHBondContact O-N 3.36Å; K440-T442 PolarHBondContact O-N 3.05Å; K440-T442 PolarHBondContact O-OG1 3.18Å
441	D	47.2	Very low	52.6	Low	163 Å²	163	105.1 Å²	105.1	87%	0.872	60%	0.604	S	S	*	*			trans	-58.3	57.5	166.5	-77	-44.2	0	0	0	111.2	A443	D441-A443 PolarHBondContact O-N 2.84Å
442	T	39.4	Very low	53.5	Low	100 Å²	100	103.2 Å²	103.2	61%	0.613	59%	0.592	S	S	*	*			trans	-73.1	81.7	160.8	42.4	0	0	0	0	104.6	K440 K444	K440-T442 PolarHBondContact O-N 3.05Å; K440-T442 PolarHBondContact O-OG1 3.18Å; T442-K444 PolarHBondContact O-N 3.27Å
443	A	41.5	Very low	54.7	Low	99 Å²	99	104.4 Å²	104.4	82%	0.818	60%	0.598	S	S	*	*			trans	21.4	55.1	146.7	0	0	0	0	0	115.1	D441 S445	D441-A443 PolarHBondContact O-N 2.84Å; A443-S445 PolarHBondContact O-N 3.33Å
444	K	43.6	Very low	55.9	Low	146 Å²	146	106.5 Å²	106.5	64%	0.635	61%	0.605	S	S	*	*			trans	-75.7	86.8	161.1	-85.9	-177.9	-175.1	159.1	0	103.9	E439 T442	E439-K444 IonicContact OE1-NZ 2.68Å; E439-K444 PolarHBondContact OE1-NZ 2.86Å; E439-K444 IonicContact OE2-NZ 2.82Å; E439-K444 PolarHBondContact OE2-NZ 3.03Å; T442-K444 PolarHBondContact O-N 3.27Å
445	S	38.3	Very low	57.2	Low	82 Å²	82	103.4 Å²	103.4	57%	0.573	59%	0.59	S	S	*	*			trans	33.2	102.3	165.4	58.1	0	0	0	0	114.9	A443 Q447	A443-S445 PolarHBondContact O-N 3.33Å; S445-Q447 PolarHBondContact O-N 2.83Å
446	L	43.8	Very low	58.9	Low	185 Å²	185	103.6 Å²	103.6	97%	0.969	57%	0.574	S	S	*	*			trans	-59.3	61	148.3	-73.2	154.2	0	0	0	109.3
447	Q	44.9	Very low	60.4	Low	144 Å²	144	101.6 Å²	101.6	67%	0.673	56%	0.564	S	S	*	*			trans	-63.9	129	152.1	-77.2	-177.2	-1.3	0	0	104.7	S445 L449	S445-Q447 PolarHBondContact O-N 2.83Å; Q447-L449 PolarHBondContact O-N 3.31Å
448	P	44.3	Very low	61.9	Low	127 Å²	127	96.7 Å²	96.7	83%	0.825	55%	0.545	S	S	*	.			trans	-56.5	109.3	173.7	22.7	-29.2	0	0	0	106	A450	P448-A450 PolarHBondContact O-N 3.4Å
449	L	59.5	Low	63.8	Low	107 Å²	107	95.8 Å²	95.8	56%	0.56	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-58	129	-177	-130.3	82.7	0	0	0	107.2	N428 Q447	N428-L449 HydrophobicContact CB-CD2 3.26Å; N428-L449 WeakPolarHBondContact O-CD2 3.43Å; Q447-L449 PolarHBondContact O-N 3.31Å
450	A	63.1	Low	65.6	Low	79 Å²	79	92.9 Å²	92.9	65%	0.653	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-52.9	134.7	-177.2	0	0	0	0	0	109.5	P448 R452	P448-A450 PolarHBondContact O-N 3.4Å; A450-R452 PolarHBondContact O-N 3.25Å
451	P	71.7	Confident	67.6	Low	129 Å²	129	93.3 Å²	93.3	84%	0.838	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-57.2	129.8	179.4	22.5	-31.7	0	0	0	109.3	N453	P451-N453 PolarHBondContact O-N 2.93Å
452	R	82	Confident	69.5	Low	61 Å²	61	85.6 Å²	85.6	23%	0.23	47%	0.469	C	S	.	.	P	Polyproline II helix	trans	-59	129	179.2	178.1	-169.6	171.7	83.3	28.3	109.2	A450 K454 V458	A450-R452 PolarHBondContact O-N 3.25Å; R452-K454 PolarHBondContact O-N 2.86Å; R452-K454 VanDerWaalsContact O-N 3.13Å; R452-V458 VanDerWaalsContact NH2-CA 3.29Å
453	N	85.3	Confident	71.7	Confident	86 Å²	86	81.5 Å²	81.5	46%	0.46	44%	0.444	S	S	.	.			trans	-69.9	108.4	166.9	-171.5	-26.6	0	0	0	109.3	P451 T455 R456	P451-N453 PolarHBondContact O-N 2.93Å; N453-T455 VanDerWaalsContact C-N 3.27Å; N453-T455 PolarHBondContact O-N 2.88Å; N453-T455 PolarHBondContact OD1-N 3.33Å; N453-T455 VanDerWaalsContact OD1-N 3.09Å; N453-T455 PolarHBondContact OD1-OG1 2.87Å; N453-R456 HydrophobicContact CB-CG 4.39Å; N453-R456 PolarHBondContact O-N 3.16Å
454	K	89.3	Confident	73.8	Confident	65 Å²	65	82.5 Å²	82.5	28%	0.283	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-19.4	-175.8	-66.5	-175.7	176.9	-177	0	114	E416 K417 E418 R452	E416-K454 HydrophobicContact CB-CB 3.9Å; E416-K454 HydrophobicContact CB-CD 4.36Å; E416-K454 HydrophobicContact CG-CB 4.02Å; K417-K454 PolarHBondContact N-O 3.02Å; E418-K454 IonicContact OE1-NZ 3.11Å; E418-K454 PolarHBondContact OE1-NZ 2.91Å; R452-K454 PolarHBondContact O-N 2.86Å; R452-K454 VanDerWaalsContact O-N 3.13Å
455	T	89.9	Confident	75.8	Confident	18 Å²	18	79.5 Å²	79.5	11%	0.11	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-17.8	-179.7	66.8	0	0	0	0	112.6	I388 Y389 L414 W415 E416 N453	I388-T455 CarbonylContact C-O 3.56Å; I388-T455 WeakPolarHBondContact CA-O 3.38Å; Y389-T455 PolarHBondContact N-O 2.86Å; L414-T455 HydrophobicContact CB-CG2 3.87Å; W415-T455 WeakPolarHBondContact O-CA 3.5Å; E416-T455 HydrophobicContact CG-CG2 3.76Å; N453-T455 VanDerWaalsContact C-N 3.27Å; N453-T455 PolarHBondContact O-N 2.88Å; N453-T455 PolarHBondContact OD1-N 3.33Å; N453-T455 VanDerWaalsContact OD1-N 3.09Å; N453-T455 PolarHBondContact OD1-OG1 2.87Å
456	R	90	Very high	78.2	Confident	80 Å²	80	75.6 Å²	75.6	30%	0.302	40%	0.395	S	S	.	.	B	Isolated β-bridge	trans	-77.7	141.5	175	-75.2	-170.9	168.1	-125.4	-8.5	111.6	E386 G387 I388 N453 V458	E386-R456 IonicContact OE1-NH1 2.78Å; E386-R456 PolarHBondContact OE1-NH1 2.82Å; E386-R456 IonicContact OE2-CZ 2.65Å; E386-R456 IonicContact OE2-NH1 3.98Å; E386-R456 PolarHBondContact OE2-NH1 2.89Å; E386-R456 IonicContact OE2-NH2 3.69Å; G387-R456 CarbonylContact O-C 3.54Å; G387-R456 WeakPolarHBondContact O-CA 3.38Å; I388-R456 HydrophobicContact CG2-CG 4.46Å; N453-R456 HydrophobicContact CB-CG 4.39Å; N453-R456 PolarHBondContact O-N 3.16Å; R456-V458 PolarHBondContact O-N 2.84Å
457	V	91.1	Very high	80.4	Confident	12 Å²	12	66.8 Å²	66.8	7%	0.073	35%	0.349	C	S	.	.			trans	-56.6	131.7	177.4	171.5	0	0	0	0	109.7	G387 Y389 A400 I402 S459	G387-V457 VanDerWaalsContact C-CG2 3.42Å; G387-V457 PolarHBondContact O-N 3.15Å; Y389-V457 HydrophobicContact CD1-CG2 4.23Å; Y389-V457 HydrophobicContact CE1-CG2 3.97Å; Y389-V457 HydrophobicContact CE2-CG2 4.36Å; A400-V457 HydrophobicContact CB-CG2 3.81Å; I402-V457 HydrophobicContact CG2-CG2 4.26Å; V457-S459 PolarHBondContact O-N 2.78Å
458	V	90.6	Very high	82.6	Confident	0 Å²	0	60 Å²	60	0%	0	32%	0.317	C	S	.	.			trans	-75.6	107.5	177.8	-172.2	0	0	0	0	108.3	Y389 K417 L419 L427 R452 R456 S488 L489 F495	Y389-V458 HydrophobicContact CE2-CG2 4.4Å; Y389-V458 PolarHBondContact OH-N 3.49Å; K417-V458 HydrophobicContact CD-CG2 3.8Å; L419-V458 HydrophobicContact CD1-CG1 3.94Å; L419-V458 HydrophobicContact CD1-CG2 3.83Å; L419-V458 HydrophobicContact CD2-CG2 4.45Å; L419-V458 HydrophobicContact CG-CG2 4.38Å; L427-V458 HydrophobicContact CD1-CG1 3.67Å; R452-V458 VanDerWaalsContact NH2-CA 3.29Å; R456-V458 PolarHBondContact O-N 2.84Å; V458-S488 WeakPolarHBondContact O-CA 3.5Å; V458-L489 HydrophobicContact CB-CB 4.11Å; V458-L489 HydrophobicContact CB-CD1 3.83Å; V458-L489 HydrophobicContact CB-CG 4.05Å; V458-L489 HydrophobicContact CG1-CD1 3.85Å; V458-L489 HydrophobicContact CG1-CG 4.28Å; V458-L489 HydrophobicContact CG2-CD1 4.26Å; V458-L489 PolarHBondContact O-N 2.9Å; V458-F495 HydrophobicContact CG1-CE2 3.82Å
459	S	88.6	Confident	84.9	Confident	54 Å²	54	55.1 Å²	55.1	38%	0.378	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	144.8	170.9	60.1	0	0	0	0	111.4	V457 V487	V457-S459 PolarHBondContact O-N 2.78Å; S459-V487 CarbonylContact C-O 3.53Å; S459-V487 WeakPolarHBondContact CA-O 3.38Å
460	Y	87.9	Confident	86.4	Confident	35 Å²	35	50 Å²	50	14%	0.137	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	127	173.3	-179.3	-106.9	0	0	0	109.7	L427 V462 V468 V487 F495 L514 C515	L427-Y460 HydrophobicContact CD2-CD2 3.59Å; L427-Y460 HydrophobicContact CD2-CE2 4.43Å; L427-Y460 HydrophobicContact CD2-CG 4.09Å; Y460-V462 HydrophobicContact CD1-CG2 4.34Å; Y460-V462 PolarHBondContact O-N 2.96Å; Y460-V468 HydrophobicContact CD1-CG2 3.94Å; Y460-V468 HydrophobicContact CE1-CG2 3.74Å; Y460-V487 PolarHBondContact N-O 2.74Å; Y460-V487 PolarHBondContact O-N 2.81Å; Y460-F495 VanDerWaalsContact CB-CZ 3.48Å; Y460-F495 HydrophobicContact CG-CZ 4.38Å; Y460-L514 HydrophobicContact CD1-CD2 3.91Å; Y460-L514 HydrophobicContact CD2-CD2 3.68Å; Y460-L514 HydrophobicContact CE1-CD2 4.02Å; Y460-L514 HydrophobicContact CE2-CD2 3.78Å; Y460-L514 HydrophobicContact CG-CD2 3.73Å; Y460-C515 HydrophobicContact CE1-CB 4.29Å
461	R	86.9	Confident	87.6	Confident	188 Å²	188	50.1 Å²	50.1	71%	0.709	24%	0.24	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-82.2	113.2	175.9	-170.3	175.2	-170.4	143.5	2.9	109.1	P463 L486	R461-P463 WeakPolarHBondContact O-CD 3.33Å; R461-L486 HydrophobicContact CB-CD1 4.23Å
462	V	88.1	Confident	88.5	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.006	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-73.7	126.2	179.8	-176	0	0	0	0	108.5	Y460 A466 V468 P484 E485 V487	Y460-V462 HydrophobicContact CD1-CG2 4.34Å; Y460-V462 PolarHBondContact O-N 2.96Å; V462-A466 HydrophobicContact CG1-CB 4Å; V462-V468 HydrophobicContact CB-CG2 4.43Å; V462-V468 HydrophobicContact CG1-CG2 4.05Å; V462-V468 HydrophobicContact CG2-CB 4.11Å; V462-V468 HydrophobicContact CG2-CG2 3.73Å; V462-P484 WeakPolarHBondContact O-CA 3.43Å; V462-E485 WeakPolarHBondContact CB-O 3.4Å; V462-E485 WeakPolarHBondContact CG2-O 3.49Å; V462-E485 PolarHBondContact N-O 2.88Å; V462-V487 HydrophobicContact CG2-CG2 3.56Å
463	P	86.4	Confident	88.7	Confident	13 Å²	13	48.7 Å²	48.7	8%	0.084	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-61.5	160.7	177.6	-23.4	33.3	0	0	0	113.1	P433 R461 A466 G483	P433-P463 HydrophobicContact CG-CG 4.03Å; R461-P463 WeakPolarHBondContact O-CD 3.33Å; P463-A466 HydrophobicContact CB-CB 4.08Å; P463-A466 HydrophobicContact CG-CB 4.39Å; P463-A466 WeakPolarHBondContact O-CB 3.24Å; P463-A466 PolarHBondContact O-N 3.08Å; P463-G483 WeakPolarHBondContact O-CA 3.33Å
464	H	83.8	Confident	88.7	Confident	120 Å²	120	51.9 Å²	51.9	56%	0.556	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	142.3	172.5	-66.1	86	0	0	0	110.6	A466	H464-A466 PolarHBondContact O-N 3.4Å
465	N	86.4	Confident	88.5	Confident	84 Å²	84	54 Å²	54	45%	0.449	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.9	33.7	-175.6	-66.5	-18.9	0	0	0	113.8	L518	N465-L518 WeakPolarHBondContact O-CB 3.34Å; N465-L518 PolarHBondContact O-N 3.34Å
466	A	89.1	Confident	88.3	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	159.7	172.1	0	0	0	0	0	111.1	V462 P463 H464 G483 C515 L516 L517	V462-A466 HydrophobicContact CG1-CB 4Å; P463-A466 HydrophobicContact CB-CB 4.08Å; P463-A466 HydrophobicContact CG-CB 4.39Å; P463-A466 WeakPolarHBondContact O-CB 3.24Å; P463-A466 PolarHBondContact O-N 3.08Å; H464-A466 PolarHBondContact O-N 3.4Å; A466-G483 PolarHBondContact O-N 2.89Å; A466-C515 HydrophobicContact CB-CB 4.07Å; A466-L516 CarbonylContact C-O 3.57Å; A466-L516 WeakPolarHBondContact CA-O 3.45Å; A466-L516 WeakPolarHBondContact CB-O 3.27Å; A466-L517 HydrophobicContact CB-CD2 4.04Å
467	A	90.2	Very high	88.1	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	144.8	171.6	0	0	0	0	0	109.5	V480 V481 F482 C515 L516 L518 F562	A467-V480 HydrophobicContact CB-CG1 3.91Å; A467-V481 CarbonylContact C-O 3.59Å; A467-V481 WeakPolarHBondContact CA-O 3.05Å; A467-F482 HydrophobicContact CB-CD1 3.93Å; A467-F482 HydrophobicContact CB-CE1 3.94Å; A467-C515 CarbonylContact O-C 3.56Å; A467-C515 WeakPolarHBondContact O-CA 3.21Å; A467-L516 PolarHBondContact N-O 2.88Å; A467-L516 PolarHBondContact O-N 3.46Å; A467-L518 HydrophobicContact CB-CD1 4.35Å; A467-L518 HydrophobicContact CB-CD2 4.22Å; A467-L518 HydrophobicContact CB-CG 4.48Å; A467-F562 HydrophobicContact CB-CE2 4.16Å; A467-F562 HydrophobicContact CB-CZ 4.08Å
468	V	91.3	Very high	87.9	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	135.9	172.5	174.1	0	0	0	0	108.3	Y460 V462 V470 V480 V481 F495 C515	Y460-V468 HydrophobicContact CD1-CG2 3.94Å; Y460-V468 HydrophobicContact CE1-CG2 3.74Å; V462-V468 HydrophobicContact CB-CG2 4.43Å; V462-V468 HydrophobicContact CG1-CG2 4.05Å; V462-V468 HydrophobicContact CG2-CB 4.11Å; V462-V468 HydrophobicContact CG2-CG2 3.73Å; V468-V470 HydrophobicContact CG1-CG2 4.36Å; V468-V480 WeakPolarHBondContact O-CA 3.39Å; V468-V481 PolarHBondContact N-O 2.97Å; V468-V481 PolarHBondContact O-N 3.3Å; V468-F495 HydrophobicContact CG1-CD1 3.45Å; V468-F495 VanDerWaalsContact CG1-CD1 3.45Å; V468-F495 HydrophobicContact CG1-CE1 3.72Å; V468-C515 HydrophobicContact CG2-CB 3.53Å
469	Q	91	Very high	87.8	Confident	26 Å²	26	72.8 Å²	72.8	12%	0.121	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	124.6	173.1	-176.8	178.8	48.9	0	0	109.8	A478 V480 T496 F562	Q469-A478 HydrophobicContact CG-CB 4.32Å; Q469-V480 HydrophobicContact CB-CG2 4.41Å; Q469-V480 HydrophobicContact CG-CG2 4.36Å; Q469-T496 PolarHBondContact O-N 3.49Å; Q469-T496 PolarHBondContact O-OG1 2.98Å; Q469-T496 PolarHBondContact OE1-OG1 2.97Å; Q469-F562 HydrophobicContact CB-CD1 3.68Å; Q469-F562 HydrophobicContact CB-CD2 3.89Å; Q469-F562 HydrophobicContact CB-CE1 3.67Å; Q469-F562 HydrophobicContact CB-CE2 3.89Å; Q469-F562 HydrophobicContact CB-CG 3.81Å; Q469-F562 HydrophobicContact CB-CZ 3.78Å; Q469-F562 HydrophobicContact CG-CD2 4.47Å; Q469-F562 HydrophobicContact CG-CG 4.36Å; Q469-F562 VanDerWaalsContact OE1-CB 3.3Å
470	V	91.8	Very high	87.9	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	130.1	173.8	-179.6	0	0	0	0	108.4	V468 A478 R479 V487 L489 E493 Q494 F495	V468-V470 HydrophobicContact CG1-CG2 4.36Å; V470-A478 CarbonylContact O-C 3.54Å; V470-A478 WeakPolarHBondContact O-CA 3.27Å; V470-R479 HydrophobicContact CB-CG 4.1Å; V470-R479 PolarHBondContact N-O 2.93Å; V470-R479 PolarHBondContact O-N 2.93Å; V470-V487 HydrophobicContact CG2-CG1 3.65Å; V470-L489 HydrophobicContact CB-CD2 4.44Å; V470-L489 HydrophobicContact CG1-CD2 3.61Å; V470-L489 HydrophobicContact CG2-CD2 3.92Å; V470-E493 HydrophobicContact CG1-CB 3.66Å; V470-E493 HydrophobicContact CG1-CG 4.05Å; V470-Q494 WeakPolarHBondContact CA-O 3.34Å; V470-F495 HydrophobicContact CG2-CD1 3.99Å; V470-F495 HydrophobicContact CG2-CE1 3.99Å
471	Y	89.1	Confident	88	Confident	80 Å²	80	70.7 Å²	70.7	31%	0.314	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	119.9	176.5	-168.9	-95.8	0	0	0	109.9	Y473 A478 E493 Q494	Y471-Y473 HydrophobicContact CD1-CD1 4.19Å; Y471-Y473 AromaticContact CD1-CD2 3.85Å; Y471-Y473 HydrophobicContact CD1-CD2 3.85Å; Y471-Y473 HydrophobicContact CD1-CE1 4.17Å; Y471-Y473 AromaticContact CD1-CE2 3.83Å; Y471-Y473 HydrophobicContact CD1-CE2 3.83Å; Y471-Y473 HydrophobicContact CD1-CG 4.04Å; Y471-Y473 HydrophobicContact CE1-CD1 4.01Å; Y471-Y473 HydrophobicContact CE1-CD2 4.44Å; Y471-Y473 HydrophobicContact CE1-CE1 4.16Å; Y471-Y473 HydrophobicContact CE1-CG 4.16Å; Y471-A478 HydrophobicContact CD2-CB 3.97Å; Y471-E493 CarbonylContact O-C 3.55Å; Y471-E493 VanDerWaalsContact O-CA 3.31Å; Y471-E493 WeakPolarHBondContact O-CA 3.34Å; Y471-Q494 PolarHBondContact N-O 3.26Å; Y471-Q494 PolarHBondContact O-N 2.89Å
472	D	89.2	Confident	88.1	Confident	20 Å²	20	63.3 Å²	63.3	11%	0.107	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	114.2	170.9	-171.4	-35.6	0	0	0	109.3	R474 E475 K476 R477 E493	D472-R474 VanDerWaalsContact C-N 3.34Å; D472-R474 WeakPolarHBondContact OD1-CA 3.42Å; D472-R474 VanDerWaalsContact OD1-CB 3.32Å; D472-R474 WeakPolarHBondContact OD1-CB 3.36Å; D472-R474 PolarHBondContact OD1-N 2.87Å; D472-E475 HydrophobicContact CB-CB 4.32Å; D472-E475 PolarHBondContact OD1-N 2.79Å; D472-K476 WeakPolarHBondContact O-CA 3.48Å; D472-K476 PolarHBondContact O-N 2.82Å; D472-R477 PolarHBondContact N-O 2.95Å; D472-R477 PolarHBondContact O-N 3.3Å; D472-E493 HydrophobicContact CB-CG 3.96Å
473	Y	86.1	Confident	88	Confident	141 Å²	141	64.1 Å²	64.1	55%	0.553	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-25.8	179.7	-80.3	-90.7	0	0	0	113.5	Y471 E492 Q494	Y471-Y473 HydrophobicContact CD1-CD1 4.19Å; Y471-Y473 AromaticContact CD1-CD2 3.85Å; Y471-Y473 HydrophobicContact CD1-CD2 3.85Å; Y471-Y473 HydrophobicContact CD1-CE1 4.17Å; Y471-Y473 AromaticContact CD1-CE2 3.83Å; Y471-Y473 HydrophobicContact CD1-CE2 3.83Å; Y471-Y473 HydrophobicContact CD1-CG 4.04Å; Y471-Y473 HydrophobicContact CE1-CD1 4.01Å; Y471-Y473 HydrophobicContact CE1-CD2 4.44Å; Y471-Y473 HydrophobicContact CE1-CE1 4.16Å; Y471-Y473 HydrophobicContact CE1-CG 4.16Å; Y473-E492 WeakPolarHBondContact CD2-O 3.23Å; Y473-E492 PolarHBondContact N-O 3.49Å; Y473-Q494 HydrophobicContact CD2-CB 4.43Å; Y473-Q494 HydrophobicContact CD2-CG 4.01Å; Y473-Q494 HydrophobicContact CE2-CB 3.81Å; Y473-Q494 HydrophobicContact CE2-CG 3.59Å
474	R	85.3	Confident	87.9	Confident	153 Å²	153	66.9 Å²	66.9	58%	0.577	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-46.7	179.9	-169.2	179.8	69.5	-174.7	0.1	110.8	D472 E492	D472-R474 VanDerWaalsContact C-N 3.34Å; D472-R474 WeakPolarHBondContact OD1-CA 3.42Å; D472-R474 VanDerWaalsContact OD1-CB 3.32Å; D472-R474 WeakPolarHBondContact OD1-CB 3.36Å; D472-R474 PolarHBondContact OD1-N 2.87Å; R474-E492 HydrophobicContact CB-CB 4Å; R474-E492 HydrophobicContact CB-CG 4.17Å
475	E	84.8	Confident	88.1	Confident	108 Å²	108	67.2 Å²	67.2	51%	0.505	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-12	178.6	-63.5	-168.4	-176.9	0	0	113.2	D472 R477	D472-E475 HydrophobicContact CB-CB 4.32Å; D472-E475 PolarHBondContact OD1-N 2.79Å; E475-R477 HydrophobicContact CB-CB 4.39Å; E475-R477 HydrophobicContact CB-CG 4.43Å; E475-R477 PolarHBondContact O-N 2.99Å
476	K	85.9	Confident	88.1	Confident	161 Å²	161	66.1 Å²	66.1	70%	0.7	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	36	-174.4	-59.2	-179.7	179.6	178.6	0	112.5	D472	D472-K476 WeakPolarHBondContact O-CA 3.48Å; D472-K476 PolarHBondContact O-N 2.82Å
477	R	86.2	Confident	88.1	Confident	180 Å²	180	66.3 Å²	66.3	68%	0.679	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119	135.5	-177.3	-74.4	178.7	176.4	-169.9	-1.9	110.2	D472 E475	D472-R477 PolarHBondContact N-O 2.95Å; D472-R477 PolarHBondContact O-N 3.3Å; E475-R477 HydrophobicContact CB-CB 4.39Å; E475-R477 HydrophobicContact CB-CG 4.43Å; E475-R477 PolarHBondContact O-N 2.99Å
478	A	86.5	Confident	88.1	Confident	46 Å²	46	68 Å²	68	38%	0.38	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	133.8	169.3	0	0	0	0	0	108.9	Q469 V470 Y471	Q469-A478 HydrophobicContact CG-CB 4.32Å; V470-A478 CarbonylContact O-C 3.54Å; V470-A478 WeakPolarHBondContact O-CA 3.27Å; Y471-A478 HydrophobicContact CD2-CB 3.97Å
479	R	89.4	Confident	88.1	Confident	118 Å²	118	68.1 Å²	68.1	45%	0.445	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	140.8	167.8	62.5	-179.1	176.4	146	4.2	109.9	V470 E493	V470-R479 HydrophobicContact CB-CG 4.1Å; V470-R479 PolarHBondContact N-O 2.93Å; V470-R479 PolarHBondContact O-N 2.93Å; R479-E493 IonicContact CZ-OE1 2.74Å; R479-E493 IonicContact CZ-OE2 3.21Å; R479-E493 IonicContact NE-OE1 3.17Å; R479-E493 PolarHBondContact NE-OE1 2.93Å; R479-E493 IonicContact NE-OE2 2.87Å; R479-E493 VanDerWaalsContact NH2-CD 3.27Å; R479-E493 IonicContact NH2-OE1 2.91Å; R479-E493 PolarHBondContact NH2-OE1 3.01Å; R479-E493 IonicContact NH2-OE2 3.95Å; R479-E493 PolarHBondContact NH2-OE2 3.42Å
480	V	90.3	Very high	88	Confident	26 Å²	26	67.7 Å²	67.7	16%	0.158	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	128.5	177	178.1	0	0	0	0	107.9	A467 V468 Q469 F482 F562	A467-V480 HydrophobicContact CB-CG1 3.91Å; V468-V480 WeakPolarHBondContact O-CA 3.39Å; Q469-V480 HydrophobicContact CB-CG2 4.41Å; Q469-V480 HydrophobicContact CG-CG2 4.36Å; V480-F482 HydrophobicContact CG1-CE2 4.18Å; V480-F482 HydrophobicContact CG1-CZ 4.17Å; V480-F562 HydrophobicContact CG1-CE2 3.77Å; V480-F562 HydrophobicContact CG2-CD2 3.97Å; V480-F562 HydrophobicContact CG2-CE2 3.9Å
481	V	90.2	Very high	87.9	Confident	19 Å²	19	68.6 Å²	68.6	12%	0.115	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	129.7	176.9	-173.8	0	0	0	0	108.9	A467 V468 E485 V487	A467-V481 CarbonylContact C-O 3.59Å; A467-V481 WeakPolarHBondContact CA-O 3.05Å; V468-V481 PolarHBondContact N-O 2.97Å; V468-V481 PolarHBondContact O-N 3.3Å; V481-E485 HydrophobicContact CG1-CB 4.12Å; V481-E485 HydrophobicContact CG1-CG 4.46Å; V481-V487 HydrophobicContact CB-CG2 3.49Å; V481-V487 VanDerWaalsContact CB-CG2 3.49Å; V481-V487 HydrophobicContact CG1-CG2 3.5Å; V481-V487 VanDerWaalsContact CG1-CG2 3.5Å; V481-V487 HydrophobicContact CG2-CG2 3.81Å
482	F	89.8	Confident	87.9	Confident	33 Å²	33	68.7 Å²	68.7	15%	0.145	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	142.5	179.4	-69.1	-82.9	0	0	0	110.6	A467 V480 L518 R552 T558 L561	A467-F482 HydrophobicContact CB-CD1 3.93Å; A467-F482 HydrophobicContact CB-CE1 3.94Å; V480-F482 HydrophobicContact CG1-CE2 4.18Å; V480-F482 HydrophobicContact CG1-CZ 4.17Å; F482-L518 HydrophobicContact CD1-CD1 3.68Å; F482-L518 HydrophobicContact CE1-CD1 3.7Å; F482-R552 HydrophobicContact CE2-CB 4.16Å; F482-T558 HydrophobicContact CE2-CG2 3.62Å; F482-T558 HydrophobicContact CZ-CG2 3.74Å; F482-L561 HydrophobicContact CE1-CD1 3.93Å; F482-L561 HydrophobicContact CZ-CD1 3.91Å
483	G	84.6	Confident	87.9	Confident	18 Å²	18	68.4 Å²	68.4	19%	0.186	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	156.2	173	0	0	0	0	0	112.6	P463 A466	P463-G483 WeakPolarHBondContact O-CA 3.33Å; A466-G483 PolarHBondContact O-N 2.89Å
484	P	85.6	Confident	88.1	Confident	71 Å²	71	63.5 Å²	63.5	46%	0.461	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	cis	-94.6	28.7	11.3	36.9	-36.1	0	0	0	115.7	V462	V462-P484 WeakPolarHBondContact O-CA 3.43Å
485	E	86.8	Confident	88.4	Confident	128 Å²	128	56.7 Å²	56.7	60%	0.598	28%	0.283	S	S	*	.	S	Bend	trans	-70.3	151.7	-177.3	-162.4	173.1	175.7	0	0	113.4	V462 V481	V462-E485 WeakPolarHBondContact CB-O 3.4Å; V462-E485 WeakPolarHBondContact CG2-O 3.49Å; V462-E485 PolarHBondContact N-O 2.88Å; V481-E485 HydrophobicContact CG1-CB 4.12Å; V481-E485 HydrophobicContact CG1-CG 4.46Å
486	L	86.8	Confident	88.6	Confident	61 Å²	61	53.7 Å²	53.7	32%	0.319	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	126.8	172	-174.8	98	0	0	0	109.4	N385 R461	N385-L486 HydrophobicContact CB-CD2 4Å; R461-L486 HydrophobicContact CB-CD1 4.23Å
487	V	89.8	Confident	88.7	Confident	4 Å²	4	48 Å²	48	2%	0.024	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	122.4	176.5	178.9	0	0	0	0	109.5	S459 Y460 V462 V470 V481 L489 F495	S459-V487 CarbonylContact C-O 3.53Å; S459-V487 WeakPolarHBondContact CA-O 3.38Å; Y460-V487 PolarHBondContact N-O 2.74Å; Y460-V487 PolarHBondContact O-N 2.81Å; V462-V487 HydrophobicContact CG2-CG2 3.56Å; V470-V487 HydrophobicContact CG2-CG1 3.65Å; V481-V487 HydrophobicContact CB-CG2 3.49Å; V481-V487 VanDerWaalsContact CB-CG2 3.49Å; V481-V487 HydrophobicContact CG1-CG2 3.5Å; V481-V487 VanDerWaalsContact CG1-CG2 3.5Å; V481-V487 HydrophobicContact CG2-CG2 3.81Å; V487-L489 HydrophobicContact CG1-CD2 4.48Å; V487-F495 HydrophobicContact CB-CE1 4.44Å; V487-F495 HydrophobicContact CG1-CE1 3.97Å; V487-F495 HydrophobicContact CG1-CZ 4.44Å
488	S	89.8	Confident	88.8	Confident	35 Å²	35	39.9 Å²	39.9	25%	0.245	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	123.6	171.5	-63.1	0	0	0	0	109.9	V458	V458-S488 WeakPolarHBondContact O-CA 3.5Å
489	L	90.7	Very high	89	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.01	21%	0.214	C	C	.	.			trans	-76.3	132.1	179.5	-62.5	-174	0	0	0	111.2	Y389 L419 V458 V470 V487 E493 F495	Y389-L489 WeakPolarHBondContact CE1-O 3.32Å; Y389-L489 PolarHBondContact OH-O 2.84Å; L419-L489 HydrophobicContact CD2-CD1 4.43Å; V458-L489 HydrophobicContact CB-CB 4.11Å; V458-L489 HydrophobicContact CB-CD1 3.83Å; V458-L489 HydrophobicContact CB-CG 4.05Å; V458-L489 HydrophobicContact CG1-CD1 3.85Å; V458-L489 HydrophobicContact CG1-CG 4.28Å; V458-L489 HydrophobicContact CG2-CD1 4.26Å; V458-L489 PolarHBondContact O-N 2.9Å; V470-L489 HydrophobicContact CB-CD2 4.44Å; V470-L489 HydrophobicContact CG1-CD2 3.61Å; V470-L489 HydrophobicContact CG2-CD2 3.92Å; V487-L489 HydrophobicContact CG1-CD2 4.48Å; L489-E493 WeakPolarHBondContact CA-OE2 3.46Å; L489-E493 HydrophobicContact CB-CB 4.24Å; L489-E493 HydrophobicContact CD2-CB 4.12Å; L489-F495 HydrophobicContact CD1-CD2 3.72Å; L489-F495 HydrophobicContact CD1-CE2 3.54Å; L489-F495 HydrophobicContact CD1-CG 4.33Å; L489-F495 HydrophobicContact CD1-CZ 4.02Å; L489-F495 HydrophobicContact CD2-CD1 4.05Å; L489-F495 HydrophobicContact CD2-CD2 4.4Å; L489-F495 HydrophobicContact CD2-CE1 3.71Å; L489-F495 HydrophobicContact CD2-CE2 4.09Å; L489-F495 HydrophobicContact CD2-CG 4.36Å; L489-F495 HydrophobicContact CD2-CZ 3.72Å; L489-F495 HydrophobicContact CG-CD2 4.35Å; L489-F495 HydrophobicContact CG-CE1 4.28Å; L489-F495 HydrophobicContact CG-CE2 3.81Å; L489-F495 HydrophobicContact CG-CZ 3.75Å
490	G	89.6	Confident	89	Confident	17 Å²	17	34.5 Å²	34.5	18%	0.175	20%	0.197	C	C	.	.			trans	-65.1	171	161.2	0	0	0	0	0	112.2	K417 E492 E493	K417-G490 PolarHBondContact NZ-O 2.91Å; G490-E492 VanDerWaalsContact C-N 3.34Å; G490-E492 PolarHBondContact O-N 2.96Å; G490-E493 PolarHBondContact N-OE2 3.26Å; G490-E493 PolarHBondContact O-N 2.81Å
491	P	88.8	Confident	88.9	Confident	19 Å²	19	33.8 Å²	33.8	12%	0.123	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-43	-177.3	-25.7	33.7	0	0	0	114	Y389 V398 W415 K417	Y389-P491 HydrophobicContact CD1-CB 4.43Å; Y389-P491 HydrophobicContact CD1-CG 4.04Å; Y389-P491 HydrophobicContact CE1-CG 4.29Å; V398-P491 HydrophobicContact CB-CB 3.98Å; V398-P491 HydrophobicContact CB-CG 4.2Å; V398-P491 HydrophobicContact CG1-CB 3.62Å; V398-P491 HydrophobicContact CG1-CG 3.79Å; W415-P491 HydrophobicContact CZ3-CB 4.15Å; K417-P491 PolarHBondContact NZ-O 2.61Å
492	E	88.7	Confident	88.8	Confident	83 Å²	83	34 Å²	34	39%	0.388	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	10	-177.2	-61.4	-59	150.8	0	0	113.2	Y473 R474 G490	Y473-E492 WeakPolarHBondContact CD2-O 3.23Å; Y473-E492 PolarHBondContact N-O 3.49Å; R474-E492 HydrophobicContact CB-CB 4Å; R474-E492 HydrophobicContact CB-CG 4.17Å; G490-E492 VanDerWaalsContact C-N 3.34Å; G490-E492 PolarHBondContact O-N 2.96Å
493	E	90.8	Very high	88.5	Confident	14 Å²	14	34.5 Å²	34.5	7%	0.065	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	140.7	178.7	-68.6	-167.2	140.7	0	0	111.8	K417 V470 Y471 D472 R479 L489 G490	K417-E493 WeakPolarHBondContact CE-O 3.49Å; K417-E493 PolarHBondContact NZ-O 2.91Å; V470-E493 HydrophobicContact CG1-CB 3.66Å; V470-E493 HydrophobicContact CG1-CG 4.05Å; Y471-E493 CarbonylContact O-C 3.55Å; Y471-E493 VanDerWaalsContact O-CA 3.31Å; Y471-E493 WeakPolarHBondContact O-CA 3.34Å; D472-E493 HydrophobicContact CB-CG 3.96Å; R479-E493 IonicContact CZ-OE1 2.74Å; R479-E493 IonicContact CZ-OE2 3.21Å; R479-E493 IonicContact NE-OE1 3.17Å; R479-E493 PolarHBondContact NE-OE1 2.93Å; R479-E493 IonicContact NE-OE2 2.87Å; R479-E493 VanDerWaalsContact NH2-CD 3.27Å; R479-E493 IonicContact NH2-OE1 2.91Å; R479-E493 PolarHBondContact NH2-OE1 3.01Å; R479-E493 IonicContact NH2-OE2 3.95Å; R479-E493 PolarHBondContact NH2-OE2 3.42Å; L489-E493 WeakPolarHBondContact CA-OE2 3.46Å; L489-E493 HydrophobicContact CB-CB 4.24Å; L489-E493 HydrophobicContact CD2-CB 4.12Å; G490-E493 PolarHBondContact N-OE2 3.26Å; G490-E493 PolarHBondContact O-N 2.81Å
494	Q	90.4	Very high	88.5	Confident	38 Å²	38	40.7 Å²	40.7	18%	0.178	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	150.8	175	-65.2	-73.7	-17.7	0	0	110.8	V470 Y471 Y473	V470-Q494 WeakPolarHBondContact CA-O 3.34Å; Y471-Q494 PolarHBondContact N-O 3.26Å; Y471-Q494 PolarHBondContact O-N 2.89Å; Y473-Q494 HydrophobicContact CD2-CB 4.43Å; Y473-Q494 HydrophobicContact CD2-CG 4.01Å; Y473-Q494 HydrophobicContact CE2-CB 3.81Å; Y473-Q494 HydrophobicContact CE2-CG 3.59Å
495	F	90.7	Very high	88.5	Confident	10 Å²	10	40.6 Å²	40.6	4%	0.044	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	137.2	169.7	-68.6	-61.1	0	0	0	111	V423 L427 V458 Y460 V468 V470 V487 L489 V497 L514	V423-F495 HydrophobicContact CG1-CD2 4.12Å; L427-F495 HydrophobicContact CD1-CE2 4.35Å; L427-F495 HydrophobicContact CD2-CD2 4.38Å; L427-F495 HydrophobicContact CD2-CE2 3.89Å; V458-F495 HydrophobicContact CG1-CE2 3.82Å; Y460-F495 VanDerWaalsContact CB-CZ 3.48Å; Y460-F495 HydrophobicContact CG-CZ 4.38Å; V468-F495 HydrophobicContact CG1-CD1 3.45Å; V468-F495 VanDerWaalsContact CG1-CD1 3.45Å; V468-F495 HydrophobicContact CG1-CE1 3.72Å; V470-F495 HydrophobicContact CG2-CD1 3.99Å; V470-F495 HydrophobicContact CG2-CE1 3.99Å; V487-F495 HydrophobicContact CB-CE1 4.44Å; V487-F495 HydrophobicContact CG1-CE1 3.97Å; V487-F495 HydrophobicContact CG1-CZ 4.44Å; L489-F495 HydrophobicContact CD1-CD2 3.72Å; L489-F495 HydrophobicContact CD1-CE2 3.54Å; L489-F495 HydrophobicContact CD1-CG 4.33Å; L489-F495 HydrophobicContact CD1-CZ 4.02Å; L489-F495 HydrophobicContact CD2-CD1 4.05Å; L489-F495 HydrophobicContact CD2-CD2 4.4Å; L489-F495 HydrophobicContact CD2-CE1 3.71Å; L489-F495 HydrophobicContact CD2-CE2 4.09Å; L489-F495 HydrophobicContact CD2-CG 4.36Å; L489-F495 HydrophobicContact CD2-CZ 3.72Å; L489-F495 HydrophobicContact CG-CD2 4.35Å; L489-F495 HydrophobicContact CG-CE1 4.28Å; L489-F495 HydrophobicContact CG-CE2 3.81Å; L489-F495 HydrophobicContact CG-CZ 3.75Å; F495-V497 PolarHBondContact O-N 3.34Å; F495-L514 HydrophobicContact CB-CD1 3.35Å; F495-L514 HydrophobicContact CB-CG 4.1Å; F495-L514 HydrophobicContact CD1-CD1 4.5Å; F495-L514 HydrophobicContact CD1-CD2 4.33Å; F495-L514 HydrophobicContact CD1-CG 4.37Å; F495-L514 HydrophobicContact CD2-CD1 4.05Å; F495-L514 HydrophobicContact CD2-CD2 3.88Å; F495-L514 HydrophobicContact CD2-CG 4.37Å; F495-L514 HydrophobicContact CE2-CD2 4.12Å; F495-L514 HydrophobicContact CG-CD1 3.75Å; F495-L514 HydrophobicContact CG-CD2 4Å; F495-L514 HydrophobicContact CG-CG 4.05Å; F495-L514 HydrophobicContact CZ-CD2 4.47Å
496	T	88.9	Confident	88.6	Confident	44 Å²	44	36.7 Å²	36.7	27%	0.27	21%	0.209	S	C	.	.			trans	-81.8	115.3	170.4	-53.7	0	0	0	0	109	Q469	Q469-T496 PolarHBondContact O-N 3.49Å; Q469-T496 PolarHBondContact O-OG1 2.98Å; Q469-T496 PolarHBondContact OE1-OG1 2.97Å
497	V	89.2	Confident	88.6	Confident	43 Å²	43	42 Å²	42	26%	0.261	23%	0.225	S	C	.	.			trans	-83.8	126.2	179.3	-176.9	0	0	0	0	109.9	V423 L426 F495 R512 L514	V423-V497 HydrophobicContact CG2-CG2 3.44Å; V423-V497 VanDerWaalsContact CG2-CG2 3.44Å; L426-V497 HydrophobicContact CD1-CG1 4.07Å; F495-V497 PolarHBondContact O-N 3.34Å; V497-R512 HydrophobicContact CG1-CB 4.31Å; V497-L514 HydrophobicContact CG2-CD1 4.47Å
498	L	88.1	Confident	88.6	Confident	8 Å²	8	46 Å²	46	4%	0.042	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	136.9	172.7	-61.8	172	0	0	0	110.2	L500 R512 A513 L516 F562	L498-L500 HydrophobicContact CB-CD2 4.2Å; L498-L500 HydrophobicContact CB-CG 4.15Å; L498-R512 CarbonylContact O-C 3.57Å; L498-R512 VanDerWaalsContact O-CA 3.3Å; L498-R512 WeakPolarHBondContact O-CA 3.28Å; L498-A513 WeakPolarHBondContact CB-O 3.41Å; L498-A513 PolarHBondContact N-O 3Å; L498-A513 PolarHBondContact O-N 2.83Å; L498-L516 HydrophobicContact CD1-CB 3.74Å; L498-L516 HydrophobicContact CD1-CD1 3.83Å; L498-L516 HydrophobicContact CD1-CG 4.4Å; L498-F562 HydrophobicContact CD1-CE1 4.21Å; L498-F562 HydrophobicContact CD2-CD1 3.91Å; L498-F562 HydrophobicContact CD2-CE1 4.29Å
499	S	89.6	Confident	88.4	Confident	34 Å²	34	50.6 Å²	50.6	24%	0.238	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	94.4	174.7	-169.8	0	0	0	0	108.7	H509 D566	S499-H509 WeakPolarHBondContact OG-CA 3.32Å; S499-H509 WeakPolarHBondContact OG-CB 3.49Å; S499-H509 PolarHBondContact OG-ND1 3.35Å; S499-D566 WeakPolarHBondContact O-CB 3.26Å
500	L	89.4	Confident	88.1	Confident	18 Å²	18	53.4 Å²	53.4	9%	0.094	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	146	-170	-57.1	177.8	0	0	0	111.7	L498 A510 R511 A513 D566 F567	L498-L500 HydrophobicContact CB-CD2 4.2Å; L498-L500 HydrophobicContact CB-CG 4.15Å; L500-A510 PolarHBondContact O-N 2.71Å; L500-R511 PolarHBondContact N-O 2.98Å; L500-R511 PolarHBondContact O-N 2.82Å; L500-A513 HydrophobicContact CD1-CB 4.32Å; L500-D566 WeakPolarHBondContact CA-OD1 3.19Å; L500-F567 HydrophobicContact CD1-CE1 4.1Å; L500-F567 HydrophobicContact CD2-CD1 3.7Å; L500-F567 HydrophobicContact CD2-CE1 3.81Å
501	S	89.7	Confident	87.9	Confident	11 Å²	11	57.4 Å²	57.4	8%	0.077	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	129.4	169.4	-79.8	0	0	0	0	111.4	R507 P508 D566 G569	S501-R507 VanDerWaalsContact CA-O 3.29Å; S501-R507 WeakPolarHBondContact CA-O 3.32Å; S501-P508 WeakPolarHBondContact OG-CA 3.42Å; S501-D566 VanDerWaalsContact CB-OD2 3.3Å; S501-D566 WeakPolarHBondContact CB-OD2 3.23Å; S501-D566 VanDerWaalsContact N-CG 3.29Å; S501-D566 PolarHBondContact N-OD1 3.04Å; S501-D566 PolarHBondContact N-OD2 2.79Å; S501-D566 PolarHBondContact OG-OD2 3.11Å; S501-G569 WeakPolarHBondContact OG-CA 3.37Å
502	A	86.3	Confident	87.7	Confident	24 Å²	24	62.3 Å²	62.3	20%	0.198	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	168	178.6	0	0	0	0	0	111.8	R507 A510 R511	A502-R507 PolarHBondContact N-O 2.85Å; A502-R507 VanDerWaalsContact N-O 3.12Å; A502-R507 PolarHBondContact O-N 2.92Å; A502-A510 HydrophobicContact CB-CB 3.97Å; A502-R511 HydrophobicContact CB-CB 3.73Å
503	G	84.6	Confident	87.6	Confident	42 Å²	42	59 Å²	59	43%	0.433	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.6	177.9	-177.7	0	0	0	0	0	114.9	P505	G503-P505 CarbonylContact C-O 3.51Å; G503-P505 VanDerWaalsContact C-O 3.25Å
504	R	84.1	Confident	87.4	Confident	148 Å²	148	58.7 Å²	58.7	56%	0.558	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.8	102.4	176.3	-66.8	-176.8	-174.9	179.5	5.3	108	T524 V526	R504-T524 VanDerWaalsContact CZ-OG1 3.25Å; R504-T524 PolarHBondContact NE-OG1 2.8Å; R504-T524 PolarHBondContact NH2-OG1 2.9Å; R504-V526 HydrophobicContact CB-CG2 3.96Å; R504-V526 HydrophobicContact CG-CG2 4.49Å
505	P	85.3	Confident	87.3	Confident	70 Å²	70	57 Å²	57	46%	0.455	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	cis	-66.7	161.1	0.6	30.6	-36.8	0	0	0	113	G503 R507 V526	G503-P505 CarbonylContact C-O 3.51Å; G503-P505 VanDerWaalsContact C-O 3.25Å; P505-R507 PolarHBondContact O-N 2.8Å; P505-V526 HydrophobicContact CB-CB 4.34Å
506	K	88.8	Confident	87.2	Confident	45 Å²	45	56.7 Å²	56.7	20%	0.196	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	121.5	177.9	-73.6	-67.6	-171.2	-151.1	0	111.4	T524 D525 V568 C572	K506-T524 WeakPolarHBondContact CE-O 3.46Å; K506-T524 PolarHBondContact NZ-O 3.43Å; K506-D525 HydrophobicContact CG-CB 3.96Å; K506-D525 WeakPolarHBondContact CG-OD1 3.36Å; K506-D525 PolarHBondContact N-OD1 2.81Å; K506-V568 HydrophobicContact CD-CG1 4.23Å; K506-C572 HydrophobicContact CG-CB 4.44Å
507	R	88.3	Confident	87.2	Confident	172 Å²	172	55.4 Å²	55.4	65%	0.649	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.3	129.2	172.9	-65	179.6	-175.4	172.2	0.7	109.2	S501 A502 P505 A510	S501-R507 VanDerWaalsContact CA-O 3.29Å; S501-R507 WeakPolarHBondContact CA-O 3.32Å; A502-R507 PolarHBondContact N-O 2.85Å; A502-R507 VanDerWaalsContact N-O 3.12Å; A502-R507 PolarHBondContact O-N 2.92Å; P505-R507 PolarHBondContact O-N 2.8Å; R507-A510 HydrophobicContact CB-CB 4.06Å; R507-A510 WeakPolarHBondContact O-CB 3.34Å
508	P	88.6	Confident	87.2	Confident	88 Å²	88	54.1 Å²	54.1	57%	0.571	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.2	149	175.8	28.4	-34.4	0	0	0	110.6	S501 A510	S501-P508 WeakPolarHBondContact OG-CA 3.42Å; P508-A510 PolarHBondContact O-N 2.87Å
509	H	86.5	Confident	87	Confident	132 Å²	132	54.4 Å²	54.4	61%	0.611	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	58.8	16.5	177	-51.7	-61.2	0	0	0	116.2	S499	S499-H509 WeakPolarHBondContact OG-CA 3.32Å; S499-H509 WeakPolarHBondContact OG-CB 3.49Å; S499-H509 PolarHBondContact OG-ND1 3.35Å
510	A	83.8	Confident	86.9	Confident	61 Å²	61	58.3 Å²	58.3	50%	0.504	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	-21.4	-175	0	0	0	0	0	113.9	L500 A502 R507 P508	L500-A510 PolarHBondContact O-N 2.71Å; A502-A510 HydrophobicContact CB-CB 3.97Å; R507-A510 HydrophobicContact CB-CB 4.06Å; R507-A510 WeakPolarHBondContact O-CB 3.34Å; P508-A510 PolarHBondContact O-N 2.87Å
511	R	84.7	Confident	86.9	Confident	101 Å²	101	58.8 Å²	58.8	38%	0.381	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	129.9	177.2	-177.3	179.8	-179	-177.9	2.8	110.5	L500 A502	L500-R511 PolarHBondContact N-O 2.98Å; L500-R511 PolarHBondContact O-N 2.82Å; A502-R511 HydrophobicContact CB-CB 3.73Å
512	R	86.1	Confident	86.9	Confident	123 Å²	123	63.4 Å²	63.4	46%	0.464	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	139.4	169.2	-60.3	175.1	71.3	178.8	4.9	109.3	L426 V497 L498	L426-R512 HydrophobicContact CD1-CB 4.14Å; V497-R512 HydrophobicContact CG1-CB 4.31Å; L498-R512 CarbonylContact O-C 3.57Å; L498-R512 VanDerWaalsContact O-CA 3.3Å; L498-R512 WeakPolarHBondContact O-CA 3.28Å
513	A	85.6	Confident	87.1	Confident	14 Å²	14	63 Å²	63	12%	0.116	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	148.3	179.5	0	0	0	0	0	110.7	L498 L500	L498-A513 WeakPolarHBondContact CB-O 3.41Å; L498-A513 PolarHBondContact N-O 3Å; L498-A513 PolarHBondContact O-N 2.83Å; L500-A513 HydrophobicContact CD1-CB 4.32Å
514	L	86	Confident	87.4	Confident	6 Å²	6	61.7 Å²	61.7	3%	0.031	31%	0.306	C	S	.	.	S	Bend	trans	-90.4	-32.5	177.9	-158.7	69.4	0	0	0	112.6	V423 L427 Y460 F495 V497	V423-L514 HydrophobicContact CG1-CD1 4.26Å; L427-L514 HydrophobicContact CD2-CD2 3.55Å; L427-L514 HydrophobicContact CG-CD2 4.3Å; Y460-L514 HydrophobicContact CD1-CD2 3.91Å; Y460-L514 HydrophobicContact CD2-CD2 3.68Å; Y460-L514 HydrophobicContact CE1-CD2 4.02Å; Y460-L514 HydrophobicContact CE2-CD2 3.78Å; Y460-L514 HydrophobicContact CG-CD2 3.73Å; F495-L514 HydrophobicContact CB-CD1 3.35Å; F495-L514 HydrophobicContact CB-CG 4.1Å; F495-L514 HydrophobicContact CD1-CD1 4.5Å; F495-L514 HydrophobicContact CD1-CD2 4.33Å; F495-L514 HydrophobicContact CD1-CG 4.37Å; F495-L514 HydrophobicContact CD2-CD1 4.05Å; F495-L514 HydrophobicContact CD2-CD2 3.88Å; F495-L514 HydrophobicContact CD2-CG 4.37Å; F495-L514 HydrophobicContact CE2-CD2 4.12Å; F495-L514 HydrophobicContact CG-CD1 3.75Å; F495-L514 HydrophobicContact CG-CD2 4Å; F495-L514 HydrophobicContact CG-CG 4.05Å; F495-L514 HydrophobicContact CZ-CD2 4.47Å; V497-L514 HydrophobicContact CG2-CD1 4.47Å
515	C	89	Confident	87.7	Confident	4 Å²	4	55.2 Å²	55.2	3%	0.027	28%	0.282	C	S	.	.	S	Bend	trans	-112.3	142.6	178.5	60.5	0	0	0	0	111.4	P433 Y460 A466 A467 V468	P433-C515 VanDerWaalsContact CG-SG 3.5Å; Y460-C515 HydrophobicContact CE1-CB 4.29Å; A466-C515 HydrophobicContact CB-CB 4.07Å; A467-C515 CarbonylContact O-C 3.56Å; A467-C515 WeakPolarHBondContact O-CA 3.21Å; V468-C515 HydrophobicContact CG2-CB 3.53Å
516	L	89.3	Confident	88	Confident	3 Å²	3	52.7 Å²	52.7	2%	0.016	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	125	168.4	-173.5	68.1	0	0	0	108.8	A466 A467 L498 L518 F547 L561 F562 F567	A466-L516 CarbonylContact C-O 3.57Å; A466-L516 WeakPolarHBondContact CA-O 3.45Å; A466-L516 WeakPolarHBondContact CB-O 3.27Å; A467-L516 PolarHBondContact N-O 2.88Å; A467-L516 PolarHBondContact O-N 3.46Å; L498-L516 HydrophobicContact CD1-CB 3.74Å; L498-L516 HydrophobicContact CD1-CD1 3.83Å; L498-L516 HydrophobicContact CD1-CG 4.4Å; L516-L518 HydrophobicContact CD2-CD2 4.34Å; L516-F547 HydrophobicContact CD1-CE2 4.22Å; L516-F547 HydrophobicContact CD1-CZ 4.23Å; L516-F547 HydrophobicContact CD2-CE2 4.27Å; L516-F547 HydrophobicContact CD2-CZ 4.14Å; L516-F547 HydrophobicContact CG-CE2 4.27Å; L516-F547 HydrophobicContact CG-CZ 4.49Å; L516-L561 HydrophobicContact CD2-CB 3.82Å; L516-L561 HydrophobicContact CD2-CD2 4.41Å; L516-L561 WeakPolarHBondContact CD2-O 3.4Å; L516-F562 HydrophobicContact CB-CE1 3.84Å; L516-F562 HydrophobicContact CB-CZ 3.78Å; L516-F562 HydrophobicContact CD2-CE1 4.5Å; L516-F562 HydrophobicContact CD2-CE2 4.42Å; L516-F562 HydrophobicContact CD2-CZ 4.3Å; L516-F567 HydrophobicContact CD1-CD1 3.67Å; L516-F567 HydrophobicContact CD1-CE1 3.54Å; L516-F567 HydrophobicContact CD1-CZ 4.42Å
517	L	89.3	Confident	88.1	Confident	16 Å²	16	51 Å²	51	8%	0.084	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	130.4	172.4	-63.4	173.8	0	0	0	109	P433 L434 A466 W545	P433-L517 HydrophobicContact CB-CD1 4.26Å; P433-L517 HydrophobicContact CB-CD2 4.32Å; L434-L517 HydrophobicContact CD1-CD1 4.34Å; L434-L517 HydrophobicContact CD1-CD2 3.73Å; A466-L517 HydrophobicContact CB-CD2 4.04Å; L517-W545 HydrophobicContact CB-CH2 4.13Å; L517-W545 VanDerWaalsContact O-CH2 3.25Å; L517-W545 WeakPolarHBondContact O-CH2 3.47Å; L517-W545 VanDerWaalsContact O-CZ3 3.24Å; L517-W545 WeakPolarHBondContact O-CZ3 3.31Å
518	L	88	Confident	88.3	Confident	17 Å²	17	46.6 Å²	46.6	9%	0.089	25%	0.251	C	S	.	.			trans	-88.7	-13.2	-177.2	-58.4	174.2	0	0	0	112.7	N465 A467 F482 L516 H546 F547 L561	N465-L518 WeakPolarHBondContact O-CB 3.34Å; N465-L518 PolarHBondContact O-N 3.34Å; A467-L518 HydrophobicContact CB-CD1 4.35Å; A467-L518 HydrophobicContact CB-CD2 4.22Å; A467-L518 HydrophobicContact CB-CG 4.48Å; F482-L518 HydrophobicContact CD1-CD1 3.68Å; F482-L518 HydrophobicContact CE1-CD1 3.7Å; L516-L518 HydrophobicContact CD2-CD2 4.34Å; L518-H546 CarbonylContact O-C 3.56Å; L518-H546 WeakPolarHBondContact O-CA 3.45Å; L518-F547 HydrophobicContact CB-CB 4.45Å; L518-F547 HydrophobicContact CD2-CB 4.09Å; L518-F547 HydrophobicContact CD2-CD2 4.38Å; L518-F547 HydrophobicContact CD2-CG 4.34Å; L518-F547 PolarHBondContact O-N 3.35Å; L518-L561 HydrophobicContact CD2-CD1 4.02Å; L518-L561 HydrophobicContact CD2-CD2 3.94Å
519	G	83.8	Confident	88.4	Confident	13 Å²	13	42.7 Å²	42.7	13%	0.134	23%	0.225	C	C	.	.	S	Bend	trans	81.8	-170.4	-175.5	0	0	0	0	0	113.2
520	P	88.4	Confident	88.7	Confident	116 Å²	116	39.9 Å²	39.9	75%	0.753	21%	0.212	S	C	*	.	S	Bend	cis	-66.8	136.1	2.5	29.1	-35.4	0	0	0	112.4	H546	P520-H546 HydrophobicContact CB-CB 4.47Å
521	D	89.5	Confident	89	Confident	29 Å²	29	37.2 Å²	37.2	16%	0.155	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	175.6	-177.2	-175.2	28.8	0	0	0	110.7	R437 W545	R437-D521 IonicContact CZ-OD1 2.81Å; R437-D521 IonicContact CZ-OD2 3.9Å; R437-D521 IonicContact NH1-OD1 3.97Å; R437-D521 PolarHBondContact NH1-OD1 3.17Å; R437-D521 IonicContact NH1-OD2 2.84Å; R437-D521 PolarHBondContact NH1-OD2 3.32Å; R437-D521 IonicContact NH2-OD1 2.74Å; R437-D521 IonicContact NH2-OD2 3.81Å; R437-D521 PolarHBondContact NH2-OD2 2.79Å; D521-W545 HydrophobicContact CB-CD2 4.46Å; D521-W545 HydrophobicContact CB-CH2 4.14Å; D521-W545 HydrophobicContact CB-CZ2 3.61Å; D521-W545 PolarHBondContact N-O 3.49Å; D521-W545 VanDerWaalsContact O-CD1 3.23Å; D521-W545 PolarHBondContact O-N 2.8Å; D521-W545 PolarHBondContact O-NE1 3.26Å; D521-W545 WeakPolarHBondContact OD2-CZ2 3.41Å
522	F	89.7	Confident	89.3	Confident	108 Å²	108	34.5 Å²	34.5	47%	0.474	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	147.6	175.1	73.7	-86.6	0	0	0	112.5	T524 A542 Y543 N544	F522-T524 HydrophobicContact CD2-CG2 4.46Å; F522-T524 HydrophobicContact CE2-CG2 4.44Å; F522-A542 HydrophobicContact CD2-CB 4.41Å; F522-Y543 WeakPolarHBondContact CA-O 3.41Å; F522-Y543 WeakPolarHBondContact CB-O 3.43Å; F522-N544 WeakPolarHBondContact CB-OD1 3.18Å
523	F	89.4	Confident	89.4	Confident	14 Å²	14	33.1 Å²	33.1	6%	0.061	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	149.1	168	53.9	-107.8	0	0	0	110.8	Y543 W545 F567 V568 A571 C572	F523-Y543 AromaticContact CD2-CD2 3.52Å; F523-Y543 HydrophobicContact CD2-CD2 3.52Å; F523-Y543 HydrophobicContact CD2-CE2 4.31Å; F523-Y543 HydrophobicContact CD2-CG 4.39Å; F523-Y543 AromaticContact CE2-CD2 3.31Å; F523-Y543 HydrophobicContact CE2-CD2 3.31Å; F523-Y543 HydrophobicContact CE2-CE2 4.11Å; F523-Y543 AromaticContact CE2-CG 3.98Å; F523-Y543 HydrophobicContact CE2-CG 3.98Å; F523-Y543 HydrophobicContact CZ-CD2 4.42Å; F523-Y543 PolarHBondContact N-O 2.84Å; F523-Y543 VanDerWaalsContact N-O 3.08Å; F523-Y543 WeakPolarHBondContact O-CD2 3.24Å; F523-Y543 PolarHBondContact O-N 2.86Å; F523-W545 AromaticContact CD1-CD1 3.2Å; F523-W545 HydrophobicContact CD1-CD2 4.26Å; F523-W545 AromaticContact CD1-CE2 3.69Å; F523-W545 AromaticContact CD1-CG 3.98Å; F523-W545 HydrophobicContact CD1-CG 3.98Å; F523-W545 HydrophobicContact CD1-CZ2 4.42Å; F523-W545 AromaticContact CD1-NE1 3.03Å; F523-W545 HydrophobicContact CE1-CB 4.31Å; F523-W545 AromaticContact CE1-CD1 3.22Å; F523-W545 HydrophobicContact CE1-CD2 4.03Å; F523-W545 AromaticContact CE1-CE2 3.93Å; F523-W545 AromaticContact CE1-CG 3.59Å; F523-W545 HydrophobicContact CE1-CG 3.59Å; F523-W545 AromaticContact CE1-NE1 3.5Å; F523-W545 AromaticContact CG-NE1 3.94Å; F523-W545 HydrophobicContact CZ-CG 4.46Å; F523-F567 HydrophobicContact CE1-CE2 4.17Å; F523-V568 HydrophobicContact CB-CG1 4.43Å; F523-V568 HydrophobicContact CD1-CG1 4.09Å; F523-V568 HydrophobicContact CD1-CG2 4.03Å; F523-V568 HydrophobicContact CD2-CG1 4.01Å; F523-V568 HydrophobicContact CE1-CG1 4.45Å; F523-V568 HydrophobicContact CE1-CG2 4.28Å; F523-V568 HydrophobicContact CE2-CG1 4.35Å; F523-V568 HydrophobicContact CG-CG1 3.93Å; F523-A571 HydrophobicContact CE2-CB 4.47Å; F523-A571 HydrophobicContact CZ-CB 3.88Å; F523-C572 WeakPolarHBondContact CE2-SG 3.41Å
524	T	90.4	Very high	89.4	Confident	15 Å²	15	39.1 Å²	39.1	9%	0.092	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	142.7	-177.6	37.2	0	0	0	0	111	R504 K506 F522 L541 A542	R504-T524 VanDerWaalsContact CZ-OG1 3.25Å; R504-T524 PolarHBondContact NE-OG1 2.8Å; R504-T524 PolarHBondContact NH2-OG1 2.9Å; K506-T524 WeakPolarHBondContact CE-O 3.46Å; K506-T524 PolarHBondContact NZ-O 3.43Å; F522-T524 HydrophobicContact CD2-CG2 4.46Å; F522-T524 HydrophobicContact CE2-CG2 4.44Å; T524-L541 CarbonylContact C-O 3.53Å; T524-L541 VanDerWaalsContact CA-O 3.27Å; T524-L541 WeakPolarHBondContact CA-O 3.41Å; T524-A542 HydrophobicContact CG2-CB 3.74Å
525	D	91.8	Very high	89.4	Confident	12 Å²	12	39.4 Å²	39.4	6%	0.064	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	157.4	176.5	-169.9	21.2	0	0	0	111	K506 I527 Q540 L541 Y543	K506-D525 HydrophobicContact CG-CB 3.96Å; K506-D525 WeakPolarHBondContact CG-OD1 3.36Å; K506-D525 PolarHBondContact N-OD1 2.81Å; D525-I527 VanDerWaalsContact OD2-CG2 3.29Å; D525-I527 WeakPolarHBondContact OD2-CG2 3.42Å; D525-Q540 WeakPolarHBondContact O-CA 3.33Å; D525-L541 PolarHBondContact N-O 2.92Å; D525-L541 PolarHBondContact O-N 2.88Å; D525-Y543 HydrophobicContact CB-CE2 3.66Å
526	V	92.1	Very high	89.5	Confident	17 Å²	17	46.5 Å²	46.5	10%	0.103	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	108.2	177.6	-179.4	0	0	0	0	107.6	R504 P505 Q538 L539 Q540	R504-V526 HydrophobicContact CB-CG2 3.96Å; R504-V526 HydrophobicContact CG-CG2 4.49Å; P505-V526 HydrophobicContact CB-CB 4.34Å; V526-Q538 HydrophobicContact CG1-CG 3.49Å; V526-Q538 VanDerWaalsContact CG1-CG 3.49Å; V526-L539 CarbonylContact C-O 3.55Å; V526-L539 VanDerWaalsContact CA-O 3.3Å; V526-L539 WeakPolarHBondContact CA-O 3.41Å; V526-Q540 HydrophobicContact CG2-CG 4.21Å
527	I	90.8	Very high	89.5	Confident	10 Å²	10	46.4 Å²	46.4	5%	0.051	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	142.2	-179.2	64.9	171.1	0	0	0	110.5	D525 I529 Q538 L539 L541 A576 V579	D525-I527 VanDerWaalsContact OD2-CG2 3.29Å; D525-I527 WeakPolarHBondContact OD2-CG2 3.42Å; I527-I529 HydrophobicContact CD1-CG2 3.94Å; I527-I529 HydrophobicContact CG1-CG2 4.14Å; I527-Q538 WeakPolarHBondContact O-CA 3.46Å; I527-L539 HydrophobicContact CD1-CB 4.46Å; I527-L539 HydrophobicContact CD1-CD1 3.93Å; I527-L539 HydrophobicContact CG1-CB 3.78Å; I527-L539 HydrophobicContact CG1-CD1 4.06Å; I527-L539 HydrophobicContact CG1-CG 4.34Å; I527-L539 PolarHBondContact N-O 3.25Å; I527-L539 PolarHBondContact O-N 2.95Å; I527-L541 HydrophobicContact CD1-CD1 3.65Å; I527-L541 HydrophobicContact CG1-CD1 4.18Å; I527-A576 HydrophobicContact CB-CB 4.46Å; I527-A576 HydrophobicContact CG2-CB 3.67Å; I527-V579 HydrophobicContact CD1-CB 3.95Å; I527-V579 HydrophobicContact CD1-CG1 3.8Å; I527-V579 HydrophobicContact CD1-CG2 4.5Å
528	T	91.2	Very high	89.6	Confident	80 Å²	80	49.2 Å²	49.2	49%	0.491	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	128.3	172.5	-52.9	0	0	0	0	108.8	L537 V646	T528-L537 WeakPolarHBondContact CA-O 3.14Å; T528-V646 HydrophobicContact CG2-CG2 4.1Å
529	I	91.4	Very high	89.8	Confident	5 Å²	5	48.4 Å²	48.4	3%	0.026	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	162.7	-174.1	60.7	156.5	0	0	0	110.4	I527 R536 L537 L539 V579 R580 V583 F591	I527-I529 HydrophobicContact CD1-CG2 3.94Å; I527-I529 HydrophobicContact CG1-CG2 4.14Å; I529-R536 WeakPolarHBondContact O-CA 3.47Å; I529-L537 HydrophobicContact CD1-CB 4.18Å; I529-L537 HydrophobicContact CD1-CD1 4.33Å; I529-L537 HydrophobicContact CG1-CB 3.86Å; I529-L537 WeakPolarHBondContact CG1-O 3.38Å; I529-L537 PolarHBondContact N-O 2.89Å; I529-L537 PolarHBondContact O-N 3.17Å; I529-L539 HydrophobicContact CD1-CD1 3.42Å; I529-L539 VanDerWaalsContact CD1-CD1 3.42Å; I529-L539 HydrophobicContact CD1-CD2 4.2Å; I529-L539 HydrophobicContact CD1-CG 3.83Å; I529-L539 HydrophobicContact CG1-CD1 3.94Å; I529-L539 HydrophobicContact CG1-CG 4.04Å; I529-L539 HydrophobicContact CG2-CD1 4.07Å; I529-V579 HydrophobicContact CG2-CG1 4.38Å; I529-R580 HydrophobicContact CB-CG 4.34Å; I529-R580 HydrophobicContact CG2-CG 3.64Å; I529-V583 HydrophobicContact CD1-CB 4Å; I529-V583 HydrophobicContact CD1-CG1 3.59Å; I529-V583 HydrophobicContact CD1-CG2 4.02Å; I529-F591 HydrophobicContact CD1-CE1 3.93Å; I529-F591 HydrophobicContact CD1-CZ 3.83Å
530	E	92.3	Very high	90.1	Very high	74 Å²	74	50.9 Å²	50.9	35%	0.346	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	133	177.2	-168.7	170.4	162.8	0	0	108.8	H534 A535 R536 A584	E530-H534 IonicContact OE1-CE1 2.71Å; E530-H534 IonicContact OE1-CG 3.64Å; E530-H534 IonicContact OE1-ND1 3.18Å; E530-H534 PolarHBondContact OE1-ND1 3.16Å; E530-A535 WeakPolarHBondContact CA-O 3.22Å; E530-R536 HydrophobicContact CG-CG 4.38Å; E530-R536 IonicContact OE2-NE 3.95Å; E530-A584 WeakPolarHBondContact O-CA 3.44Å; E530-A584 PolarHBondContact O-N 3.4Å
531	T	91.2	Very high	90.2	Very high	4 Å²	4	45.3 Å²	45.3	3%	0.025	23%	0.226	C	C	.	.			trans	-85.4	171.7	177.8	66.4	0	0	0	0	111.4	D533 H534 A535 L537 V583 V586 F588	T531-D533 PolarHBondContact O-N 2.8Å; T531-H534 PolarHBondContact O-N 2.81Å; T531-A535 HydrophobicContact CG2-CB 4.33Å; T531-A535 PolarHBondContact N-O 3.27Å; T531-A535 VanDerWaalsContact OG1-CB 3.28Å; T531-A535 WeakPolarHBondContact OG1-CB 3.27Å; T531-A535 PolarHBondContact OG1-N 3.46Å; T531-A535 VanDerWaalsContact OG1-N 3.14Å; T531-L537 HydrophobicContact CG2-CD1 4.06Å; T531-V583 HydrophobicContact CG2-CG1 3.79Å; T531-V586 WeakPolarHBondContact CB-O 3.26Å; T531-F588 HydrophobicContact CG2-CB 4.32Å; T531-F588 HydrophobicContact CG2-CD2 4.49Å
532	A	90.6	Very high	90.3	Very high	45 Å²	45	44 Å²	44	37%	0.372	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-30.5	176.3	0	0	0	0	0	113.2	H534 A584 V586	A532-H534 VanDerWaalsContact C-N 3.26Å; A532-H534 PolarHBondContact O-N 2.87Å; A532-A584 WeakPolarHBondContact CA-O 3.5Å; A532-V586 WeakPolarHBondContact CB-O 3.36Å; A532-V586 PolarHBondContact N-O 3.1Å
533	D	88.6	Confident	90.4	Very high	93 Å²	93	38.9 Å²	38.9	50%	0.497	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	18.6	178.7	-44.6	-49.5	0	0	0	112.9	T531 A535 T587 F588	T531-D533 PolarHBondContact O-N 2.8Å; D533-A535 PolarHBondContact O-N 3.39Å; D533-T587 WeakPolarHBondContact OD2-CA 3.49Å; D533-T587 WeakPolarHBondContact OD2-CB 3.35Å; D533-F588 PolarHBondContact OD2-N 3.32Å
534	H	85.5	Confident	90.5	Very high	141 Å²	141	40.2 Å²	40.2	65%	0.653	20%	0.204	S	C	*	.			trans	61.6	23.9	-179.2	-58.6	-68.6	0	0	0	115.2	E530 T531 A532 R536	E530-H534 IonicContact OE1-CE1 2.71Å; E530-H534 IonicContact OE1-CG 3.64Å; E530-H534 IonicContact OE1-ND1 3.18Å; E530-H534 PolarHBondContact OE1-ND1 3.16Å; T531-H534 PolarHBondContact O-N 2.81Å; A532-H534 VanDerWaalsContact C-N 3.26Å; A532-H534 PolarHBondContact O-N 2.87Å; H534-R536 PolarHBondContact O-N 3.08Å
535	A	86.3	Confident	90.6	Very high	12 Å²	12	39.8 Å²	39.8	10%	0.099	20%	0.201	C	C	.	.			trans	-79.1	118.6	172.7	0	0	0	0	0	110	E530 T531 D533 F588	E530-A535 WeakPolarHBondContact CA-O 3.22Å; T531-A535 HydrophobicContact CG2-CB 4.33Å; T531-A535 PolarHBondContact N-O 3.27Å; T531-A535 VanDerWaalsContact OG1-CB 3.28Å; T531-A535 WeakPolarHBondContact OG1-CB 3.27Å; T531-A535 PolarHBondContact OG1-N 3.46Å; T531-A535 VanDerWaalsContact OG1-N 3.14Å; D533-A535 PolarHBondContact O-N 3.39Å; A535-F588 HydrophobicContact CB-CB 3.85Å; A535-F588 HydrophobicContact CB-CD2 3.79Å; A535-F588 HydrophobicContact CB-CG 3.93Å
536	R	89.7	Confident	90.7	Very high	153 Å²	153	41.8 Å²	41.8	58%	0.577	21%	0.209	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-85.9	120.5	176.7	-67.1	-177	177.3	179.2	1.3	110.7	I529 E530 H534 V646	I529-R536 WeakPolarHBondContact O-CA 3.47Å; E530-R536 HydrophobicContact CG-CG 4.38Å; E530-R536 IonicContact OE2-NE 3.95Å; H534-R536 PolarHBondContact O-N 3.08Å; R536-V646 HydrophobicContact CB-CB 3.99Å; R536-V646 HydrophobicContact CB-CG2 4.2Å; R536-V646 PolarHBondContact O-N 3.01Å
537	L	89.9	Confident	90.7	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	146.5	-179.7	-48.7	176.5	0	0	0	110.9	T528 I529 T531 F588 F591 V643 E644 P645	T528-L537 WeakPolarHBondContact CA-O 3.14Å; I529-L537 HydrophobicContact CD1-CB 4.18Å; I529-L537 HydrophobicContact CD1-CD1 4.33Å; I529-L537 HydrophobicContact CG1-CB 3.86Å; I529-L537 WeakPolarHBondContact CG1-O 3.38Å; I529-L537 PolarHBondContact N-O 2.89Å; I529-L537 PolarHBondContact O-N 3.17Å; T531-L537 HydrophobicContact CG2-CD1 4.06Å; L537-F588 HydrophobicContact CD1-CD2 3.97Å; L537-F588 HydrophobicContact CD1-CE2 4.02Å; L537-F588 HydrophobicContact CD2-CD2 3.93Å; L537-F588 HydrophobicContact CD2-CE2 3.59Å; L537-F588 HydrophobicContact CG-CD2 4.4Å; L537-F588 HydrophobicContact CG-CE2 4.4Å; L537-F591 HydrophobicContact CD1-CD1 3.44Å; L537-F591 VanDerWaalsContact CD1-CD1 3.44Å; L537-F591 HydrophobicContact CD1-CE1 3.52Å; L537-V643 HydrophobicContact CD1-CG1 4.25Å; L537-E644 CarbonylContact C-O 3.53Å; L537-E644 WeakPolarHBondContact CA-O 3.31Å; L537-P645 HydrophobicContact CD2-CB 4.26Å; L537-P645 HydrophobicContact CD2-CG 4.33Å
538	Q	91.9	Very high	90.5	Very high	75 Å²	75	45.8 Å²	45.8	35%	0.35	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	120.2	170.8	-170.9	170.2	36.5	0	0	108.4	V526 I527 E644 V646	V526-Q538 HydrophobicContact CG1-CG 3.49Å; V526-Q538 VanDerWaalsContact CG1-CG 3.49Å; I527-Q538 WeakPolarHBondContact O-CA 3.46Å; Q538-E644 PolarHBondContact N-O 3.16Å; Q538-E644 PolarHBondContact O-N 3.24Å; Q538-V646 HydrophobicContact CB-CG2 4Å
539	L	90.5	Very high	90.2	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	130.5	179	-55.7	174.3	0	0	0	109.4	V526 I527 I529 L541 V579 F591 I599 S642 V643	V526-L539 CarbonylContact C-O 3.55Å; V526-L539 VanDerWaalsContact CA-O 3.3Å; V526-L539 WeakPolarHBondContact CA-O 3.41Å; I527-L539 HydrophobicContact CD1-CB 4.46Å; I527-L539 HydrophobicContact CD1-CD1 3.93Å; I527-L539 HydrophobicContact CG1-CB 3.78Å; I527-L539 HydrophobicContact CG1-CD1 4.06Å; I527-L539 HydrophobicContact CG1-CG 4.34Å; I527-L539 PolarHBondContact N-O 3.25Å; I527-L539 PolarHBondContact O-N 2.95Å; I529-L539 HydrophobicContact CD1-CD1 3.42Å; I529-L539 VanDerWaalsContact CD1-CD1 3.42Å; I529-L539 HydrophobicContact CD1-CD2 4.2Å; I529-L539 HydrophobicContact CD1-CG 3.83Å; I529-L539 HydrophobicContact CG1-CD1 3.94Å; I529-L539 HydrophobicContact CG1-CG 4.04Å; I529-L539 HydrophobicContact CG2-CD1 4.07Å; L539-L541 HydrophobicContact CB-CD2 4.21Å; L539-L541 HydrophobicContact CB-CG 4.16Å; L539-V579 HydrophobicContact CD1-CG1 3.91Å; L539-F591 HydrophobicContact CD1-CZ 4.11Å; L539-F591 HydrophobicContact CD2-CE1 3.97Å; L539-F591 HydrophobicContact CD2-CZ 3.91Å; L539-I599 HydrophobicContact CD1-CD1 4.01Å; L539-I599 HydrophobicContact CD2-CD1 4.49Å; L539-S642 WeakPolarHBondContact CA-O 3.43Å; L539-V643 HydrophobicContact CD2-CB 3.94Å; L539-V643 HydrophobicContact CD2-CG1 3.61Å; L539-V643 HydrophobicContact CD2-CG2 3.54Å
540	Q	91.8	Very high	89.7	Confident	64 Å²	64	49.8 Å²	49.8	30%	0.299	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	113.4	164.8	-57.5	-165.8	5.7	0	0	108.3	D525 V526 Q641 S642	D525-Q540 WeakPolarHBondContact O-CA 3.33Å; V526-Q540 HydrophobicContact CG2-CG 4.21Å; Q540-Q641 HydrophobicContact CB-CB 4.14Å; Q540-Q641 PolarHBondContact O-N 3.39Å; Q540-S642 PolarHBondContact N-O 2.83Å; Q540-S642 PolarHBondContact O-N 3.14Å
541	L	90.2	Very high	89.1	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	136.7	-177.9	-57.5	-177.5	0	0	0	109.6	T524 D525 I527 L539 Y543 I599 V640	T524-L541 CarbonylContact C-O 3.53Å; T524-L541 VanDerWaalsContact CA-O 3.27Å; T524-L541 WeakPolarHBondContact CA-O 3.41Å; D525-L541 PolarHBondContact N-O 2.92Å; D525-L541 PolarHBondContact O-N 2.88Å; I527-L541 HydrophobicContact CD1-CD1 3.65Å; I527-L541 HydrophobicContact CG1-CD1 4.18Å; L539-L541 HydrophobicContact CB-CD2 4.21Å; L539-L541 HydrophobicContact CB-CG 4.16Å; L541-Y543 HydrophobicContact CB-CE1 3.68Å; L541-Y543 HydrophobicContact CB-CE2 4.35Å; L541-Y543 HydrophobicContact CD1-CE1 3.97Å; L541-Y543 WeakPolarHBondContact CD1-OH 3.4Å; L541-Y543 HydrophobicContact CG-CE1 4.48Å; L541-I599 HydrophobicContact CD1-CG2 4.37Å; L541-I599 HydrophobicContact CD2-CD1 4.1Å; L541-I599 HydrophobicContact CD2-CG2 4.37Å; L541-V640 HydrophobicContact CD2-CB 4.18Å; L541-V640 HydrophobicContact CD2-CG1 4.05Å; L541-V640 HydrophobicContact CD2-CG2 3.89Å
542	A	91.5	Very high	88.6	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.008	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	133.5	165.4	0	0	0	0	0	109	F522 T524 V638 D639 Q641	F522-A542 HydrophobicContact CD2-CB 4.41Å; T524-A542 HydrophobicContact CG2-CB 3.74Å; A542-V638 CarbonylContact O-C 3.56Å; A542-V638 WeakPolarHBondContact O-CA 3.44Å; A542-D639 HydrophobicContact CB-CB 4.27Å; A542-D639 PolarHBondContact N-O 2.9Å; A542-D639 PolarHBondContact O-N 2.84Å; A542-Q641 HydrophobicContact CB-CG 4.26Å
543	Y	90.9	Very high	88.1	Confident	0 Å²	0	64 Å²	64	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	119	178.4	-43.2	-74.1	0	0	0	107.5	F522 F523 D525 L541 I575 V638	F522-Y543 WeakPolarHBondContact CA-O 3.41Å; F522-Y543 WeakPolarHBondContact CB-O 3.43Å; F523-Y543 AromaticContact CD2-CD2 3.52Å; F523-Y543 HydrophobicContact CD2-CD2 3.52Å; F523-Y543 HydrophobicContact CD2-CE2 4.31Å; F523-Y543 HydrophobicContact CD2-CG 4.39Å; F523-Y543 AromaticContact CE2-CD2 3.31Å; F523-Y543 HydrophobicContact CE2-CD2 3.31Å; F523-Y543 HydrophobicContact CE2-CE2 4.11Å; F523-Y543 AromaticContact CE2-CG 3.98Å; F523-Y543 HydrophobicContact CE2-CG 3.98Å; F523-Y543 HydrophobicContact CZ-CD2 4.42Å; F523-Y543 PolarHBondContact N-O 2.84Å; F523-Y543 VanDerWaalsContact N-O 3.08Å; F523-Y543 WeakPolarHBondContact O-CD2 3.24Å; F523-Y543 PolarHBondContact O-N 2.86Å; D525-Y543 HydrophobicContact CB-CE2 3.66Å; L541-Y543 HydrophobicContact CB-CE1 3.68Å; L541-Y543 HydrophobicContact CB-CE2 4.35Å; L541-Y543 HydrophobicContact CD1-CE1 3.97Å; L541-Y543 WeakPolarHBondContact CD1-OH 3.4Å; L541-Y543 HydrophobicContact CG-CE1 4.48Å; Y543-I575 HydrophobicContact CD1-CD1 3.75Å; Y543-I575 HydrophobicContact CD1-CG2 4.2Å; Y543-I575 HydrophobicContact CE1-CB 4.26Å; Y543-I575 HydrophobicContact CE1-CD1 3.94Å; Y543-I575 HydrophobicContact CE1-CG2 3.36Å; Y543-I575 HydrophobicContact CG-CD1 4.09Å; Y543-V638 HydrophobicContact CD1-CB 4.32Å; Y543-V638 HydrophobicContact CD1-CG1 3.77Å; Y543-V638 HydrophobicContact CD1-CG2 3.86Å; Y543-V638 HydrophobicContact CE1-CG1 3.84Å; Y543-V638 HydrophobicContact CE1-CG2 4.46Å
544	N	92.4	Very high	87.9	Confident	42 Å²	42	62.3 Å²	62.3	23%	0.225	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	129.2	171.7	-64.6	-36.6	0	0	0	107.9	F522 V635 S636 S637 D639	F522-N544 WeakPolarHBondContact CB-OD1 3.18Å; N544-V635 CarbonylContact O-C 3.57Å; N544-V635 WeakPolarHBondContact O-CA 3.33Å; N544-S636 PolarHBondContact O-N 2.89Å; N544-S636 PolarHBondContact O-OG 2.77Å; N544-S637 PolarHBondContact N-O 3.3Å; N544-S637 PolarHBondContact ND2-OG 2.86Å; N544-D639 PolarHBondContact ND2-OD2 3.18Å
545	W	92.5	Very high	87.7	Confident	7 Å²	7	60 Å²	60	3%	0.027	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	156.6	-170.9	65	-86.3	0	0	0	112	L517 D521 F523 F547 F567 L633 V634	L517-W545 HydrophobicContact CB-CH2 4.13Å; L517-W545 VanDerWaalsContact O-CH2 3.25Å; L517-W545 WeakPolarHBondContact O-CH2 3.47Å; L517-W545 VanDerWaalsContact O-CZ3 3.24Å; L517-W545 WeakPolarHBondContact O-CZ3 3.31Å; D521-W545 HydrophobicContact CB-CD2 4.46Å; D521-W545 HydrophobicContact CB-CH2 4.14Å; D521-W545 HydrophobicContact CB-CZ2 3.61Å; D521-W545 PolarHBondContact N-O 3.49Å; D521-W545 VanDerWaalsContact O-CD1 3.23Å; D521-W545 PolarHBondContact O-N 2.8Å; D521-W545 PolarHBondContact O-NE1 3.26Å; D521-W545 WeakPolarHBondContact OD2-CZ2 3.41Å; F523-W545 AromaticContact CD1-CD1 3.2Å; F523-W545 HydrophobicContact CD1-CD2 4.26Å; F523-W545 AromaticContact CD1-CE2 3.69Å; F523-W545 AromaticContact CD1-CG 3.98Å; F523-W545 HydrophobicContact CD1-CG 3.98Å; F523-W545 HydrophobicContact CD1-CZ2 4.42Å; F523-W545 AromaticContact CD1-NE1 3.03Å; F523-W545 HydrophobicContact CE1-CB 4.31Å; F523-W545 AromaticContact CE1-CD1 3.22Å; F523-W545 HydrophobicContact CE1-CD2 4.03Å; F523-W545 AromaticContact CE1-CE2 3.93Å; F523-W545 AromaticContact CE1-CG 3.59Å; F523-W545 HydrophobicContact CE1-CG 3.59Å; F523-W545 AromaticContact CE1-NE1 3.5Å; F523-W545 AromaticContact CG-NE1 3.94Å; F523-W545 HydrophobicContact CZ-CG 4.46Å; W545-F547 HydrophobicContact CE3-CD2 4.11Å; W545-F547 HydrophobicContact CE3-CE2 4.12Å; W545-F547 HydrophobicContact CH2-CE2 4.48Å; W545-F547 AromaticContact CZ3-CD2 3.66Å; W545-F547 HydrophobicContact CZ3-CD2 3.66Å; W545-F547 AromaticContact CZ3-CE2 3.62Å; W545-F547 HydrophobicContact CZ3-CE2 3.62Å; W545-F567 HydrophobicContact CD2-CE2 4.25Å; W545-F567 HydrophobicContact CE3-CE2 4.06Å; W545-F567 AromaticContact CH2-CE2 3.9Å; W545-F567 HydrophobicContact CH2-CE2 3.9Å; W545-F567 AromaticContact CH2-CZ 3.7Å; W545-F567 HydrophobicContact CH2-CZ 3.7Å; W545-F567 HydrophobicContact CZ2-CE2 4.06Å; W545-F567 AromaticContact CZ2-CZ 3.97Å; W545-F567 HydrophobicContact CZ2-CZ 3.97Å; W545-F567 AromaticContact CZ3-CE2 3.92Å; W545-F567 HydrophobicContact CZ3-CE2 3.92Å; W545-F567 HydrophobicContact CZ3-CZ 4.09Å; W545-L633 HydrophobicContact CB-CD1 4.06Å; W545-L633 HydrophobicContact CD2-CD1 4.17Å; W545-L633 HydrophobicContact CE3-CD1 3.67Å; W545-L633 HydrophobicContact CG-CD1 4.36Å; W545-V634 CarbonylContact C-O 3.25Å; W545-V634 WeakPolarHBondContact CA-O 3.5Å
546	H	93.2	Very high	87.4	Confident	53 Å²	53	66.7 Å²	66.7	25%	0.245	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	161.3	166.8	64	-72.7	0	0	0	108.7	L518 P520 V634	L518-H546 CarbonylContact O-C 3.56Å; L518-H546 WeakPolarHBondContact O-CA 3.45Å; P520-H546 HydrophobicContact CB-CB 4.47Å; H546-V634 PolarHBondContact N-O 2.87Å; H546-V634 PolarHBondContact O-N 2.83Å
547	F	91.8	Very high	87.1	Confident	16 Å²	16	61 Å²	61	7%	0.07	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	129.6	168.9	-76.9	-88.8	0	0	0	109.4	L516 L518 W545 L561 F567 N631 G632 L633	L516-F547 HydrophobicContact CD1-CE2 4.22Å; L516-F547 HydrophobicContact CD1-CZ 4.23Å; L516-F547 HydrophobicContact CD2-CE2 4.27Å; L516-F547 HydrophobicContact CD2-CZ 4.14Å; L516-F547 HydrophobicContact CG-CE2 4.27Å; L516-F547 HydrophobicContact CG-CZ 4.49Å; L518-F547 HydrophobicContact CB-CB 4.45Å; L518-F547 HydrophobicContact CD2-CB 4.09Å; L518-F547 HydrophobicContact CD2-CD2 4.38Å; L518-F547 HydrophobicContact CD2-CG 4.34Å; L518-F547 PolarHBondContact O-N 3.35Å; W545-F547 HydrophobicContact CE3-CD2 4.11Å; W545-F547 HydrophobicContact CE3-CE2 4.12Å; W545-F547 HydrophobicContact CH2-CE2 4.48Å; W545-F547 AromaticContact CZ3-CD2 3.66Å; W545-F547 HydrophobicContact CZ3-CD2 3.66Å; W545-F547 AromaticContact CZ3-CE2 3.62Å; W545-F547 HydrophobicContact CZ3-CE2 3.62Å; F547-L561 HydrophobicContact CB-CD2 3.86Å; F547-L561 HydrophobicContact CD1-CD2 3.46Å; F547-L561 VanDerWaalsContact CD1-CD2 3.46Å; F547-L561 HydrophobicContact CE1-CD2 4.17Å; F547-L561 HydrophobicContact CG-CD2 3.81Å; F547-F567 HydrophobicContact CE2-CD2 4Å; F547-F567 HydrophobicContact CE2-CE1 4.49Å; F547-F567 AromaticContact CE2-CE2 3.89Å; F547-F567 HydrophobicContact CE2-CE2 3.89Å; F547-F567 HydrophobicContact CE2-CG 4.34Å; F547-F567 HydrophobicContact CE2-CZ 4.14Å; F547-F567 HydrophobicContact CZ-CB 4.18Å; F547-F567 HydrophobicContact CZ-CD1 4.23Å; F547-F567 AromaticContact CZ-CD2 3.74Å; F547-F567 HydrophobicContact CZ-CD2 3.74Å; F547-F567 HydrophobicContact CZ-CE2 4.12Å; F547-F567 AromaticContact CZ-CG 3.79Å; F547-F567 HydrophobicContact CZ-CG 3.79Å; F547-N631 VanDerWaalsContact CD1-O 3.3Å; F547-N631 WeakPolarHBondContact CD1-O 3.5Å; F547-N631 HydrophobicContact CE1-CB 4.24Å; F547-N631 WeakPolarHBondContact CE1-O 3.47Å; F547-G632 WeakPolarHBondContact CA-O 3.08Å; F547-L633 HydrophobicContact CD1-CB 4.24Å; F547-L633 HydrophobicContact CD2-CD1 4.27Å; F547-L633 HydrophobicContact CE1-CB 3.87Å; F547-L633 HydrophobicContact CE1-CD1 4.25Å; F547-L633 HydrophobicContact CE2-CD1 3.93Å; F547-L633 HydrophobicContact CZ-CB 4.28Å; F547-L633 HydrophobicContact CZ-CD1 3.92Å
548	E	87.1	Confident	86.8	Confident	96 Å²	96	61.3 Å²	61.3	45%	0.449	30%	0.298	S	S	.	.			trans	-102.1	119.7	174.1	-167.6	171.1	-156.6	0	0	108.6	G632 V634	E548-G632 PolarHBondContact N-O 2.99Å; E548-V634 HydrophobicContact CB-CG2 3.75Å
549	V	84.4	Confident	86.4	Confident	32 Å²	32	59.5 Å²	59.5	19%	0.194	30%	0.295	C	S	.	.			trans	-126.7	119	179.5	-177	0	0	0	0	107.1	R552 E557 L561	V549-R552 HydrophobicContact CG1-CG 4.35Å; V549-E557 HydrophobicContact CG1-CG 4.32Å; V549-L561 HydrophobicContact CG2-CD1 4.08Å; V549-L561 HydrophobicContact CG2-CD2 3.73Å; V549-L561 HydrophobicContact CG2-CG 4.15Å
550	N	80.6	Confident	86.2	Confident	137 Å²	137	64.5 Å²	64.5	73%	0.733	32%	0.317	S	S	*	.	S	Bend	trans	-74.6	-48.7	-175.1	-58.2	-67.3	0	0	0	110.9	E557	N550-E557 WeakPolarHBondContact CB-OE1 3.2Å; N550-E557 PolarHBondContact N-OE1 3.48Å; N550-E557 PolarHBondContact ND2-OE1 2.82Å
551	D	81.6	Confident	86.1	Confident	82 Å²	82	61.6 Å²	61.6	44%	0.439	30%	0.304	S	S	.	.			trans	-122.4	110.8	175.6	-165.7	-7.1	0	0	0	111.7	K553 D554 E557	D551-K553 PolarHBondContact O-N 2.87Å; D551-K553 WeakPolarHBondContact OD1-CB 3.25Å; D551-K553 PolarHBondContact OD1-N 2.81Å; D551-D554 HydrophobicContact CB-CB 4.32Å; D551-D554 PolarHBondContact O-N 2.89Å; D551-E557 PolarHBondContact N-OE2 2.84Å
552	R	80.4	Confident	86	Confident	153 Å²	153	62.5 Å²	62.5	58%	0.577	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-12.1	176.1	-64.3	-174.8	-177.8	-173.9	-1.1	113.1	F482 V549 T558	F482-R552 HydrophobicContact CE2-CB 4.16Å; V549-R552 HydrophobicContact CG1-CG 4.35Å; R552-T558 WeakPolarHBondContact O-CG2 3.44Å
553	K	78.4	Confident	85.9	Confident	185 Å²	185	66 Å²	66	80%	0.804	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-16.8	-179.5	-63.3	-176.4	179	-179.4	0	113.2	D551 P555	D551-K553 PolarHBondContact O-N 2.87Å; D551-K553 WeakPolarHBondContact OD1-CB 3.25Å; D551-K553 PolarHBondContact OD1-N 2.81Å; K553-P555 VanDerWaalsContact O-CD 3.24Å; K553-P555 WeakPolarHBondContact O-CD 3.37Å
554	D	85.8	Confident	85.8	Confident	58 Å²	58	66.8 Å²	66.8	31%	0.31	34%	0.337	S	S	.	.			trans	-76.3	115.3	178.9	-179.8	12.1	0	0	0	111	D551 Q556 E557 T558	D551-D554 HydrophobicContact CB-CB 4.32Å; D551-D554 PolarHBondContact O-N 2.89Å; D554-Q556 PolarHBondContact O-N 3Å; D554-Q556 PolarHBondContact OD1-N 3.1Å; D554-E557 HydrophobicContact CB-CB 4.06Å; D554-E557 PolarHBondContact O-N 2.89Å; D554-E557 PolarHBondContact OD2-N 2.89Å; D554-T558 WeakPolarHBondContact O-CB 3.48Å; D554-T558 WeakPolarHBondContact O-CG2 3.39Å; D554-T558 PolarHBondContact O-N 3.25Å; D554-T558 PolarHBondContact O-OG1 3.39Å
555	P	80.6	Confident	85.3	Confident	92 Å²	92	69.2 Å²	69.2	60%	0.597	36%	0.355	S	S	*	.	H	α-helix	trans	-60.5	-29.9	178	-22.9	35.7	0	0	0	113.3	K553 T558 A559	K553-P555 VanDerWaalsContact O-CD 3.24Å; K553-P555 WeakPolarHBondContact O-CD 3.37Å; P555-T558 VanDerWaalsContact CA-OG1 3.29Å; P555-T558 WeakPolarHBondContact CA-OG1 3.37Å; P555-T558 PolarHBondContact O-OG1 2.89Å; P555-T558 VanDerWaalsContact O-OG1 3.14Å; P555-A559 VanDerWaalsContact O-CB 3.25Å; P555-A559 WeakPolarHBondContact O-CB 3.4Å; P555-A559 PolarHBondContact O-N 3.38Å; P555-A559 VanDerWaalsContact O-N 3.1Å
556	Q	80.8	Confident	85.2	Confident	153 Å²	153	70 Å²	70	72%	0.715	36%	0.36	S	S	*	.	H	α-helix	trans	-76.6	-42.5	-178.5	-64.7	-170.7	3.3	0	0	111.7	D554 K560	D554-Q556 PolarHBondContact O-N 3Å; D554-Q556 PolarHBondContact OD1-N 3.1Å; Q556-K560 WeakPolarHBondContact O-CG 3.24Å; Q556-K560 PolarHBondContact O-N 2.76Å
557	E	82.3	Confident	85	Confident	34 Å²	34	67.9 Å²	67.9	16%	0.159	35%	0.35	C	S	.	.	H	α-helix	trans	-67.2	-42.9	175.3	-166.1	176	-163.7	0	0	111.6	V549 N550 D551 D554 A559 K560	V549-E557 HydrophobicContact CG1-CG 4.32Å; N550-E557 WeakPolarHBondContact CB-OE1 3.2Å; N550-E557 PolarHBondContact N-OE1 3.48Å; N550-E557 PolarHBondContact ND2-OE1 2.82Å; D551-E557 PolarHBondContact N-OE2 2.84Å; D554-E557 HydrophobicContact CB-CB 4.06Å; D554-E557 PolarHBondContact O-N 2.89Å; D554-E557 PolarHBondContact OD2-N 2.89Å; E557-A559 VanDerWaalsContact C-N 3.34Å; E557-A559 PolarHBondContact O-N 3.29Å; E557-K560 VanDerWaalsContact O-CB 3.26Å; E557-K560 WeakPolarHBondContact O-CB 3.4Å; E557-K560 PolarHBondContact O-N 3.47Å
558	T	84.2	Confident	85	Confident	8 Å²	8	67.6 Å²	67.6	5%	0.049	35%	0.349	C	S	.	.	H	α-helix	trans	-66.1	-34.4	178.8	55.4	0	0	0	0	112.7	F482 R552 D554 P555 K560 L561	F482-T558 HydrophobicContact CE2-CG2 3.62Å; F482-T558 HydrophobicContact CZ-CG2 3.74Å; R552-T558 WeakPolarHBondContact O-CG2 3.44Å; D554-T558 WeakPolarHBondContact O-CB 3.48Å; D554-T558 WeakPolarHBondContact O-CG2 3.39Å; D554-T558 PolarHBondContact O-N 3.25Å; D554-T558 PolarHBondContact O-OG1 3.39Å; P555-T558 VanDerWaalsContact CA-OG1 3.29Å; P555-T558 WeakPolarHBondContact CA-OG1 3.37Å; P555-T558 PolarHBondContact O-OG1 2.89Å; P555-T558 VanDerWaalsContact O-OG1 3.14Å; T558-K560 PolarHBondContact O-N 3.14Å; T558-L561 WeakPolarHBondContact O-CB 3.46Å; T558-L561 PolarHBondContact O-N 3.27Å
559	A	84.2	Confident	85.1	Confident	36 Å²	36	63.7 Å²	63.7	30%	0.298	34%	0.335	S	S	.	.	H	α-helix	trans	-62.8	-28	172	0	0	0	0	0	112.7	P555 E557 L561 F562	P555-A559 VanDerWaalsContact O-CB 3.25Å; P555-A559 WeakPolarHBondContact O-CB 3.4Å; P555-A559 PolarHBondContact O-N 3.38Å; P555-A559 VanDerWaalsContact O-N 3.1Å; E557-A559 VanDerWaalsContact C-N 3.34Å; E557-A559 PolarHBondContact O-N 3.29Å; A559-L561 PolarHBondContact O-N 3.37Å; A559-F562 PolarHBondContact O-N 2.96Å; A559-F562 VanDerWaalsContact O-N 3.15Å
560	K	86.6	Confident	85.4	Confident	105 Å²	105	65.1 Å²	65.1	46%	0.457	34%	0.341	S	S	.	.	H	α-helix	trans	-61.7	-31.9	179	-67.2	174.6	-174.1	169.4	0	112.7	Q556 E557 T558 F562 S563 N631	Q556-K560 WeakPolarHBondContact O-CG 3.24Å; Q556-K560 PolarHBondContact O-N 2.76Å; E557-K560 VanDerWaalsContact O-CB 3.26Å; E557-K560 WeakPolarHBondContact O-CB 3.4Å; E557-K560 PolarHBondContact O-N 3.47Å; T558-K560 PolarHBondContact O-N 3.14Å; K560-F562 PolarHBondContact O-N 3.2Å; K560-S563 WeakPolarHBondContact CA-OG 3.21Å; K560-S563 VanDerWaalsContact O-CB 3.26Å; K560-S563 WeakPolarHBondContact O-CB 3.43Å; K560-S563 PolarHBondContact O-N 3.02Å; K560-S563 PolarHBondContact O-OG 3.11Å; K560-N631 VanDerWaalsContact O-CA 3.25Å; K560-N631 WeakPolarHBondContact O-CA 3.46Å; K560-N631 WeakPolarHBondContact O-CB 3.26Å
561	L	88.4	Confident	85.9	Confident	4 Å²	4	58.6 Å²	58.6	2%	0.021	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-34.1	177	-71.7	169.7	0	0	0	112.4	F482 L516 L518 F547 V549 T558 A559	F482-L561 HydrophobicContact CE1-CD1 3.93Å; F482-L561 HydrophobicContact CZ-CD1 3.91Å; L516-L561 HydrophobicContact CD2-CB 3.82Å; L516-L561 HydrophobicContact CD2-CD2 4.41Å; L516-L561 WeakPolarHBondContact CD2-O 3.4Å; L518-L561 HydrophobicContact CD2-CD1 4.02Å; L518-L561 HydrophobicContact CD2-CD2 3.94Å; F547-L561 HydrophobicContact CB-CD2 3.86Å; F547-L561 HydrophobicContact CD1-CD2 3.46Å; F547-L561 VanDerWaalsContact CD1-CD2 3.46Å; F547-L561 HydrophobicContact CE1-CD2 4.17Å; F547-L561 HydrophobicContact CG-CD2 3.81Å; V549-L561 HydrophobicContact CG2-CD1 4.08Å; V549-L561 HydrophobicContact CG2-CD2 3.73Å; V549-L561 HydrophobicContact CG2-CG 4.15Å; T558-L561 WeakPolarHBondContact O-CB 3.46Å; T558-L561 PolarHBondContact O-N 3.27Å; A559-L561 PolarHBondContact O-N 3.37Å
562	F	88.8	Confident	86.4	Confident	19 Å²	19	54.9 Å²	54.9	8%	0.083	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	3.2	-177.6	-64.1	-94.4	0	0	0	113.4	A467 Q469 V480 L498 L516 A559 K560 V564	A467-F562 HydrophobicContact CB-CE2 4.16Å; A467-F562 HydrophobicContact CB-CZ 4.08Å; Q469-F562 HydrophobicContact CB-CD1 3.68Å; Q469-F562 HydrophobicContact CB-CD2 3.89Å; Q469-F562 HydrophobicContact CB-CE1 3.67Å; Q469-F562 HydrophobicContact CB-CE2 3.89Å; Q469-F562 HydrophobicContact CB-CG 3.81Å; Q469-F562 HydrophobicContact CB-CZ 3.78Å; Q469-F562 HydrophobicContact CG-CD2 4.47Å; Q469-F562 HydrophobicContact CG-CG 4.36Å; Q469-F562 VanDerWaalsContact OE1-CB 3.3Å; V480-F562 HydrophobicContact CG1-CE2 3.77Å; V480-F562 HydrophobicContact CG2-CD2 3.97Å; V480-F562 HydrophobicContact CG2-CE2 3.9Å; L498-F562 HydrophobicContact CD1-CE1 4.21Å; L498-F562 HydrophobicContact CD2-CD1 3.91Å; L498-F562 HydrophobicContact CD2-CE1 4.29Å; L516-F562 HydrophobicContact CB-CE1 3.84Å; L516-F562 HydrophobicContact CB-CZ 3.78Å; L516-F562 HydrophobicContact CD2-CE1 4.5Å; L516-F562 HydrophobicContact CD2-CE2 4.42Å; L516-F562 HydrophobicContact CD2-CZ 4.3Å; A559-F562 PolarHBondContact O-N 2.96Å; A559-F562 VanDerWaalsContact O-N 3.15Å; K560-F562 PolarHBondContact O-N 3.2Å; F562-V564 PolarHBondContact O-N 2.8Å
563	S	88.6	Confident	86.8	Confident	75 Å²	75	54.8 Å²	54.8	52%	0.524	29%	0.291	S	S	.	.	S	Bend	trans	-59.8	-34.8	177.9	-69.3	0	0	0	0	112.8	K560	K560-S563 WeakPolarHBondContact CA-OG 3.21Å; K560-S563 VanDerWaalsContact O-CB 3.26Å; K560-S563 WeakPolarHBondContact O-CB 3.43Å; K560-S563 PolarHBondContact O-N 3.02Å; K560-S563 PolarHBondContact O-OG 3.11Å
564	V	88.8	Confident	87.4	Confident	16 Å²	16	47.2 Å²	47.2	10%	0.097	26%	0.262	C	S	.	.	S	Bend	trans	-103.3	108.5	-180	-178	0	0	0	0	108.3	F562 D566 F567 D570 Q630 N631	F562-V564 PolarHBondContact O-N 2.8Å; V564-D566 VanDerWaalsContact C-N 3.32Å; V564-D566 PolarHBondContact O-N 2.91Å; V564-F567 HydrophobicContact CG1-CB 4.45Å; V564-D570 HydrophobicContact CG1-CB 3.85Å; V564-Q630 HydrophobicContact CG2-CB 4.04Å; V564-N631 HydrophobicContact CB-CB 4.19Å; V564-N631 HydrophobicContact CG2-CB 3.87Å
565	P	82	Confident	87.6	Confident	93 Å²	93	44.5 Å²	44.5	60%	0.604	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-32.6	-172.2	24.7	-34	0	0	0	113.3
566	D	89.9	Confident	88	Confident	24 Å²	24	40.5 Å²	40.5	13%	0.128	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.3	75.6	174.7	-174.6	7.7	0	0	0	110.4	S499 L500 S501 V564 V568 G569 D570	S499-D566 WeakPolarHBondContact O-CB 3.26Å; L500-D566 WeakPolarHBondContact CA-OD1 3.19Å; S501-D566 VanDerWaalsContact CB-OD2 3.3Å; S501-D566 WeakPolarHBondContact CB-OD2 3.23Å; S501-D566 VanDerWaalsContact N-CG 3.29Å; S501-D566 PolarHBondContact N-OD1 3.04Å; S501-D566 PolarHBondContact N-OD2 2.79Å; S501-D566 PolarHBondContact OG-OD2 3.11Å; V564-D566 VanDerWaalsContact C-N 3.32Å; V564-D566 PolarHBondContact O-N 2.91Å; D566-V568 PolarHBondContact O-N 2.84Å; D566-G569 PolarHBondContact O-N 2.92Å; D566-G569 PolarHBondContact OD1-N 3.03Å; D566-G569 WeakPolarHBondContact OD2-CA 3.42Å; D566-D570 WeakPolarHBondContact O-CB 3.39Å; D566-D570 PolarHBondContact O-N 3.03Å
567	F	90.9	Very high	88.5	Confident	8 Å²	8	36.5 Å²	36.5	4%	0.035	21%	0.211	C	C	.	.	H	α-helix	trans	-61	-32.9	-178.8	80.3	-86.7	0	0	0	112.9	L500 L516 F523 W545 F547 V564 A571 N631 L633	L500-F567 HydrophobicContact CD1-CE1 4.1Å; L500-F567 HydrophobicContact CD2-CD1 3.7Å; L500-F567 HydrophobicContact CD2-CE1 3.81Å; L516-F567 HydrophobicContact CD1-CD1 3.67Å; L516-F567 HydrophobicContact CD1-CE1 3.54Å; L516-F567 HydrophobicContact CD1-CZ 4.42Å; F523-F567 HydrophobicContact CE1-CE2 4.17Å; W545-F567 HydrophobicContact CD2-CE2 4.25Å; W545-F567 HydrophobicContact CE3-CE2 4.06Å; W545-F567 AromaticContact CH2-CE2 3.9Å; W545-F567 HydrophobicContact CH2-CE2 3.9Å; W545-F567 AromaticContact CH2-CZ 3.7Å; W545-F567 HydrophobicContact CH2-CZ 3.7Å; W545-F567 HydrophobicContact CZ2-CE2 4.06Å; W545-F567 AromaticContact CZ2-CZ 3.97Å; W545-F567 HydrophobicContact CZ2-CZ 3.97Å; W545-F567 AromaticContact CZ3-CE2 3.92Å; W545-F567 HydrophobicContact CZ3-CE2 3.92Å; W545-F567 HydrophobicContact CZ3-CZ 4.09Å; F547-F567 HydrophobicContact CE2-CD2 4Å; F547-F567 HydrophobicContact CE2-CE1 4.49Å; F547-F567 AromaticContact CE2-CE2 3.89Å; F547-F567 HydrophobicContact CE2-CE2 3.89Å; F547-F567 HydrophobicContact CE2-CG 4.34Å; F547-F567 HydrophobicContact CE2-CZ 4.14Å; F547-F567 HydrophobicContact CZ-CB 4.18Å; F547-F567 HydrophobicContact CZ-CD1 4.23Å; F547-F567 AromaticContact CZ-CD2 3.74Å; F547-F567 HydrophobicContact CZ-CD2 3.74Å; F547-F567 HydrophobicContact CZ-CE2 4.12Å; F547-F567 AromaticContact CZ-CG 3.79Å; F547-F567 HydrophobicContact CZ-CG 3.79Å; V564-F567 HydrophobicContact CG1-CB 4.45Å; F567-A571 WeakPolarHBondContact O-CB 3.38Å; F567-A571 PolarHBondContact O-N 2.72Å; F567-N631 WeakPolarHBondContact CB-ND2 3.4Å; F567-L633 HydrophobicContact CD2-CD1 3.86Å; F567-L633 HydrophobicContact CD2-CD2 4Å; F567-L633 HydrophobicContact CE2-CD1 4.1Å
568	V	90.4	Very high	88.9	Confident	10 Å²	10	40.2 Å²	40.2	6%	0.061	22%	0.224	C	C	.	.	H	α-helix	trans	-68.9	-47.5	178.3	178.9	0	0	0	0	109.9	K506 F523 D566 C572	K506-V568 HydrophobicContact CD-CG1 4.23Å; F523-V568 HydrophobicContact CB-CG1 4.43Å; F523-V568 HydrophobicContact CD1-CG1 4.09Å; F523-V568 HydrophobicContact CD1-CG2 4.03Å; F523-V568 HydrophobicContact CD2-CG1 4.01Å; F523-V568 HydrophobicContact CE1-CG1 4.45Å; F523-V568 HydrophobicContact CE1-CG2 4.28Å; F523-V568 HydrophobicContact CE2-CG1 4.35Å; F523-V568 HydrophobicContact CG-CG1 3.93Å; D566-V568 PolarHBondContact O-N 2.84Å; V568-C572 VanDerWaalsContact O-CB 3.32Å; V568-C572 WeakPolarHBondContact O-CB 3.36Å; V568-C572 PolarHBondContact O-N 2.83Å; V568-C572 PolarHBondContact O-SG 2.84Å
569	G	90.1	Very high	89.2	Confident	14 Å²	14	39.8 Å²	39.8	14%	0.144	22%	0.222	C	C	.	.	H	α-helix	trans	-63	-44.1	178.1	0	0	0	0	0	112	S501 D566 K573	S501-G569 WeakPolarHBondContact OG-CA 3.37Å; D566-G569 PolarHBondContact O-N 2.92Å; D566-G569 PolarHBondContact OD1-N 3.03Å; D566-G569 WeakPolarHBondContact OD2-CA 3.42Å; G569-K573 WeakPolarHBondContact O-CB 3.15Å; G569-K573 PolarHBondContact O-N 2.88Å
570	D	91	Very high	89.4	Confident	61 Å²	61	43.7 Å²	43.7	33%	0.326	23%	0.228	S	C	.	.	H	α-helix	trans	-63.7	-47.1	177.9	-169.5	62.1	0	0	0	111.9	V564 D566 K573 A574	V564-D570 HydrophobicContact CG1-CB 3.85Å; D566-D570 WeakPolarHBondContact O-CB 3.39Å; D566-D570 PolarHBondContact O-N 3.03Å; D570-K573 PolarHBondContact O-N 3.16Å; D570-A574 WeakPolarHBondContact O-CB 3.44Å; D570-A574 PolarHBondContact O-N 2.98Å
571	A	90.9	Very high	89.5	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61	-49.2	176.4	0	0	0	0	0	112	F523 F567 K573 A574 I575 F628 L633	F523-A571 HydrophobicContact CE2-CB 4.47Å; F523-A571 HydrophobicContact CZ-CB 3.88Å; F567-A571 WeakPolarHBondContact O-CB 3.38Å; F567-A571 PolarHBondContact O-N 2.72Å; A571-K573 VanDerWaalsContact C-N 3.34Å; A571-K573 PolarHBondContact O-N 2.96Å; A571-A574 PolarHBondContact O-N 2.9Å; A571-I575 WeakPolarHBondContact O-CB 3.38Å; A571-I575 WeakPolarHBondContact O-CD1 3.28Å; A571-I575 WeakPolarHBondContact O-CG1 3.25Å; A571-I575 PolarHBondContact O-N 3.06Å; A571-F628 HydrophobicContact CB-CE2 4.34Å; A571-F628 HydrophobicContact CB-CZ 4.18Å; A571-L633 HydrophobicContact CB-CD2 3.66Å
572	C	90.7	Very high	89.6	Confident	4 Å²	4	42.3 Å²	42.3	3%	0.027	24%	0.242	C	C	.	.	H	α-helix	trans	-62	-41.8	178.1	-66.3	0	0	0	0	111.3	K506 F523 V568 I575 A576	K506-C572 HydrophobicContact CG-CB 4.44Å; F523-C572 WeakPolarHBondContact CE2-SG 3.41Å; V568-C572 VanDerWaalsContact O-CB 3.32Å; V568-C572 WeakPolarHBondContact O-CB 3.36Å; V568-C572 PolarHBondContact O-N 2.83Å; V568-C572 PolarHBondContact O-SG 2.84Å; C572-I575 PolarHBondContact O-N 3.42Å; C572-A576 WeakPolarHBondContact O-CB 3.41Å; C572-A576 PolarHBondContact O-N 3.1Å
573	K	90.4	Very high	89.6	Confident	152 Å²	152	41.4 Å²	41.4	66%	0.661	24%	0.238	S	C	*	.	H	α-helix	trans	-64.3	-45.3	178.8	-175.8	-179.9	-179.4	-176.4	0	111.8	G569 D570 A571 S577	G569-K573 WeakPolarHBondContact O-CB 3.15Å; G569-K573 PolarHBondContact O-N 2.88Å; D570-K573 PolarHBondContact O-N 3.16Å; A571-K573 VanDerWaalsContact C-N 3.34Å; A571-K573 PolarHBondContact O-N 2.96Å; K573-S577 WeakPolarHBondContact O-CB 3.38Å; K573-S577 PolarHBondContact O-N 2.88Å
574	A	90.3	Very high	89.6	Confident	26 Å²	26	40.5 Å²	40.5	22%	0.215	24%	0.235	C	C	.	.	H	α-helix	trans	-63.9	-47.5	177.5	0	0	0	0	0	111.3	D570 A571 S577 R578 F628	D570-A574 WeakPolarHBondContact O-CB 3.44Å; D570-A574 PolarHBondContact O-N 2.98Å; A571-A574 PolarHBondContact O-N 2.9Å; A574-S577 WeakPolarHBondContact O-CB 3.17Å; A574-S577 PolarHBondContact O-N 2.97Å; A574-R578 WeakPolarHBondContact O-CG 3.39Å; A574-R578 PolarHBondContact O-N 3.01Å; A574-F628 HydrophobicContact CB-CE1 3.82Å; A574-F628 HydrophobicContact CB-CZ 4.21Å
575	I	90.4	Very high	89.6	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-63.8	-47.6	178.1	-67.9	167.7	0	0	0	110.9	Y543 A571 C572 S577 R578 V579 V603 V635	Y543-I575 HydrophobicContact CD1-CD1 3.75Å; Y543-I575 HydrophobicContact CD1-CG2 4.2Å; Y543-I575 HydrophobicContact CE1-CB 4.26Å; Y543-I575 HydrophobicContact CE1-CD1 3.94Å; Y543-I575 HydrophobicContact CE1-CG2 3.36Å; Y543-I575 HydrophobicContact CG-CD1 4.09Å; A571-I575 WeakPolarHBondContact O-CB 3.38Å; A571-I575 WeakPolarHBondContact O-CD1 3.28Å; A571-I575 WeakPolarHBondContact O-CG1 3.25Å; A571-I575 PolarHBondContact O-N 3.06Å; C572-I575 PolarHBondContact O-N 3.42Å; I575-S577 PolarHBondContact O-N 2.8Å; I575-R578 PolarHBondContact O-N 3.29Å; I575-R578 VanDerWaalsContact O-N 3.1Å; I575-V579 HydrophobicContact CG2-CG2 4.19Å; I575-V579 WeakPolarHBondContact O-CG2 3.48Å; I575-V579 PolarHBondContact O-N 2.8Å; I575-V603 HydrophobicContact CD1-CG1 4.49Å; I575-V603 HydrophobicContact CG1-CG1 4.14Å; I575-V603 HydrophobicContact CG2-CG1 4.48Å; I575-V603 HydrophobicContact CG2-CG2 3.61Å; I575-V635 HydrophobicContact CD1-CG2 4.28Å
576	A	89.4	Confident	90	Very high	8 Å²	8	40.9 Å²	40.9	7%	0.066	24%	0.24	C	C	.	.	H	α-helix	trans	-58.4	-36.2	176.6	0	0	0	0	0	112	I527 C572 R580	I527-A576 HydrophobicContact CB-CB 4.46Å; I527-A576 HydrophobicContact CG2-CB 3.67Å; C572-A576 WeakPolarHBondContact O-CB 3.41Å; C572-A576 PolarHBondContact O-N 3.1Å; A576-R580 VanDerWaalsContact O-CB 3.25Å; A576-R580 WeakPolarHBondContact O-CB 3.32Å; A576-R580 VanDerWaalsContact O-CG 3.26Å; A576-R580 WeakPolarHBondContact O-CG 3.36Å; A576-R580 PolarHBondContact O-N 3.39Å; A576-R580 PolarHBondContact O-NE 3.07Å; A576-R580 VanDerWaalsContact O-NE 3.07Å
577	S	90.8	Very high	90.1	Very high	69 Å²	69	42.7 Å²	42.7	48%	0.483	25%	0.252	S	S	.	.	H	α-helix	trans	-68	-44.1	175.4	-166.5	0	0	0	0	112	K573 A574 I575 G581	K573-S577 WeakPolarHBondContact O-CB 3.38Å; K573-S577 PolarHBondContact O-N 2.88Å; A574-S577 WeakPolarHBondContact O-CB 3.17Å; A574-S577 PolarHBondContact O-N 2.97Å; I575-S577 PolarHBondContact O-N 2.8Å; S577-G581 PolarHBondContact O-N 3.25Å
578	R	90	Very high	89.9	Confident	112 Å²	112	44 Å²	44	42%	0.423	26%	0.258	S	S	.	.	H	α-helix	trans	-63	-46.1	177.4	-70.7	178.8	-171.1	-179.5	5.3	111.7	A574 I575 G581 A582 A602 V603	A574-R578 WeakPolarHBondContact O-CG 3.39Å; A574-R578 PolarHBondContact O-N 3.01Å; I575-R578 PolarHBondContact O-N 3.29Å; I575-R578 VanDerWaalsContact O-N 3.1Å; R578-G581 PolarHBondContact O-N 3.07Å; R578-A582 PolarHBondContact O-N 3.01Å; R578-A602 WeakPolarHBondContact CB-O 3.38Å; R578-V603 PolarHBondContact NH1-O 2.96Å
579	V	90.2	Very high	89.6	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-65.7	-46.3	178.7	177.7	0	0	0	0	110.9	I527 I529 L539 I575 G581 A582 V583 I599 V603	I527-V579 HydrophobicContact CD1-CB 3.95Å; I527-V579 HydrophobicContact CD1-CG1 3.8Å; I527-V579 HydrophobicContact CD1-CG2 4.5Å; I529-V579 HydrophobicContact CG2-CG1 4.38Å; L539-V579 HydrophobicContact CD1-CG1 3.91Å; I575-V579 HydrophobicContact CG2-CG2 4.19Å; I575-V579 WeakPolarHBondContact O-CG2 3.48Å; I575-V579 PolarHBondContact O-N 2.8Å; V579-G581 VanDerWaalsContact C-N 3.32Å; V579-G581 PolarHBondContact O-N 2.86Å; V579-A582 PolarHBondContact O-N 2.93Å; V579-V583 HydrophobicContact CG1-CG2 4.01Å; V579-V583 VanDerWaalsContact O-CG2 3.29Å; V579-V583 WeakPolarHBondContact O-CG2 3.42Å; V579-V583 PolarHBondContact O-N 3.02Å; V579-I599 HydrophobicContact CG1-CG1 4.19Å; V579-I599 HydrophobicContact CG2-CG2 4.14Å; V579-V603 HydrophobicContact CG2-CG2 3.76Å
580	R	89.6	Confident	89.5	Confident	117 Å²	117	49.9 Å²	49.9	44%	0.442	29%	0.285	S	S	.	.	H	α-helix	trans	-57.8	-43.9	176.1	-81.6	-179.2	-70.7	137.3	-4.4	112.4	I529 A576 A584	I529-R580 HydrophobicContact CB-CG 4.34Å; I529-R580 HydrophobicContact CG2-CG 3.64Å; A576-R580 VanDerWaalsContact O-CB 3.25Å; A576-R580 WeakPolarHBondContact O-CB 3.32Å; A576-R580 VanDerWaalsContact O-CG 3.26Å; A576-R580 WeakPolarHBondContact O-CG 3.36Å; A576-R580 PolarHBondContact O-N 3.39Å; A576-R580 PolarHBondContact O-NE 3.07Å; A576-R580 VanDerWaalsContact O-NE 3.07Å; R580-A584 WeakPolarHBondContact O-CB 3.45Å; R580-A584 PolarHBondContact O-N 3Å; R580-A584 VanDerWaalsContact O-N 3.15Å
581	G	89.1	Confident	89.4	Confident	51 Å²	51	47 Å²	47	53%	0.526	27%	0.27	S	S	.	.	H	α-helix	trans	-63.9	-44	178.9	0	0	0	0	0	112.9	S577 R578 V579	S577-G581 PolarHBondContact O-N 3.25Å; R578-G581 PolarHBondContact O-N 3.07Å; V579-G581 VanDerWaalsContact C-N 3.32Å; V579-G581 PolarHBondContact O-N 2.86Å
582	A	88.6	Confident	89.1	Confident	29 Å²	29	51.9 Å²	51.9	24%	0.24	29%	0.292	C	S	.	.	H	α-helix	trans	-68.7	-46.7	179.1	0	0	0	0	0	112.3	R578 V579 A584 S585 A602	R578-A582 PolarHBondContact O-N 3.01Å; V579-A582 PolarHBondContact O-N 2.93Å; A582-A584 VanDerWaalsContact C-N 3.31Å; A582-A584 PolarHBondContact O-N 2.83Å; A582-S585 PolarHBondContact O-N 2.83Å; A582-S585 VanDerWaalsContact O-N 3.1Å; A582-S585 PolarHBondContact O-OG 2.94Å; A582-A602 HydrophobicContact CB-CB 3.48Å; A582-A602 VanDerWaalsContact CB-CB 3.48Å
583	V	90.1	Very high	88.8	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.006	32%	0.321	C	S	.	.	H	α-helix	trans	-69.6	-28.7	-175.4	-177.1	0	0	0	0	112.5	I529 T531 V579 S585 V586 F591 I598	I529-V583 HydrophobicContact CD1-CB 4Å; I529-V583 HydrophobicContact CD1-CG1 3.59Å; I529-V583 HydrophobicContact CD1-CG2 4.02Å; T531-V583 HydrophobicContact CG2-CG1 3.79Å; V579-V583 HydrophobicContact CG1-CG2 4.01Å; V579-V583 VanDerWaalsContact O-CG2 3.29Å; V579-V583 WeakPolarHBondContact O-CG2 3.42Å; V579-V583 PolarHBondContact O-N 3.02Å; V583-S585 PolarHBondContact O-N 3.04Å; V583-S585 VanDerWaalsContact O-N 3.1Å; V583-V586 PolarHBondContact O-N 3.39Å; V583-V586 VanDerWaalsContact O-O 3.12Å; V583-F591 HydrophobicContact CB-CD2 4.35Å; V583-F591 HydrophobicContact CB-CE2 4.32Å; V583-F591 HydrophobicContact CG1-CD1 4.35Å; V583-F591 HydrophobicContact CG1-CD2 3.75Å; V583-F591 HydrophobicContact CG1-CE2 3.99Å; V583-F591 HydrophobicContact CG1-CG 3.94Å; V583-F591 HydrophobicContact CG1-CZ 4.37Å; V583-F591 HydrophobicContact CG2-CD2 3.69Å; V583-F591 HydrophobicContact CG2-CE2 3.31Å; V583-F591 HydrophobicContact CG2-CZ 4.01Å; V583-I598 HydrophobicContact CG2-CG2 4.33Å
584	A	89.1	Confident	88.7	Confident	55 Å²	55	53.8 Å²	53.8	46%	0.455	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-19.2	172.9	0	0	0	0	0	113.6	E530 A532 R580 A582	E530-A584 WeakPolarHBondContact O-CA 3.44Å; E530-A584 PolarHBondContact O-N 3.4Å; A532-A584 WeakPolarHBondContact CA-O 3.5Å; R580-A584 WeakPolarHBondContact O-CB 3.45Å; R580-A584 PolarHBondContact O-N 3Å; R580-A584 VanDerWaalsContact O-N 3.15Å; A582-A584 VanDerWaalsContact C-N 3.31Å; A582-A584 PolarHBondContact O-N 2.83Å
585	S	88.9	Confident	88.4	Confident	95 Å²	95	53.7 Å²	53.7	66%	0.664	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-3.6	177.5	70.9	0	0	0	0	114.2	A582 V583	A582-S585 PolarHBondContact O-N 2.83Å; A582-S585 VanDerWaalsContact O-N 3.1Å; A582-S585 PolarHBondContact O-OG 2.94Å; V583-S585 PolarHBondContact O-N 3.04Å; V583-S585 VanDerWaalsContact O-N 3.1Å
586	V	90.1	Very high	88	Confident	23 Å²	23	56.7 Å²	56.7	14%	0.139	33%	0.325	C	S	.	.	S	Bend	trans	-116.4	143.5	-174.4	-177.1	0	0	0	0	110.1	T531 A532 V583 D590 F591 I598	T531-V586 WeakPolarHBondContact CB-O 3.26Å; A532-V586 WeakPolarHBondContact CB-O 3.36Å; A532-V586 PolarHBondContact N-O 3.1Å; V583-V586 PolarHBondContact O-N 3.39Å; V583-V586 VanDerWaalsContact O-O 3.12Å; V586-D590 HydrophobicContact CG1-CB 3.75Å; V586-D590 VanDerWaalsContact CG1-OD2 3.29Å; V586-D590 WeakPolarHBondContact CG1-OD2 3.46Å; V586-F591 HydrophobicContact CG1-CB 4.19Å; V586-I598 HydrophobicContact CG1-CD1 4.02Å
587	T	91.2	Very high	87.8	Confident	61 Å²	61	63 Å²	63	37%	0.374	35%	0.347	S	S	.	.			trans	-70.6	158.8	176	59.2	0	0	0	0	111.3	D533 D589 D590 F591	D533-T587 WeakPolarHBondContact OD2-CA 3.49Å; D533-T587 WeakPolarHBondContact OD2-CB 3.35Å; T587-D589 PolarHBondContact O-N 2.85Å; T587-D590 WeakPolarHBondContact OG1-CB 3.48Å; T587-F591 WeakPolarHBondContact O-CB 3.04Å; T587-F591 PolarHBondContact O-N 2.81Å
588	F	86.8	Confident	87.6	Confident	36 Å²	36	60.6 Å²	60.6	16%	0.158	33%	0.329	C	S	.	.	H	α-helix	trans	-62.3	-41.8	-178.1	169.4	-102.5	0	0	0	113	T531 D533 A535 L537 F591 H592 L654	T531-F588 HydrophobicContact CG2-CB 4.32Å; T531-F588 HydrophobicContact CG2-CD2 4.49Å; D533-F588 PolarHBondContact OD2-N 3.32Å; A535-F588 HydrophobicContact CB-CB 3.85Å; A535-F588 HydrophobicContact CB-CD2 3.79Å; A535-F588 HydrophobicContact CB-CG 3.93Å; L537-F588 HydrophobicContact CD1-CD2 3.97Å; L537-F588 HydrophobicContact CD1-CE2 4.02Å; L537-F588 HydrophobicContact CD2-CD2 3.93Å; L537-F588 HydrophobicContact CD2-CE2 3.59Å; L537-F588 HydrophobicContact CG-CD2 4.4Å; L537-F588 HydrophobicContact CG-CE2 4.4Å; F588-F591 PolarHBondContact O-N 3.2Å; F588-H592 HydrophobicContact CZ-CB 4.34Å; F588-H592 WeakPolarHBondContact O-CB 3.46Å; F588-H592 PolarHBondContact O-N 3.47Å; F588-L654 HydrophobicContact CE1-CD1 4.15Å; F588-L654 HydrophobicContact CE1-CD2 3.87Å; F588-L654 HydrophobicContact CE1-CG 4.32Å; F588-L654 HydrophobicContact CZ-CD1 3.68Å; F588-L654 HydrophobicContact CZ-CD2 3.96Å; F588-L654 HydrophobicContact CZ-CG 4.3Å
589	D	85.2	Confident	87.4	Confident	85 Å²	85	55.3 Å²	55.3	46%	0.455	31%	0.309	S	S	.	.	H	α-helix	trans	-66.1	-43.6	-179	-178.2	61.4	0	0	0	112.3	T587 F591 H592 K593	T587-D589 PolarHBondContact O-N 2.85Å; D589-F591 VanDerWaalsContact C-N 3.35Å; D589-H592 PolarHBondContact O-N 3.14Å; D589-K593 VanDerWaalsContact CG-NZ 3.33Å; D589-K593 PolarHBondContact O-N 3.29Å; D589-K593 VanDerWaalsContact O-N 3.1Å; D589-K593 VanDerWaalsContact OD1-CE 3.28Å; D589-K593 WeakPolarHBondContact OD1-CE 3.46Å; D589-K593 IonicContact OD1-NZ 2.83Å; D589-K593 PolarHBondContact OD1-NZ 2.82Å; D589-K593 IonicContact OD2-NZ 3.65Å; D589-K593 PolarHBondContact OD2-NZ 2.71Å
590	D	87.3	Confident	87.2	Confident	62 Å²	62	60.8 Å²	60.8	33%	0.332	33%	0.33	S	S	.	.	H	α-helix	trans	-65.7	-41.3	176.6	-175.4	35.5	0	0	0	110.9	V586 T587 H592 K593 N594	V586-D590 HydrophobicContact CG1-CB 3.75Å; V586-D590 VanDerWaalsContact CG1-OD2 3.29Å; V586-D590 WeakPolarHBondContact CG1-OD2 3.46Å; T587-D590 WeakPolarHBondContact OG1-CB 3.48Å; D590-H592 PolarHBondContact O-N 3.21Å; D590-K593 PolarHBondContact O-N 3.09Å; D590-N594 WeakPolarHBondContact O-CB 3.4Å; D590-N594 PolarHBondContact O-N 3Å; D590-N594 PolarHBondContact OD1-ND2 3.22Å
591	F	88.5	Confident	86.9	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-63.3	-40.5	174.3	-176.1	-102	0	0	0	112.5	I529 L537 L539 V583 V586 T587 F588 D589 K593 S595 I598 I599 V643	I529-F591 HydrophobicContact CD1-CE1 3.93Å; I529-F591 HydrophobicContact CD1-CZ 3.83Å; L537-F591 HydrophobicContact CD1-CD1 3.44Å; L537-F591 VanDerWaalsContact CD1-CD1 3.44Å; L537-F591 HydrophobicContact CD1-CE1 3.52Å; L539-F591 HydrophobicContact CD1-CZ 4.11Å; L539-F591 HydrophobicContact CD2-CE1 3.97Å; L539-F591 HydrophobicContact CD2-CZ 3.91Å; V583-F591 HydrophobicContact CB-CD2 4.35Å; V583-F591 HydrophobicContact CB-CE2 4.32Å; V583-F591 HydrophobicContact CG1-CD1 4.35Å; V583-F591 HydrophobicContact CG1-CD2 3.75Å; V583-F591 HydrophobicContact CG1-CE2 3.99Å; V583-F591 HydrophobicContact CG1-CG 3.94Å; V583-F591 HydrophobicContact CG1-CZ 4.37Å; V583-F591 HydrophobicContact CG2-CD2 3.69Å; V583-F591 HydrophobicContact CG2-CE2 3.31Å; V583-F591 HydrophobicContact CG2-CZ 4.01Å; V586-F591 HydrophobicContact CG1-CB 4.19Å; T587-F591 WeakPolarHBondContact O-CB 3.04Å; T587-F591 PolarHBondContact O-N 2.81Å; F588-F591 PolarHBondContact O-N 3.2Å; D589-F591 VanDerWaalsContact C-N 3.35Å; F591-K593 PolarHBondContact O-N 3.43Å; F591-S595 WeakPolarHBondContact O-CA 3.28Å; F591-S595 WeakPolarHBondContact O-CB 3.47Å; F591-S595 PolarHBondContact O-N 3.01Å; F591-I598 HydrophobicContact CB-CD1 4.45Å; F591-I598 HydrophobicContact CD2-CB 4.33Å; F591-I598 HydrophobicContact CD2-CD1 4.03Å; F591-I598 HydrophobicContact CD2-CG2 4.06Å; F591-I598 HydrophobicContact CE2-CB 4.49Å; F591-I598 HydrophobicContact CE2-CG2 4.23Å; F591-I599 HydrophobicContact CE2-CD1 4.22Å; F591-I599 HydrophobicContact CE2-CG1 4.06Å; F591-I599 HydrophobicContact CZ-CD1 3.95Å; F591-I599 HydrophobicContact CZ-CG1 4.26Å; F591-V643 HydrophobicContact CE1-CG1 4.07Å
592	H	84.4	Confident	86.8	Confident	103 Å²	103	55 Å²	55	48%	0.477	30%	0.299	S	S	.	.	H	α-helix	trans	-63.7	-43.1	179.5	-173.4	61.2	0	0	0	112	F588 D589 D590	F588-H592 HydrophobicContact CZ-CB 4.34Å; F588-H592 WeakPolarHBondContact O-CB 3.46Å; F588-H592 PolarHBondContact O-N 3.47Å; D589-H592 PolarHBondContact O-N 3.14Å; D590-H592 PolarHBondContact O-N 3.21Å
593	K	84.8	Confident	86.7	Confident	142 Å²	142	53.6 Å²	53.6	62%	0.617	29%	0.288	S	S	*	.	H	α-helix	trans	-72.5	-37.2	178.7	-70	169.6	-178.1	161.3	0	113.2	D589 D590 F591	D589-K593 VanDerWaalsContact CG-NZ 3.33Å; D589-K593 PolarHBondContact O-N 3.29Å; D589-K593 VanDerWaalsContact O-N 3.1Å; D589-K593 VanDerWaalsContact OD1-CE 3.28Å; D589-K593 WeakPolarHBondContact OD1-CE 3.46Å; D589-K593 IonicContact OD1-NZ 2.83Å; D589-K593 PolarHBondContact OD1-NZ 2.82Å; D589-K593 IonicContact OD2-NZ 3.65Å; D589-K593 PolarHBondContact OD2-NZ 2.71Å; D590-K593 PolarHBondContact O-N 3.09Å; F591-K593 PolarHBondContact O-N 3.43Å
594	N	87.3	Confident	86.4	Confident	55 Å²	55	54.1 Å²	54.1	29%	0.294	29%	0.29	S	S	.	.	H	α-helix	trans	-115.5	17.1	-170.4	-66.2	-52.4	0	0	0	114.2	D590 A596 R597 I598	D590-N594 WeakPolarHBondContact O-CB 3.4Å; D590-N594 PolarHBondContact O-N 3Å; D590-N594 PolarHBondContact OD1-ND2 3.22Å; N594-A596 PolarHBondContact O-N 3.28Å; N594-R597 PolarHBondContact O-N 2.83Å; N594-I598 HydrophobicContact CB-CD1 3.72Å; N594-I598 HydrophobicContact CB-CG1 4.13Å; N594-I598 WeakPolarHBondContact O-CG1 3.07Å; N594-I598 PolarHBondContact O-N 3.29Å
595	S	84.6	Confident	86	Confident	23 Å²	23	52.8 Å²	52.8	16%	0.161	28%	0.282	C	S	.	.	H	α-helix	trans	-48.3	-51.2	-172.9	49.5	0	0	0	0	113.8	F591 R597 I598 I599	F591-S595 WeakPolarHBondContact O-CA 3.28Å; F591-S595 WeakPolarHBondContact O-CB 3.47Å; F591-S595 PolarHBondContact O-N 3.01Å; S595-R597 VanDerWaalsContact C-N 3.34Å; S595-R597 PolarHBondContact O-N 2.74Å; S595-I598 PolarHBondContact O-N 2.65Å; S595-I599 WeakPolarHBondContact O-CB 3.37Å; S595-I599 VanDerWaalsContact O-CG1 3.3Å; S595-I599 WeakPolarHBondContact O-CG1 3.49Å; S595-I599 PolarHBondContact O-N 3.49Å
596	A	83	Confident	85.2	Confident	63 Å²	63	53.9 Å²	53.9	52%	0.521	28%	0.275	S	S	.	.	H	α-helix	trans	-58.2	-43.7	179.3	0	0	0	0	0	112.5	N594 R600	N594-A596 PolarHBondContact O-N 3.28Å; A596-R600 VanDerWaalsContact O-CB 3.23Å; A596-R600 WeakPolarHBondContact O-CB 3.46Å; A596-R600 PolarHBondContact O-N 3.48Å; A596-R600 VanDerWaalsContact O-N 3.08Å
597	R	84.1	Confident	83.9	Confident	140 Å²	140	56.5 Å²	56.5	53%	0.528	29%	0.286	S	S	.	.	H	α-helix	trans	-68.8	-47.7	178.6	-173	177.2	69.2	133.6	1	111	N594 S595 I599 R600 T601	N594-R597 PolarHBondContact O-N 2.83Å; S595-R597 VanDerWaalsContact C-N 3.34Å; S595-R597 PolarHBondContact O-N 2.74Å; R597-I599 PolarHBondContact O-N 3.01Å; R597-R600 PolarHBondContact O-N 2.79Å; R597-T601 WeakPolarHBondContact O-CB 3.32Å; R597-T601 PolarHBondContact O-N 2.84Å; R597-T601 PolarHBondContact O-OG1 2.84Å
598	I	86.7	Confident	82.1	Confident	20 Å²	20	59.7 Å²	59.7	10%	0.103	31%	0.305	C	S	.	.	H	α-helix	trans	-61.2	-45.5	-177.7	-67.3	161.4	0	0	0	110.7	V583 V586 F591 N594 S595 T601 A602	V583-I598 HydrophobicContact CG2-CG2 4.33Å; V586-I598 HydrophobicContact CG1-CD1 4.02Å; F591-I598 HydrophobicContact CB-CD1 4.45Å; F591-I598 HydrophobicContact CD2-CB 4.33Å; F591-I598 HydrophobicContact CD2-CD1 4.03Å; F591-I598 HydrophobicContact CD2-CG2 4.06Å; F591-I598 HydrophobicContact CE2-CB 4.49Å; F591-I598 HydrophobicContact CE2-CG2 4.23Å; N594-I598 HydrophobicContact CB-CD1 3.72Å; N594-I598 HydrophobicContact CB-CG1 4.13Å; N594-I598 WeakPolarHBondContact O-CG1 3.07Å; N594-I598 PolarHBondContact O-N 3.29Å; S595-I598 PolarHBondContact O-N 2.65Å; I598-T601 PolarHBondContact O-N 2.92Å; I598-A602 VanDerWaalsContact O-CB 3.25Å; I598-A602 WeakPolarHBondContact O-CB 3.49Å; I598-A602 PolarHBondContact O-N 2.79Å
599	I	86.8	Confident	80	Confident	1 Å²	1	61.2 Å²	61.2	1%	0.005	32%	0.32	C	S	.	.	H	α-helix	trans	-64.8	-46.7	178	-68.4	165.2	0	0	0	110.5	L539 L541 V579 F591 S595 R597 T601 A602 V603 V638 V640	L539-I599 HydrophobicContact CD1-CD1 4.01Å; L539-I599 HydrophobicContact CD2-CD1 4.49Å; L541-I599 HydrophobicContact CD1-CG2 4.37Å; L541-I599 HydrophobicContact CD2-CD1 4.1Å; L541-I599 HydrophobicContact CD2-CG2 4.37Å; V579-I599 HydrophobicContact CG1-CG1 4.19Å; V579-I599 HydrophobicContact CG2-CG2 4.14Å; F591-I599 HydrophobicContact CE2-CD1 4.22Å; F591-I599 HydrophobicContact CE2-CG1 4.06Å; F591-I599 HydrophobicContact CZ-CD1 3.95Å; F591-I599 HydrophobicContact CZ-CG1 4.26Å; S595-I599 WeakPolarHBondContact O-CB 3.37Å; S595-I599 VanDerWaalsContact O-CG1 3.3Å; S595-I599 WeakPolarHBondContact O-CG1 3.49Å; S595-I599 PolarHBondContact O-N 3.49Å; R597-I599 PolarHBondContact O-N 3.01Å; I599-T601 VanDerWaalsContact C-N 3.34Å; I599-T601 PolarHBondContact O-N 2.89Å; I599-A602 PolarHBondContact O-N 2.82Å; I599-V603 HydrophobicContact CG2-CG2 4.39Å; I599-V603 WeakPolarHBondContact O-CG2 3.27Å; I599-V603 PolarHBondContact O-N 2.81Å; I599-V638 HydrophobicContact CG2-CG1 3.93Å; I599-V640 HydrophobicContact CB-CG2 4.3Å; I599-V640 HydrophobicContact CD1-CG1 4.12Å; I599-V640 HydrophobicContact CD1-CG2 3.56Å; I599-V640 HydrophobicContact CG2-CG2 4.29Å
600	R	84.8	Confident	78.1	Confident	114 Å²	114	66.4 Å²	66.4	43%	0.43	34%	0.342	S	S	.	.	H	α-helix	trans	-58.7	-46.4	178	-172.8	173.3	178.8	168.5	-3.5	111.5	A596 R597 V603 F604 D624	A596-R600 VanDerWaalsContact O-CB 3.23Å; A596-R600 WeakPolarHBondContact O-CB 3.46Å; A596-R600 PolarHBondContact O-N 3.48Å; A596-R600 VanDerWaalsContact O-N 3.08Å; R597-R600 PolarHBondContact O-N 2.79Å; R600-V603 PolarHBondContact O-N 2.91Å; R600-F604 HydrophobicContact CG-CD2 3.54Å; R600-F604 HydrophobicContact CG-CE2 3.77Å; R600-F604 VanDerWaalsContact O-CD2 3.27Å; R600-F604 WeakPolarHBondContact O-CD2 3.1Å; R600-F604 PolarHBondContact O-N 3.06Å; R600-D624 IonicContact CZ-OD1 3.93Å; R600-D624 IonicContact NH2-OD1 3.31Å; R600-D624 PolarHBondContact NH2-OD1 3.01Å
601	T	84.5	Confident	75.9	Confident	26 Å²	26	67.1 Å²	67.1	16%	0.16	36%	0.356	C	S	.	.	H	α-helix	trans	-64	-41.8	176.9	-58.8	0	0	0	0	112.1	R597 I598 I599 V603 G605 F606 P622	R597-T601 WeakPolarHBondContact O-CB 3.32Å; R597-T601 PolarHBondContact O-N 2.84Å; R597-T601 PolarHBondContact O-OG1 2.84Å; I598-T601 PolarHBondContact O-N 2.92Å; I599-T601 VanDerWaalsContact C-N 3.34Å; I599-T601 PolarHBondContact O-N 2.89Å; T601-V603 VanDerWaalsContact C-N 3.33Å; T601-V603 PolarHBondContact O-N 3.05Å; T601-G605 VanDerWaalsContact O-CA 3.32Å; T601-G605 WeakPolarHBondContact O-CA 3.32Å; T601-G605 PolarHBondContact O-N 3.26Å; T601-F606 HydrophobicContact CG2-CD1 4Å; T601-F606 HydrophobicContact CG2-CE1 3.32Å; T601-F606 HydrophobicContact CG2-CE2 4.04Å; T601-F606 HydrophobicContact CG2-CZ 3.34Å; T601-P622 WeakPolarHBondContact OG1-CG 3.3Å
602	A	86.4	Confident	73.5	Confident	20 Å²	20	76.9 Å²	76.9	17%	0.165	40%	0.398	C	S	.	.	H	α-helix	trans	-63.8	-38.1	178.3	0	0	0	0	0	112.3	R578 A582 I598 I599	R578-A602 WeakPolarHBondContact CB-O 3.38Å; A582-A602 HydrophobicContact CB-CB 3.48Å; A582-A602 VanDerWaalsContact CB-CB 3.48Å; I598-A602 VanDerWaalsContact O-CB 3.25Å; I598-A602 WeakPolarHBondContact O-CB 3.49Å; I598-A602 PolarHBondContact O-N 2.79Å; I599-A602 PolarHBondContact O-N 2.82Å
603	V	85.6	Confident	71.7	Confident	0 Å²	0	74 Å²	74	0%	0	40%	0.396	C	S	.	.	H	α-helix	trans	-77.2	-47.8	-177.4	174.7	0	0	0	0	112.2	I575 R578 V579 I599 R600 T601 V638	I575-V603 HydrophobicContact CD1-CG1 4.49Å; I575-V603 HydrophobicContact CG1-CG1 4.14Å; I575-V603 HydrophobicContact CG2-CG1 4.48Å; I575-V603 HydrophobicContact CG2-CG2 3.61Å; R578-V603 PolarHBondContact NH1-O 2.96Å; V579-V603 HydrophobicContact CG2-CG2 3.76Å; I599-V603 HydrophobicContact CG2-CG2 4.39Å; I599-V603 WeakPolarHBondContact O-CG2 3.27Å; I599-V603 PolarHBondContact O-N 2.81Å; R600-V603 PolarHBondContact O-N 2.91Å; T601-V603 VanDerWaalsContact C-N 3.33Å; T601-V603 PolarHBondContact O-N 3.05Å; V603-V638 HydrophobicContact CB-CG2 4.2Å; V603-V638 HydrophobicContact CG1-CG2 3.82Å; V603-V638 HydrophobicContact CG2-CG2 4.25Å
604	F	85.1	Confident	69.8	Low	12 Å²	12	73.6 Å²	73.6	5%	0.053	41%	0.408	C	S	.	.	H	α-helix	trans	-91.5	-19	-172.7	-59.7	-54.2	0	0	0	114.3	R600 R623 A626 V635 V638	R600-F604 HydrophobicContact CG-CD2 3.54Å; R600-F604 HydrophobicContact CG-CE2 3.77Å; R600-F604 VanDerWaalsContact O-CD2 3.27Å; R600-F604 WeakPolarHBondContact O-CD2 3.1Å; R600-F604 PolarHBondContact O-N 3.06Å; F604-R623 HydrophobicContact CB-CB 4.07Å; F604-R623 WeakPolarHBondContact CB-O 3.39Å; F604-R623 WeakPolarHBondContact CD2-O 3.27Å; F604-R623 WeakPolarHBondContact CG-O 3.31Å; F604-A626 HydrophobicContact CD1-CB 3.63Å; F604-A626 VanDerWaalsContact CD1-N 3.3Å; F604-A626 HydrophobicContact CE1-CB 3.91Å; F604-V635 HydrophobicContact CE1-CG1 4.21Å; F604-V635 WeakPolarHBondContact CE1-O 3.28Å; F604-V635 HydrophobicContact CZ-CG1 4.42Å; F604-V638 HydrophobicContact CE2-CG2 4.19Å; F604-V638 HydrophobicContact CZ-CG2 3.8Å
605	G	80.3	Confident	67.9	Low	27 Å²	27	77.9 Å²	77.9	28%	0.278	43%	0.431	S	S	.	.			trans	72.2	-177	-172.3	0	0	0	0	0	112.6	T601 P622 R623	T601-G605 VanDerWaalsContact O-CA 3.32Å; T601-G605 WeakPolarHBondContact O-CA 3.32Å; T601-G605 PolarHBondContact O-N 3.26Å; G605-P622 WeakPolarHBondContact O-CA 3.44Å; G605-R623 PolarHBondContact O-N 2.88Å
606	F	72.8	Confident	66	Low	118 Å²	118	80.9 Å²	80.9	52%	0.518	47%	0.465	S	S	.	.	B	Isolated β-bridge	trans	-90.9	149.1	179.9	-61.4	-76.4	0	0	0	111.8	T601 S620 R623	T601-F606 HydrophobicContact CG2-CD1 4Å; T601-F606 HydrophobicContact CG2-CE1 3.32Å; T601-F606 HydrophobicContact CG2-CE2 4.04Å; T601-F606 HydrophobicContact CG2-CZ 3.34Å; F606-S620 VanDerWaalsContact CD1-CB 3.44Å; F606-R623 PolarHBondContact O-NE 2.87Å
607	E	61.8	Low	64.1	Low	79 Å²	79	85.5 Å²	85.5	37%	0.369	48%	0.478	S	S	.	.			trans	-64.5	136.2	162.6	-75.1	-171.6	153.1	0	0	110	S609 R621 R623	E607-S609 PolarHBondContact O-N 2.97Å; E607-S609 VanDerWaalsContact O-N 3.15Å; E607-R621 PolarHBondContact N-O 2.91Å; E607-R623 HydrophobicContact CG-CG 3.95Å
608	T	52.4	Low	62	Low	127 Å²	127	83.5 Å²	83.5	78%	0.779	49%	0.492	S	S	*	.			trans	-76.6	13.8	176.6	17.4	0	0	0	0	112.9	R623	T608-R623 PolarHBondContact OG1-NH2 3.18Å
609	S	44.8	Very low	60.2	Low	68 Å²	68	89.1 Å²	89.1	48%	0.476	52%	0.521	S	S	.	.			trans	-91.2	117.8	-179.8	72.2	0	0	0	0	110.9	E607 A611	E607-S609 PolarHBondContact O-N 2.97Å; E607-S609 VanDerWaalsContact O-N 3.15Å; S609-A611 PolarHBondContact O-N 2.77Å
610	E	44.1	Very low	58.6	Low	195 Å²	195	92.3 Å²	92.3	91%	0.911	54%	0.543	S	S	*	.			trans	-67.6	74.6	164.4	-68.4	-175.2	157.2	0	0	109.7	K612	E610-K612 PolarHBondContact O-N 2.98Å
611	A	40.3	Very low	57.3	Low	76 Å²	76	96 Å²	96	63%	0.628	56%	0.557	S	S	*	*			trans	-86.9	96.3	171.1	0	0	0	0	0	109.6	S609 G613	S609-A611 PolarHBondContact O-N 2.77Å; A611-G613 PolarHBondContact O-N 2.96Å
612	K	39.2	Very low	56.3	Low	206 Å²	206	96.4 Å²	96.4	90%	0.896	56%	0.561	S	S	*	*			trans	-61.6	115.9	168.5	-74.3	178.4	178	175	0	109.8	E610	E610-K612 PolarHBondContact O-N 2.98Å
613	G	46.3	Very low	55.8	Low	42 Å²	42	100.9 Å²	100.9	43%	0.433	57%	0.573	S	S	.	*			trans	-75.5	161.5	162.5	0	0	0	0	0	111.5	A611 D615	A611-G613 PolarHBondContact O-N 2.96Å; G613-D615 PolarHBondContact O-N 2.88Å
614	P	44.8	Very low	55.5	Low	134 Å²	134	105.6 Å²	105.6	87%	0.87	60%	0.599	S	S	*	*	S	Bend	trans	-65.2	-17.9	-178.1	24.4	-31.9	0	0	0	114.2
615	D	47	Very low	55.6	Low	145 Å²	145	109.4 Å²	109.4	78%	0.775	62%	0.616	S	S	*	*	S	Bend	trans	-120.5	61	-177.4	-67	-35.7	0	0	0	112.5	G613 M617	G613-D615 PolarHBondContact O-N 2.88Å; D615-M617 PolarHBondContact O-N 2.73Å
616	G	45.3	Very low	55.9	Low	85 Å²	85	108.5 Å²	108.5	88%	0.876	61%	0.606	S	S	*	*	S	Bend	trans	54.2	-4.3	154	0	0	0	0	0	121.5
617	M	43.1	Very low	56.6	Low	161 Å²	161	106.5 Å²	106.5	79%	0.793	60%	0.604	S	S	*	*			trans	-107.6	117.4	178.5	-82.9	-168.3	165.2	0	0	109.5	D615 L619	D615-M617 PolarHBondContact O-N 2.73Å; M617-L619 PolarHBondContact O-N 3.48Å
618	A	40.1	Very low	58	Low	98 Å²	98	103.6 Å²	103.6	81%	0.81	59%	0.59	S	S	*	*			trans	-72.2	108.5	176.5	0	0	0	0	0	110.4
619	L	47.9	Very low	59.6	Low	138 Å²	138	102.9 Å²	102.9	72%	0.723	59%	0.588	S	S	*	*			trans	-106.4	92.3	167.9	-86.5	150.8	0	0	0	108.5	M617 R621	M617-L619 PolarHBondContact O-N 3.48Å; L619-R621 PolarHBondContact O-N 2.92Å
620	S	53.7	Low	61.6	Low	67 Å²	67	105.8 Å²	105.8	47%	0.469	59%	0.593	S	S	.	*	P	Polyproline II helix	trans	-62.8	121.3	172.5	-55.9	0	0	0	0	110	F606	F606-S620 VanDerWaalsContact CD1-CB 3.44Å
621	R	57.6	Low	63.7	Low	191 Å²	191	96.7 Å²	96.7	72%	0.721	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-75.7	140.4	177.6	-70.9	-175.4	179.2	-177.1	0.2	110.6	E607 L619	E607-R621 PolarHBondContact N-O 2.91Å; L619-R621 PolarHBondContact O-N 2.92Å
622	P	62.7	Low	66	Low	36 Å²	36	94 Å²	94	23%	0.234	53%	0.53	C	S	.	.	B	Isolated β-bridge	trans	-65.8	145.9	172.8	-15.3	29.7	0	0	0	110.6	T601 G605	T601-P622 WeakPolarHBondContact OG1-CG 3.3Å; G605-P622 WeakPolarHBondContact O-CA 3.44Å
623	R	76.8	Confident	68.5	Low	113 Å²	113	84.2 Å²	84.2	43%	0.426	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-65.1	156.4	167.8	-65.6	178.9	-177.9	-166.5	-7.1	110.2	F604 G605 F606 E607 T608	F604-R623 HydrophobicContact CB-CB 4.07Å; F604-R623 WeakPolarHBondContact CB-O 3.39Å; F604-R623 WeakPolarHBondContact CD2-O 3.27Å; F604-R623 WeakPolarHBondContact CG-O 3.31Å; G605-R623 PolarHBondContact O-N 2.88Å; F606-R623 PolarHBondContact O-NE 2.87Å; E607-R623 HydrophobicContact CG-CG 3.95Å; T608-R623 PolarHBondContact OG1-NH2 3.18Å
624	D	80.3	Confident	70.7	Confident	100 Å²	100	82.2 Å²	82.2	54%	0.535	47%	0.468	S	S	.	.	S	Bend	trans	-88.4	-18.8	-177.7	-73.1	-35.8	0	0	0	114.4	R600	R600-D624 IonicContact CZ-OD1 3.93Å; R600-D624 IonicContact NH2-OD1 3.31Å; R600-D624 PolarHBondContact NH2-OD1 3.01Å
625	Q	85.6	Confident	73	Confident	91 Å²	91	75.9 Å²	75.9	43%	0.425	43%	0.426	S	S	.	.			trans	-145.5	152.3	-178.4	64.4	-176.2	21.1	0	0	112.9	V634 V635	Q625-V634 HydrophobicContact CB-CG1 4.07Å; Q625-V634 HydrophobicContact CG-CG1 4.42Å; Q625-V635 WeakPolarHBondContact CA-O 3.33Å
626	A	86.9	Confident	75	Confident	8 Å²	8	71.3 Å²	71.3	7%	0.066	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	118.6	174.2	0	0	0	0	0	109.3	F604 V635	F604-A626 HydrophobicContact CD1-CB 3.63Å; F604-A626 VanDerWaalsContact CD1-N 3.3Å; F604-A626 HydrophobicContact CE1-CB 3.91Å; A626-V635 HydrophobicContact CB-CB 4.41Å; A626-V635 PolarHBondContact N-O 2.86Å; A626-V635 PolarHBondContact O-N 3.01Å
627	V	88.8	Confident	77.1	Confident	77 Å²	77	69 Å²	69	47%	0.467	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	131.4	178.6	-175.8	0	0	0	0	109.7	P629 V634	V627-P629 WeakPolarHBondContact O-CD 3.44Å; V627-V634 HydrophobicContact CG1-CG2 4.45Å; V627-V634 HydrophobicContact CG2-CG1 4.49Å; V627-V634 HydrophobicContact CG2-CG2 4.26Å
628	F	89.6	Confident	79.3	Confident	18 Å²	18	62.2 Å²	62.2	8%	0.079	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	100	169.3	-68.1	-95.4	0	0	0	108.5	A571 A574 Q630 N631 G632 L633 V635	A571-F628 HydrophobicContact CB-CE2 4.34Å; A571-F628 HydrophobicContact CB-CZ 4.18Å; A574-F628 HydrophobicContact CB-CE1 3.82Å; A574-F628 HydrophobicContact CB-CZ 4.21Å; F628-Q630 PolarHBondContact O-N 3.03Å; F628-Q630 VanDerWaalsContact O-N 3.12Å; F628-N631 PolarHBondContact O-N 2.82Å; F628-N631 PolarHBondContact O-OD1 2.88Å; F628-G632 PolarHBondContact O-N 3.36Å; F628-L633 HydrophobicContact CB-CB 4.12Å; F628-L633 HydrophobicContact CD2-CB 4.36Å; F628-L633 HydrophobicContact CD2-CD2 3.98Å; F628-L633 HydrophobicContact CD2-CG 4.28Å; F628-L633 HydrophobicContact CE2-CD2 4.36Å; F628-L633 HydrophobicContact CG-CD2 4.47Å; F628-L633 PolarHBondContact N-O 2.91Å; F628-V635 HydrophobicContact CD2-CG2 4.49Å; F628-V635 HydrophobicContact CE2-CG2 3.86Å
629	P	86.8	Confident	81.6	Confident	112 Å²	112	61.1 Å²	61.1	73%	0.727	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-14.2	-169.3	28.3	-36.3	0	0	0	113.8	V627	V627-P629 WeakPolarHBondContact O-CD 3.44Å
630	Q	86.8	Confident	83.5	Confident	128 Å²	128	56.7 Å²	56.7	60%	0.598	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-34.3	-176.9	-62.9	-179.5	8.7	0	0	112.7	V564 F628	V564-Q630 HydrophobicContact CG2-CB 4.04Å; F628-Q630 PolarHBondContact O-N 3.03Å; F628-Q630 VanDerWaalsContact O-N 3.12Å
631	N	88.4	Confident	85.1	Confident	4 Å²	4	58.1 Å²	58.1	2%	0.021	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.9	0.2	-177.2	63.8	-10.5	0	0	0	114.4	F547 K560 V564 F567 F628 L633	F547-N631 VanDerWaalsContact CD1-O 3.3Å; F547-N631 WeakPolarHBondContact CD1-O 3.5Å; F547-N631 HydrophobicContact CE1-CB 4.24Å; F547-N631 WeakPolarHBondContact CE1-O 3.47Å; K560-N631 VanDerWaalsContact O-CA 3.25Å; K560-N631 WeakPolarHBondContact O-CA 3.46Å; K560-N631 WeakPolarHBondContact O-CB 3.26Å; V564-N631 HydrophobicContact CB-CB 4.19Å; V564-N631 HydrophobicContact CG2-CB 3.87Å; F567-N631 WeakPolarHBondContact CB-ND2 3.4Å; F628-N631 PolarHBondContact O-N 2.82Å; F628-N631 PolarHBondContact O-OD1 2.88Å; N631-L633 VanDerWaalsContact C-N 3.29Å; N631-L633 PolarHBondContact O-N 2.92Å; N631-L633 WeakPolarHBondContact OD1-CB 3.42Å; N631-L633 PolarHBondContact OD1-N 3.03Å
632	G	87.8	Confident	86.5	Confident	19 Å²	19	50.6 Å²	50.6	20%	0.196	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.3	15.8	-179.5	0	0	0	0	0	114	F547 E548 F628 V634	F547-G632 WeakPolarHBondContact CA-O 3.08Å; E548-G632 PolarHBondContact N-O 2.99Å; F628-G632 PolarHBondContact O-N 3.36Å; G632-V634 PolarHBondContact O-N 3.44Å
633	L	92.4	Very high	87.7	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.005	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	128.4	175.3	178.6	75.2	0	0	0	110	W545 F547 F567 A571 F628 N631	W545-L633 HydrophobicContact CB-CD1 4.06Å; W545-L633 HydrophobicContact CD2-CD1 4.17Å; W545-L633 HydrophobicContact CE3-CD1 3.67Å; W545-L633 HydrophobicContact CG-CD1 4.36Å; F547-L633 HydrophobicContact CD1-CB 4.24Å; F547-L633 HydrophobicContact CD2-CD1 4.27Å; F547-L633 HydrophobicContact CE1-CB 3.87Å; F547-L633 HydrophobicContact CE1-CD1 4.25Å; F547-L633 HydrophobicContact CE2-CD1 3.93Å; F547-L633 HydrophobicContact CZ-CB 4.28Å; F547-L633 HydrophobicContact CZ-CD1 3.92Å; F567-L633 HydrophobicContact CD2-CD1 3.86Å; F567-L633 HydrophobicContact CD2-CD2 4Å; F567-L633 HydrophobicContact CE2-CD1 4.1Å; A571-L633 HydrophobicContact CB-CD2 3.66Å; F628-L633 HydrophobicContact CB-CB 4.12Å; F628-L633 HydrophobicContact CD2-CB 4.36Å; F628-L633 HydrophobicContact CD2-CD2 3.98Å; F628-L633 HydrophobicContact CD2-CG 4.28Å; F628-L633 HydrophobicContact CE2-CD2 4.36Å; F628-L633 HydrophobicContact CG-CD2 4.47Å; F628-L633 PolarHBondContact N-O 2.91Å; N631-L633 VanDerWaalsContact C-N 3.29Å; N631-L633 PolarHBondContact O-N 2.92Å; N631-L633 WeakPolarHBondContact OD1-CB 3.42Å; N631-L633 PolarHBondContact OD1-N 3.03Å
634	V	92.4	Very high	88.2	Confident	1 Å²	1	49.2 Å²	49.2	1%	0.006	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	121.5	175.7	-176.2	0	0	0	0	108.8	W545 H546 E548 Q625 V627 G632	W545-V634 CarbonylContact C-O 3.25Å; W545-V634 WeakPolarHBondContact CA-O 3.5Å; H546-V634 PolarHBondContact N-O 2.87Å; H546-V634 PolarHBondContact O-N 2.83Å; E548-V634 HydrophobicContact CB-CG2 3.75Å; Q625-V634 HydrophobicContact CB-CG1 4.07Å; Q625-V634 HydrophobicContact CG-CG1 4.42Å; V627-V634 HydrophobicContact CG1-CG2 4.45Å; V627-V634 HydrophobicContact CG2-CG1 4.49Å; V627-V634 HydrophobicContact CG2-CG2 4.26Å; G632-V634 PolarHBondContact O-N 3.44Å
635	V	92.3	Very high	88.6	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	113.7	168.7	178.2	0	0	0	0	107.3	N544 I575 F604 Q625 A626 F628 V638	N544-V635 CarbonylContact O-C 3.57Å; N544-V635 WeakPolarHBondContact O-CA 3.33Å; I575-V635 HydrophobicContact CD1-CG2 4.28Å; F604-V635 HydrophobicContact CE1-CG1 4.21Å; F604-V635 WeakPolarHBondContact CE1-O 3.28Å; F604-V635 HydrophobicContact CZ-CG1 4.42Å; Q625-V635 WeakPolarHBondContact CA-O 3.33Å; A626-V635 HydrophobicContact CB-CB 4.41Å; A626-V635 PolarHBondContact N-O 2.86Å; A626-V635 PolarHBondContact O-N 3.01Å; F628-V635 HydrophobicContact CD2-CG2 4.49Å; F628-V635 HydrophobicContact CE2-CG2 3.86Å; V635-V638 HydrophobicContact CG1-CG2 4.23Å
636	S	89.8	Confident	88.6	Confident	50 Å²	50	44.2 Å²	44.2	35%	0.35	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	-32	-173.5	56.1	0	0	0	0	113.2	N544	N544-S636 PolarHBondContact O-N 2.89Å; N544-S636 PolarHBondContact O-OG 2.77Å
637	S	88.9	Confident	88.6	Confident	36 Å²	36	47.7 Å²	47.7	25%	0.252	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	159.7	171.4	74.8	0	0	0	0	112.3	N544	N544-S637 PolarHBondContact N-O 3.3Å; N544-S637 PolarHBondContact ND2-OG 2.86Å
638	V	89.9	Confident	88.3	Confident	19 Å²	19	48.6 Å²	48.6	12%	0.115	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	115.5	174.8	-177	0	0	0	0	108.6	A542 Y543 I599 V603 F604 V635	A542-V638 CarbonylContact O-C 3.56Å; A542-V638 WeakPolarHBondContact O-CA 3.44Å; Y543-V638 HydrophobicContact CD1-CB 4.32Å; Y543-V638 HydrophobicContact CD1-CG1 3.77Å; Y543-V638 HydrophobicContact CD1-CG2 3.86Å; Y543-V638 HydrophobicContact CE1-CG1 3.84Å; Y543-V638 HydrophobicContact CE1-CG2 4.46Å; I599-V638 HydrophobicContact CG2-CG1 3.93Å; V603-V638 HydrophobicContact CB-CG2 4.2Å; V603-V638 HydrophobicContact CG1-CG2 3.82Å; V603-V638 HydrophobicContact CG2-CG2 4.25Å; F604-V638 HydrophobicContact CE2-CG2 4.19Å; F604-V638 HydrophobicContact CZ-CG2 3.8Å; V635-V638 HydrophobicContact CG1-CG2 4.23Å
639	D	88.8	Confident	88	Confident	75 Å²	75	57.2 Å²	57.2	40%	0.401	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	120.2	179.7	-56.9	-34	0	0	0	109.4	A542 N544 Q641	A542-D639 HydrophobicContact CB-CB 4.27Å; A542-D639 PolarHBondContact N-O 2.9Å; A542-D639 PolarHBondContact O-N 2.84Å; N544-D639 PolarHBondContact ND2-OD2 3.18Å; D639-Q641 PolarHBondContact O-N 3.49Å
640	V	88.1	Confident	87.7	Confident	45 Å²	45	54 Å²	54	27%	0.273	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	104.9	176.8	-172.5	0	0	0	0	108.1	L541 I599 V643	L541-V640 HydrophobicContact CD2-CB 4.18Å; L541-V640 HydrophobicContact CD2-CG1 4.05Å; L541-V640 HydrophobicContact CD2-CG2 3.89Å; I599-V640 HydrophobicContact CB-CG2 4.3Å; I599-V640 HydrophobicContact CD1-CG1 4.12Å; I599-V640 HydrophobicContact CD1-CG2 3.56Å; I599-V640 HydrophobicContact CG2-CG2 4.29Å; V640-V643 HydrophobicContact CG1-CG2 3.54Å
641	Q	86.9	Confident	87.5	Confident	97 Å²	97	51.7 Å²	51.7	45%	0.453	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	-41.4	-175.5	-63.1	-170.6	-26.8	0	0	112.5	Q540 A542 D639	Q540-Q641 HydrophobicContact CB-CB 4.14Å; Q540-Q641 PolarHBondContact O-N 3.39Å; A542-Q641 HydrophobicContact CB-CG 4.26Å; D639-Q641 PolarHBondContact O-N 3.49Å
642	S	87.6	Confident	87.3	Confident	32 Å²	32	54.3 Å²	54.3	22%	0.224	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	144.9	179.7	-178.1	0	0	0	0	111	L539 Q540	L539-S642 WeakPolarHBondContact CA-O 3.43Å; Q540-S642 PolarHBondContact N-O 2.83Å; Q540-S642 PolarHBondContact O-N 3.14Å
643	V	87.7	Confident	87	Confident	43 Å²	43	55.5 Å²	55.5	26%	0.261	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	107.8	175.1	-178.9	0	0	0	0	107.8	L537 L539 F591 V640	L537-V643 HydrophobicContact CD1-CG1 4.25Å; L539-V643 HydrophobicContact CD2-CB 3.94Å; L539-V643 HydrophobicContact CD2-CG1 3.61Å; L539-V643 HydrophobicContact CD2-CG2 3.54Å; F591-V643 HydrophobicContact CE1-CG1 4.07Å; V640-V643 HydrophobicContact CG1-CG2 3.54Å
644	E	86.9	Confident	86.4	Confident	77 Å²	77	57.6 Å²	57.6	36%	0.36	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	135.8	-176.7	-70.5	-169.5	-151.1	0	0	112.4	L537 Q538 V646 R651	L537-E644 CarbonylContact C-O 3.53Å; L537-E644 WeakPolarHBondContact CA-O 3.31Å; Q538-E644 PolarHBondContact N-O 3.16Å; Q538-E644 PolarHBondContact O-N 3.24Å; E644-V646 PolarHBondContact O-N 2.9Å; E644-R651 IonicContact OE2-CZ 2.85Å; E644-R651 IonicContact OE2-NH2 4Å; E644-R651 PolarHBondContact OE2-NH2 2.82Å
645	P	87.4	Confident	86	Confident	16 Å²	16	63.8 Å²	63.8	10%	0.104	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	132.9	166.3	-18.4	30.5	0	0	0	111.3	L537 T650 R651 L654	L537-P645 HydrophobicContact CD2-CB 4.26Å; L537-P645 HydrophobicContact CD2-CG 4.33Å; P645-T650 HydrophobicContact CB-CG2 4.25Å; P645-R651 HydrophobicContact CB-CB 4.44Å; P645-R651 HydrophobicContact CG-CB 4.49Å; P645-R651 PolarHBondContact O-NH2 2.8Å; P645-L654 HydrophobicContact CG-CD1 3.52Å
646	V	86.9	Confident	85.6	Confident	71 Å²	71	70.6 Å²	70.6	43%	0.43	36%	0.357	S	S	.	.	S	Bend	trans	-74.6	-38.2	176.6	179.5	0	0	0	0	110.7	T528 R536 Q538 E644	T528-V646 HydrophobicContact CG2-CG2 4.1Å; R536-V646 HydrophobicContact CB-CB 3.99Å; R536-V646 HydrophobicContact CB-CG2 4.2Å; R536-V646 PolarHBondContact O-N 3.01Å; Q538-V646 HydrophobicContact CB-CG2 4Å; E644-V646 PolarHBondContact O-N 2.9Å
647	D	85.5	Confident	85.3	Confident	80 Å²	80	71.6 Å²	71.6	43%	0.428	36%	0.364	S	S	.	.	S	Bend	trans	-81.6	124.9	178.4	-168.7	-3.4	0	0	0	110.7	R649 T650 R651	D647-R649 PolarHBondContact O-N 3.31Å; D647-R649 PolarHBondContact OD1-N 2.84Å; D647-R649 VanDerWaalsContact OD1-N 3.14Å; D647-T650 PolarHBondContact O-N 2.64Å; D647-R651 PolarHBondContact O-N 2.93Å
648	Q	83.6	Confident	85.1	Confident	96 Å²	96	74.1 Å²	74.1	45%	0.449	38%	0.377	S	S	.	.	H	α-helix	trans	-59.7	-36.1	178.3	-171.4	61.2	30.8	0	0	111.5	T650 R651 D652	Q648-T650 VanDerWaalsContact C-N 3.31Å; Q648-T650 PolarHBondContact O-N 3.42Å; Q648-R651 WeakPolarHBondContact O-CB 3.47Å; Q648-R651 PolarHBondContact O-N 3.32Å; Q648-D652 PolarHBondContact NE2-OD1 3.24Å; Q648-D652 PolarHBondContact O-N 2.98Å
649	R	83.5	Confident	84.8	Confident	199 Å²	199	79.4 Å²	79.4	75%	0.751	40%	0.401	S	S	*	.	H	α-helix	trans	-62.7	-39.1	179.3	-68.2	179.7	175.6	177	-0.1	112.4	D647 D652 A653	D647-R649 PolarHBondContact O-N 3.31Å; D647-R649 PolarHBondContact OD1-N 2.84Å; D647-R649 VanDerWaalsContact OD1-N 3.14Å; R649-D652 PolarHBondContact O-N 2.74Å; R649-A653 WeakPolarHBondContact O-CB 3.45Å; R649-A653 PolarHBondContact O-N 3Å
650	T	79.6	Confident	84.6	Confident	45 Å²	45	80.4 Å²	80.4	28%	0.276	41%	0.406	S	S	.	.	H	α-helix	trans	-69.2	-39.6	177.6	-51.6	0	0	0	0	110.9	P645 D647 Q648 A653 L654	P645-T650 HydrophobicContact CB-CG2 4.25Å; D647-T650 PolarHBondContact O-N 2.64Å; Q648-T650 VanDerWaalsContact C-N 3.31Å; Q648-T650 PolarHBondContact O-N 3.42Å; T650-A653 PolarHBondContact O-N 2.88Å; T650-L654 HydrophobicContact CG2-CD1 4.29Å; T650-L654 WeakPolarHBondContact O-CD1 3.49Å; T650-L654 PolarHBondContact O-N 3.37Å
651	R	82.2	Confident	84.4	Confident	80 Å²	80	80.6 Å²	80.6	30%	0.302	41%	0.412	S	S	.	.	H	α-helix	trans	-61	-46.4	173.7	-171	-175.7	-80.3	131.7	-8.3	111.6	E644 P645 D647 Q648 A653 L654 Q655	E644-R651 IonicContact OE2-CZ 2.85Å; E644-R651 IonicContact OE2-NH2 4Å; E644-R651 PolarHBondContact OE2-NH2 2.82Å; P645-R651 HydrophobicContact CB-CB 4.44Å; P645-R651 HydrophobicContact CG-CB 4.49Å; P645-R651 PolarHBondContact O-NH2 2.8Å; D647-R651 PolarHBondContact O-N 2.93Å; Q648-R651 WeakPolarHBondContact O-CB 3.47Å; Q648-R651 PolarHBondContact O-N 3.32Å; R651-A653 VanDerWaalsContact C-N 3.31Å; R651-A653 PolarHBondContact O-N 2.86Å; R651-L654 WeakPolarHBondContact O-CB 3.39Å; R651-L654 PolarHBondContact O-N 3.48Å; R651-Q655 PolarHBondContact O-N 3.25Å
652	D	84.3	Confident	84.3	Confident	58 Å²	58	80.6 Å²	80.6	31%	0.31	41%	0.414	S	S	.	.	H	α-helix	trans	-65.5	-35.2	178	-59.4	-20.8	0	0	0	111.8	Q648 R649 Q655 R656	Q648-D652 PolarHBondContact NE2-OD1 3.24Å; Q648-D652 PolarHBondContact O-N 2.98Å; R649-D652 PolarHBondContact O-N 2.74Å; D652-Q655 PolarHBondContact O-N 3.43Å; D652-R656 WeakPolarHBondContact O-CG 3.41Å; D652-R656 PolarHBondContact O-N 3.04Å
653	A	81.6	Confident	84.1	Confident	44 Å²	44	83.9 Å²	83.9	36%	0.364	43%	0.426	S	S	.	.	H	α-helix	trans	-67.4	-41.6	175.4	0	0	0	0	0	112.5	R649 T650 R651 Q655 R656 S657	R649-A653 WeakPolarHBondContact O-CB 3.45Å; R649-A653 PolarHBondContact O-N 3Å; T650-A653 PolarHBondContact O-N 2.88Å; R651-A653 VanDerWaalsContact C-N 3.31Å; R651-A653 PolarHBondContact O-N 2.86Å; A653-Q655 VanDerWaalsContact C-N 3.33Å; A653-R656 PolarHBondContact O-N 3.25Å; A653-S657 PolarHBondContact O-N 2.9Å
654	L	81.3	Confident	84	Confident	46 Å²	46	87.3 Å²	87.3	24%	0.241	44%	0.442	C	S	.	.	H	α-helix	trans	-60.5	-42.9	171.9	-83.6	154.4	0	0	0	111.6	F588 P645 T650 R651 R656 S657 V658	F588-L654 HydrophobicContact CE1-CD1 4.15Å; F588-L654 HydrophobicContact CE1-CD2 3.87Å; F588-L654 HydrophobicContact CE1-CG 4.32Å; F588-L654 HydrophobicContact CZ-CD1 3.68Å; F588-L654 HydrophobicContact CZ-CD2 3.96Å; F588-L654 HydrophobicContact CZ-CG 4.3Å; P645-L654 HydrophobicContact CG-CD1 3.52Å; T650-L654 HydrophobicContact CG2-CD1 4.29Å; T650-L654 WeakPolarHBondContact O-CD1 3.49Å; T650-L654 PolarHBondContact O-N 3.37Å; R651-L654 WeakPolarHBondContact O-CB 3.39Å; R651-L654 PolarHBondContact O-N 3.48Å; L654-R656 PolarHBondContact O-N 2.89Å; L654-S657 WeakPolarHBondContact O-CA 3.23Å; L654-S657 WeakPolarHBondContact O-CB 3.43Å; L654-S657 PolarHBondContact O-N 2.86Å; L654-S657 VanDerWaalsContact O-N 3.1Å; L654-V658 WeakPolarHBondContact O-CG2 3.37Å; L654-V658 PolarHBondContact O-N 2.66Å
655	Q	83	Confident	84	Confident	130 Å²	130	87.6 Å²	87.6	61%	0.607	45%	0.449	S	S	*	.	H	α-helix	trans	-63.4	-41.2	178.4	-170.1	167.2	-2.6	0	0	112.1	R651 D652 A653 S657 V658 Q659	R651-Q655 PolarHBondContact O-N 3.25Å; D652-Q655 PolarHBondContact O-N 3.43Å; A653-Q655 VanDerWaalsContact C-N 3.33Å; Q655-S657 VanDerWaalsContact C-N 3.33Å; Q655-S657 PolarHBondContact O-N 2.71Å; Q655-V658 PolarHBondContact O-N 3.19Å; Q655-Q659 PolarHBondContact O-N 3.07Å
656	R	84.9	Confident	83.9	Confident	143 Å²	143	89.6 Å²	89.6	54%	0.54	46%	0.461	S	S	.	.	H	α-helix	trans	-61.3	-40.6	170.8	-73.1	-172.5	-66.5	-90.8	0	112.1	D652 A653 L654 Q659 L660	D652-R656 WeakPolarHBondContact O-CG 3.41Å; D652-R656 PolarHBondContact O-N 3.04Å; A653-R656 PolarHBondContact O-N 3.25Å; L654-R656 PolarHBondContact O-N 2.89Å; R656-Q659 PolarHBondContact O-N 3.45Å; R656-L660 WeakPolarHBondContact O-CB 3.41Å; R656-L660 WeakPolarHBondContact O-CG 3.45Å; R656-L660 PolarHBondContact O-N 2.78Å
657	S	83.2	Confident	83.7	Confident	72 Å²	72	90.1 Å²	90.1	50%	0.503	46%	0.461	S	S	.	.	H	α-helix	trans	-63.6	-39.7	176.9	-170.5	0	0	0	0	112.6	A653 L654 Q655 A661	A653-S657 PolarHBondContact O-N 2.9Å; L654-S657 WeakPolarHBondContact O-CA 3.23Å; L654-S657 WeakPolarHBondContact O-CB 3.43Å; L654-S657 PolarHBondContact O-N 2.86Å; L654-S657 VanDerWaalsContact O-N 3.1Å; Q655-S657 VanDerWaalsContact C-N 3.33Å; Q655-S657 PolarHBondContact O-N 2.71Å; S657-A661 WeakPolarHBondContact O-CB 3.3Å; S657-A661 PolarHBondContact O-N 2.8Å
658	V	83.2	Confident	83.6	Confident	88 Å²	88	90 Å²	90	53%	0.533	47%	0.466	S	S	.	.	H	α-helix	trans	-66.8	-42.2	175.5	173.7	0	0	0	0	110.5	L654 Q655 A661 I662	L654-V658 WeakPolarHBondContact O-CG2 3.37Å; L654-V658 PolarHBondContact O-N 2.66Å; Q655-V658 PolarHBondContact O-N 3.19Å; V658-A661 PolarHBondContact O-N 2.9Å; V658-I662 HydrophobicContact CG1-CD1 4.05Å; V658-I662 WeakPolarHBondContact O-CG1 3.21Å; V658-I662 PolarHBondContact O-N 2.67Å
659	Q	83.8	Confident	83.4	Confident	131 Å²	131	92.4 Å²	92.4	61%	0.612	48%	0.477	S	S	*	.	H	α-helix	trans	-62.1	-44	177.1	-170.6	166.6	5.6	0	0	112	Q655 R656 I662 E663	Q655-Q659 PolarHBondContact O-N 3.07Å; R656-Q659 PolarHBondContact O-N 3.45Å; Q659-I662 PolarHBondContact O-N 2.54Å; Q659-E663 WeakPolarHBondContact O-CB 3.02Å; Q659-E663 PolarHBondContact O-N 3.35Å
660	L	86.1	Confident	83.3	Confident	95 Å²	95	89.1 Å²	89.1	50%	0.497	47%	0.471	S	S	.	.	H	α-helix	trans	-63.9	-38.2	173.1	-73.4	167.4	0	0	0	112.2	R656 E663 I664	R656-L660 WeakPolarHBondContact O-CB 3.41Å; R656-L660 WeakPolarHBondContact O-CG 3.45Å; R656-L660 PolarHBondContact O-N 2.78Å; L660-E663 PolarHBondContact O-N 3.33Å; L660-I664 WeakPolarHBondContact O-CB 3.44Å; L660-I664 WeakPolarHBondContact O-CD1 3.39Å; L660-I664 WeakPolarHBondContact O-CG1 3.3Å; L660-I664 PolarHBondContact O-N 2.53Å
661	A	83.8	Confident	83.1	Confident	49 Å²	49	91 Å²	91	41%	0.405	49%	0.491	S	S	.	.	H	α-helix	trans	-63.9	-42	176	0	0	0	0	0	111.6	S657 V658 I664 T665	S657-A661 WeakPolarHBondContact O-CB 3.3Å; S657-A661 PolarHBondContact O-N 2.8Å; V658-A661 PolarHBondContact O-N 2.9Å; A661-I664 PolarHBondContact O-N 2.86Å; A661-T665 WeakPolarHBondContact O-CG2 3.36Å; A661-T665 PolarHBondContact O-N 2.78Å; A661-T665 PolarHBondContact O-OG1 3.3Å
662	I	83.6	Confident	82.8	Confident	98 Å²	98	91.6 Å²	91.6	50%	0.503	51%	0.513	S	S	.	.	H	α-helix	trans	-60.8	-49.5	173.1	-66.2	165.4	0	0	0	109.6	V658 Q659 I664 T665 T666	V658-I662 HydrophobicContact CG1-CD1 4.05Å; V658-I662 WeakPolarHBondContact O-CG1 3.21Å; V658-I662 PolarHBondContact O-N 2.67Å; Q659-I662 PolarHBondContact O-N 2.54Å; I662-I664 VanDerWaalsContact C-N 3.33Å; I662-I664 PolarHBondContact O-N 2.77Å; I662-T665 WeakPolarHBondContact CA-OG1 3.41Å; I662-T665 CarbonylContact O-C 3.6Å; I662-T665 PolarHBondContact O-N 3.13Å; I662-T665 PolarHBondContact O-OG1 3.21Å; I662-T666 PolarHBondContact O-N 3.12Å; I662-T666 PolarHBondContact O-OG1 3.18Å
663	E	84.9	Confident	81.9	Confident	101 Å²	101	95.3 Å²	95.3	47%	0.472	55%	0.552	S	S	.	*	H	α-helix	trans	-57.8	-41.9	178.1	-171.2	175.1	-177.9	0	0	112.5	Q659 L660 T666 N667	Q659-E663 WeakPolarHBondContact O-CB 3.02Å; Q659-E663 PolarHBondContact O-N 3.35Å; L660-E663 PolarHBondContact O-N 3.33Å; E663-T666 PolarHBondContact O-N 3.15Å; E663-N667 VanDerWaalsContact O-CB 3.29Å; E663-N667 WeakPolarHBondContact O-CB 3.18Å; E663-N667 PolarHBondContact O-N 3.07Å; E663-N667 PolarHBondContact O-ND2 2.9Å
664	I	85.1	Confident	81.9	Confident	115 Å²	115	97.9 Å²	97.9	59%	0.59	56%	0.561	S	S	*	*	H	α-helix	trans	-63.5	-43.6	173.9	-68.8	162.5	0	0	0	111.1	L660 A661 I662 T666 S668	L660-I664 WeakPolarHBondContact O-CB 3.44Å; L660-I664 WeakPolarHBondContact O-CD1 3.39Å; L660-I664 WeakPolarHBondContact O-CG1 3.3Å; L660-I664 PolarHBondContact O-N 2.53Å; A661-I664 PolarHBondContact O-N 2.86Å; I662-I664 VanDerWaalsContact C-N 3.33Å; I662-I664 PolarHBondContact O-N 2.77Å; I664-T666 VanDerWaalsContact C-N 3.35Å; I664-S668 WeakPolarHBondContact O-CB 3.37Å; I664-S668 PolarHBondContact O-N 3.44Å
665	T	85.8	Confident	82	Confident	82 Å²	82	100.6 Å²	100.6	50%	0.503	58%	0.578	S	S	.	*	H	α-helix	trans	-66.3	-37.5	177.2	56.4	0	0	0	0	112.3	A661 I662 S668 Q669	A661-T665 WeakPolarHBondContact O-CG2 3.36Å; A661-T665 PolarHBondContact O-N 2.78Å; A661-T665 PolarHBondContact O-OG1 3.3Å; I662-T665 WeakPolarHBondContact CA-OG1 3.41Å; I662-T665 CarbonylContact O-C 3.6Å; I662-T665 PolarHBondContact O-N 3.13Å; I662-T665 PolarHBondContact O-OG1 3.21Å; T665-S668 PolarHBondContact O-N 2.85Å; T665-Q669 WeakPolarHBondContact O-CG 3.35Å; T665-Q669 PolarHBondContact O-N 3.16Å
666	T	85.4	Confident	81.9	Confident	58 Å²	58	99 Å²	99	36%	0.356	58%	0.576	S	S	.	*	H	α-helix	trans	-66.5	-48.8	175.4	-56.8	0	0	0	0	110.8	I662 E663 I664 S668 Q669 E670	I662-T666 PolarHBondContact O-N 3.12Å; I662-T666 PolarHBondContact O-OG1 3.18Å; E663-T666 PolarHBondContact O-N 3.15Å; I664-T666 VanDerWaalsContact C-N 3.35Å; T666-S668 VanDerWaalsContact C-N 3.29Å; T666-S668 PolarHBondContact O-N 2.94Å; T666-Q669 WeakPolarHBondContact O-CB 3.44Å; T666-Q669 PolarHBondContact O-N 2.66Å; T666-Q669 VanDerWaalsContact O-N 3.14Å; T666-E670 PolarHBondContact O-N 2.93Å
667	N	84.4	Confident	81.7	Confident	83 Å²	83	96.4 Å²	96.4	44%	0.444	58%	0.579	S	S	.	*	H	α-helix	trans	-63	-34.6	176.5	-69.5	-15	0	0	0	112.3	E663 E670 A671	E663-N667 VanDerWaalsContact O-CB 3.29Å; E663-N667 WeakPolarHBondContact O-CB 3.18Å; E663-N667 PolarHBondContact O-N 3.07Å; E663-N667 PolarHBondContact O-ND2 2.9Å; N667-E670 PolarHBondContact O-N 2.98Å; N667-A671 VanDerWaalsContact O-CB 3.28Å; N667-A671 WeakPolarHBondContact O-CB 3.5Å; N667-A671 PolarHBondContact O-N 2.91Å
668	S	83.3	Confident	81.6	Confident	76 Å²	76	97.9 Å²	97.9	53%	0.531	58%	0.583	S	S	.	*	H	α-helix	trans	-67.6	-40.3	173.7	-178.4	0	0	0	0	111.9	I664 T665 T666 A671 A672	I664-S668 WeakPolarHBondContact O-CB 3.37Å; I664-S668 PolarHBondContact O-N 3.44Å; T665-S668 PolarHBondContact O-N 2.85Å; T666-S668 VanDerWaalsContact C-N 3.29Å; T666-S668 PolarHBondContact O-N 2.94Å; S668-A671 PolarHBondContact O-N 3.16Å; S668-A672 WeakPolarHBondContact O-CB 3.42Å; S668-A672 PolarHBondContact O-N 2.99Å
669	Q	79.6	Confident	81.5	Confident	147 Å²	147	98.6 Å²	98.6	69%	0.687	59%	0.587	S	S	*	*	H	α-helix	trans	-65.9	-40.5	172.3	-78.6	-175	-11.9	0	0	112.1	T665 T666 A672 A673	T665-Q669 WeakPolarHBondContact O-CG 3.35Å; T665-Q669 PolarHBondContact O-N 3.16Å; T666-Q669 WeakPolarHBondContact O-CB 3.44Å; T666-Q669 PolarHBondContact O-N 2.66Å; T666-Q669 VanDerWaalsContact O-N 3.14Å; Q669-A672 PolarHBondContact O-N 3.45Å; Q669-A673 PolarHBondContact O-N 2.9Å
670	E	79.9	Confident	81.4	Confident	131 Å²	131	96.3 Å²	96.3	61%	0.612	59%	0.585	S	S	*	*	H	α-helix	trans	-65.2	-37.4	174.7	-75.7	-174.8	174.2	0	0	112.5	T666 N667 A672 A673	T666-E670 PolarHBondContact O-N 2.93Å; N667-E670 PolarHBondContact O-N 2.98Å; E670-A672 VanDerWaalsContact C-N 3.34Å; E670-A673 PolarHBondContact O-N 2.8Å
671	A	76.6	Confident	81	Confident	85 Å²	85	96.4 Å²	96.4	70%	0.702	59%	0.591	S	S	*	*	H	α-helix	trans	-75.9	-20.9	177.3	0	0	0	0	0	113.8	N667 S668	N667-A671 VanDerWaalsContact O-CB 3.28Å; N667-A671 WeakPolarHBondContact O-CB 3.5Å; N667-A671 PolarHBondContact O-N 2.91Å; S668-A671 PolarHBondContact O-N 3.16Å
672	A	74.9	Confident	80.8	Confident	91 Å²	91	100.3 Å²	100.3	75%	0.752	61%	0.607	S	S	*	*	H	α-helix	trans	-89.1	-11.5	175.4	0	0	0	0	0	113.3	S668 Q669 E670	S668-A672 WeakPolarHBondContact O-CB 3.42Å; S668-A672 PolarHBondContact O-N 2.99Å; Q669-A672 PolarHBondContact O-N 3.45Å; E670-A672 VanDerWaalsContact C-N 3.34Å
673	A	65.9	Low	80.5	Confident	137 Å²	137	100.5 Å²	100.5	100%	1.132	62%	0.617	S	S	*	*			trans	-92.5	0	173.2	0	0	0	0	0	110.8	Q669 E670	Q669-A673 PolarHBondContact O-N 2.9Å; E670-A673 PolarHBondContact O-N 2.8Å

Retrieved 673 of 673 residues in 179.6 ms (Link to these results)

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