A0A077YW65_TRITR Loading...

FACT complex subunit SSRP1

Component of the FACT complex, a general chromatin factor that acts to reorganize nucleosomes. The FACT complex is involved in multiple processes that require DNA as a template such as mRNA elongation, DNA replication and DNA repair. During transcription elongation the FACT complex acts as a histone chaperone that both destabilizes and restores nucleosomal structure. It facilitates the passage of RNA polymerase II and transcription by promoting the dissociation of one histone H2A-H2B dimer from the nucleosome, then subsequently promotes the reestablishment of the nucleosome following the passage of RNA polymerase II.

AlphaFold DB , UniProt , Accession A0A077YW65, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 667 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	43.1	Very low	79.1	Confident	242 Å²	242	80.5 Å²	80.5	100%	1.192	44%	0.444	S	S	*	.				0	138.2	0	-65.4	164.1	-179.4	0	0	106.5
2	S	55.6	Low	80.2	Confident	93 Å²	93	80.1 Å²	80.1	65%	0.65	43%	0.43	S	S	*	.			trans	-79.9	135.1	174.5	35.1	0	0	0	0	110.1	V4	S2-V4 PolarHBondContact O-N 2.94Å
3	N	73.4	Confident	81	Confident	105 Å²	105	75.3 Å²	75.3	56%	0.561	40%	0.404	S	S	*	.			trans	-70.1	96.5	170.7	-73.8	-4	0	0	0	108.9	T27 E28	N3-T27 WeakPolarHBondContact O-CA 3.49Å; N3-T27 WeakPolarHBondContact O-CB 3.38Å; N3-E28 WeakPolarHBondContact CB-OE1 3.33Å; N3-E28 PolarHBondContact ND2-OE1 3.34Å
4	V	73.9	Confident	81.5	Confident	57 Å²	57	72.1 Å²	72.1	35%	0.345	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	118	168.5	-179.1	0	0	0	0	107.1	S2 L6 E7 K25 T27	S2-V4 PolarHBondContact O-N 2.94Å; V4-L6 WeakPolarHBondContact CG1-O 3.44Å; V4-E7 HydrophobicContact CG1-CB 4.13Å; V4-K25 HydrophobicContact CG1-CB 4.06Å; V4-K25 HydrophobicContact CG1-CD 4.45Å; V4-K25 HydrophobicContact CG1-CG 4.21Å; V4-K25 HydrophobicContact CG2-CB 4.48Å; V4-K25 HydrophobicContact CG2-CD 4.05Å; V4-T27 HydrophobicContact CG2-CG2 4.42Å
5	V	81.5	Confident	81.7	Confident	64 Å²	64	72.3 Å²	72.3	39%	0.388	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	-35.5	-175.5	-174.7	0	0	0	0	110.8	L26 E28 F89	V5-L26 PolarHBondContact N-O 3.28Å; V5-E28 HydrophobicContact CG2-CG 4.07Å; V5-F89 HydrophobicContact CB-CD2 4.04Å; V5-F89 HydrophobicContact CB-CE2 3.69Å; V5-F89 HydrophobicContact CG1-CD2 3.71Å; V5-F89 HydrophobicContact CG1-CE2 3.84Å; V5-F89 HydrophobicContact CG2-CE2 4.14Å
6	L	90.4	Very high	81.8	Confident	42 Å²	42	70 Å²	70	22%	0.22	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	144.4	170.8	-65.3	174.1	0	0	0	110	V4 F8 L26 L86 F89	V4-L6 WeakPolarHBondContact CG1-O 3.44Å; L6-F8 HydrophobicContact CB-CE2 3.84Å; L6-F8 HydrophobicContact CB-CZ 4.32Å; L6-F8 HydrophobicContact CD1-CE2 4.29Å; L6-F8 HydrophobicContact CD1-CZ 4.2Å; L6-L26 HydrophobicContact CB-CB 4.26Å; L6-L26 HydrophobicContact CB-CD1 4.38Å; L6-L26 HydrophobicContact CD1-CD1 4.28Å; L6-L26 PolarHBondContact N-O 2.57Å; L6-L26 PolarHBondContact O-N 3.09Å; L6-L86 HydrophobicContact CD1-CD2 4.41Å; L6-F89 HydrophobicContact CD1-CB 3.66Å; L6-F89 HydrophobicContact CD1-CD1 4.38Å; L6-F89 HydrophobicContact CD1-CD2 4.25Å; L6-F89 HydrophobicContact CD1-CG 3.82Å; L6-F89 HydrophobicContact CG-CD2 4.45Å
7	E	91.7	Very high	81.9	Confident	83 Å²	83	68.6 Å²	68.6	39%	0.388	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	136.1	172.4	178.4	161.3	-169.6	0	0	110.5	V4 M24 K25	V4-E7 HydrophobicContact CG1-CB 4.13Å; E7-M24 WeakPolarHBondContact CA-O 3.44Å; E7-K25 HydrophobicContact CB-CG 4.39Å; E7-K25 HydrophobicContact CG-CG 3.99Å; E7-K25 VanDerWaalsContact OE1-CE 3.32Å; E7-K25 WeakPolarHBondContact OE1-CE 3.15Å; E7-K25 IonicContact OE1-NZ 2.67Å; E7-K25 PolarHBondContact OE1-NZ 2.63Å; E7-K25 IonicContact OE2-NZ 2.59Å; E7-K25 PolarHBondContact OE2-NZ 2.68Å
8	F	93	Very high	82.1	Confident	24 Å²	24	67.2 Å²	67.2	11%	0.105	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	134.1	-177.9	-57.7	-91	0	0	0	109.3	L6 V11 R23 M24 L26 F78 D82 L86	L6-F8 HydrophobicContact CB-CE2 3.84Å; L6-F8 HydrophobicContact CB-CZ 4.32Å; L6-F8 HydrophobicContact CD1-CE2 4.29Å; L6-F8 HydrophobicContact CD1-CZ 4.2Å; F8-V11 HydrophobicContact CB-CG2 3.31Å; F8-V11 HydrophobicContact CG-CG2 4.27Å; F8-R23 CarbonylContact O-C 3.52Å; F8-R23 WeakPolarHBondContact O-CA 3.31Å; F8-R23 WeakPolarHBondContact O-CB 3.38Å; F8-M24 HydrophobicContact CD2-CE 3.78Å; F8-M24 HydrophobicContact CE2-CE 4.05Å; F8-M24 PolarHBondContact N-O 3.05Å; F8-M24 PolarHBondContact O-N 2.9Å; F8-L26 HydrophobicContact CE2-CD1 4.07Å; F8-F78 HydrophobicContact CB-CE1 4.48Å; F8-F78 HydrophobicContact CD1-CD1 4.06Å; F8-F78 HydrophobicContact CD1-CE1 4.18Å; F8-F78 HydrophobicContact CD2-CE1 4.17Å; F8-F78 HydrophobicContact CE1-CD1 4.19Å; F8-F78 HydrophobicContact CE1-CE1 4.43Å; F8-F78 HydrophobicContact CE2-CE1 4.41Å; F8-F78 HydrophobicContact CG-CD1 4.38Å; F8-F78 HydrophobicContact CG-CE1 4.05Å; F8-D82 HydrophobicContact CE1-CB 4.08Å; F8-L86 HydrophobicContact CE2-CD2 3.81Å; F8-L86 HydrophobicContact CZ-CD2 3.73Å; F8-L86 HydrophobicContact CZ-CG 4.12Å
9	T	88.2	Confident	82.5	Confident	112 Å²	112	67.4 Å²	67.4	69%	0.687	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.1	-14.6	-160.4	47.2	0	0	0	0	117.3	G22	T9-G22 CarbonylContact C-O 3.59Å
10	D	87.7	Confident	82.7	Confident	63 Å²	63	64.3 Å²	64.3	34%	0.337	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	37.6	169.3	-171.7	40	0	0	0	111.5	R12 R21	D10-R12 IonicContact OD1-NE 2.75Å; D10-R12 IonicContact OD1-NH2 2.72Å; D10-R12 IonicContact OD2-CZ 3.67Å; D10-R12 IonicContact OD2-NE 3.71Å; D10-R12 IonicContact OD2-NH2 2.88Å; D10-R12 PolarHBondContact OD2-NH2 3.15Å; D10-R21 IonicContact OD1-NH1 2.69Å
11	V	91.9	Very high	83.1	Confident	1 Å²	1	68.1 Å²	68.1	1%	0.006	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	143.7	171.5	179.1	0	0	0	0	109.1	F8 G22 M24 F33 F75 F78	F8-V11 HydrophobicContact CB-CG2 3.31Å; F8-V11 HydrophobicContact CG-CG2 4.27Å; V11-G22 PolarHBondContact N-O 2.88Å; V11-G22 CarbonylContact O-C 3.39Å; V11-G22 PolarHBondContact O-N 3.4Å; V11-M24 HydrophobicContact CB-CB 4.15Å; V11-M24 HydrophobicContact CG1-CB 4.13Å; V11-M24 HydrophobicContact CG2-CB 3.95Å; V11-F33 HydrophobicContact CB-CE2 4.37Å; V11-F33 HydrophobicContact CG1-CD2 4.31Å; V11-F33 HydrophobicContact CG1-CE2 4.16Å; V11-F75 HydrophobicContact CG1-CB 3.97Å; V11-F75 HydrophobicContact CG1-CD1 4.09Å; V11-F75 HydrophobicContact CG1-CG 4.42Å; V11-F78 HydrophobicContact CG1-CE2 4.31Å; V11-F78 HydrophobicContact CG1-CZ 3.9Å; V11-F78 HydrophobicContact CG2-CD1 4.48Å; V11-F78 HydrophobicContact CG2-CE1 3.81Å; V11-F78 HydrophobicContact CG2-CZ 3.97Å
12	R	91.6	Very high	85.3	Confident	75 Å²	75	56.6 Å²	56.6	28%	0.283	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	127.8	-179.3	-45.9	-173.2	-170.4	145.1	9.1	110.2	D10 L19 D20 R21 F75 G76	D10-R12 IonicContact OD1-NE 2.75Å; D10-R12 IonicContact OD1-NH2 2.72Å; D10-R12 IonicContact OD2-CZ 3.67Å; D10-R12 IonicContact OD2-NE 3.71Å; D10-R12 IonicContact OD2-NH2 2.88Å; D10-R12 PolarHBondContact OD2-NH2 3.15Å; R12-L19 HydrophobicContact CB-CB 4.04Å; R12-D20 CarbonylContact C-O 3.5Å; R12-D20 WeakPolarHBondContact CA-O 3.4Å; R12-R21 HydrophobicContact CG-CG 4.22Å; R12-F75 CarbonylContact O-C 3.5Å; R12-F75 WeakPolarHBondContact O-CA 3.32Å; R12-G76 PolarHBondContact N-O 2.74Å; R12-G76 PolarHBondContact O-N 3.2Å
13	M	90.5	Very high	87.1	Confident	18 Å²	18	57.1 Å²	57.1	9%	0.089	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	138.9	177.8	-175.7	164.8	173.1	0	0	110.3	L19 D20 F33 E42 Y73 F75	M13-L19 CarbonylContact O-C 3.5Å; M13-L19 WeakPolarHBondContact O-CA 3.37Å; M13-D20 PolarHBondContact N-O 2.82Å; M13-D20 PolarHBondContact O-N 2.95Å; M13-F33 HydrophobicContact CB-CD1 3.94Å; M13-F33 HydrophobicContact CB-CD2 4.49Å; M13-F33 HydrophobicContact CB-CE1 3.49Å; M13-F33 VanDerWaalsContact CB-CE1 3.49Å; M13-F33 HydrophobicContact CB-CE2 4.11Å; M13-F33 HydrophobicContact CB-CG 4.41Å; M13-F33 HydrophobicContact CB-CZ 3.59Å; M13-F33 HydrophobicContact CG-CE1 4.42Å; M13-F33 HydrophobicContact SD-CD1 3.77Å; M13-F33 HydrophobicContact SD-CE1 4.19Å; M13-F33 HydrophobicContact SD-CG 4.3Å; M13-E42 VanDerWaalsContact CE-OE2 3.28Å; M13-E42 WeakPolarHBondContact CE-OE2 3.46Å; M13-Y73 HydrophobicContact CE-CD1 3.91Å; M13-F75 HydrophobicContact CB-CD1 3.99Å; M13-F75 HydrophobicContact CB-CE1 3.97Å; M13-F75 HydrophobicContact CG-CD1 4.14Å; M13-F75 HydrophobicContact CG-CE1 3.79Å; M13-F75 HydrophobicContact SD-CD1 4.48Å; M13-F75 HydrophobicContact SD-CE1 3.58Å; M13-F75 VanDerWaalsContact SD-CE1 3.58Å; M13-F75 HydrophobicContact SD-CZ 4.04Å
14	E	88.4	Confident	88	Confident	30 Å²	30	52.1 Å²	52.1	14%	0.14	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	127.9	174.6	-165.7	-103.5	118.4	0	0	111.2	V16 G17 H18 L19 R74 N136	E14-V16 WeakPolarHBondContact OE1-CA 3.07Å; E14-V16 PolarHBondContact OE1-N 3.15Å; E14-G17 PolarHBondContact OE1-N 3.29Å; E14-H18 WeakPolarHBondContact CA-O 3.28Å; E14-L19 HydrophobicContact CB-CD2 4.15Å; E14-L19 HydrophobicContact CG-CD2 4.42Å; E14-R74 HydrophobicContact CB-CB 3.99Å; E14-R74 PolarHBondContact N-O 3.48Å; E14-R74 IonicContact OE2-NH1 2.81Å; E14-N136 PolarHBondContact OE1-ND2 3.16Å
15	N	84.4	Confident	88.9	Confident	75 Å²	75	51.2 Å²	51.2	40%	0.401	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	86.8	-177.5	179.3	11.5	0	0	0	109.5	G17 H18 D20 N154	N15-G17 VanDerWaalsContact C-N 3.32Å; N15-G17 PolarHBondContact O-N 3.49Å; N15-H18 PolarHBondContact N-O 3.45Å; N15-H18 PolarHBondContact O-N 3.14Å; N15-H18 VanDerWaalsContact O-N 3.09Å; N15-D20 VanDerWaalsContact CB-OD2 3.31Å; N15-D20 WeakPolarHBondContact CB-OD2 3.03Å; N15-D20 PolarHBondContact ND2-OD2 2.99Å; N15-N154 PolarHBondContact O-ND2 3.49Å
16	V	83.4	Confident	89.5	Confident	36 Å²	36	48.2 Å²	48.2	22%	0.218	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	51.9	-178.4	-167.9	0	0	0	0	110.6	E14 H18 H152 N154	E14-V16 WeakPolarHBondContact OE1-CA 3.07Å; E14-V16 PolarHBondContact OE1-N 3.15Å; V16-H18 VanDerWaalsContact C-N 3.27Å; V16-H18 PolarHBondContact O-N 2.88Å; V16-H152 HydrophobicContact CG1-CB 3.87Å; V16-H152 WeakPolarHBondContact CG1-O 3.17Å; V16-N154 HydrophobicContact CB-CB 4.18Å; V16-N154 HydrophobicContact CG1-CB 4.45Å; V16-N154 WeakPolarHBondContact O-CB 3.23Å
17	G	83.2	Confident	89.6	Confident	46 Å²	46	47 Å²	47	47%	0.474	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.1	-11.1	-179.3	0	0	0	0	0	116.2	E14 N15 C157	E14-G17 PolarHBondContact OE1-N 3.29Å; N15-G17 VanDerWaalsContact C-N 3.32Å; N15-G17 PolarHBondContact O-N 3.49Å; G17-C157 PolarHBondContact O-SG 2.81Å
18	H	86.3	Confident	89.5	Confident	44 Å²	44	47.1 Å²	47.1	20%	0.204	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	150.7	166.5	-165.9	85.7	0	0	0	110.2	E14 N15 V16 N154 E156 C157	E14-H18 WeakPolarHBondContact CA-O 3.28Å; N15-H18 PolarHBondContact N-O 3.45Å; N15-H18 PolarHBondContact O-N 3.14Å; N15-H18 VanDerWaalsContact O-N 3.09Å; V16-H18 VanDerWaalsContact C-N 3.27Å; V16-H18 PolarHBondContact O-N 2.88Å; H18-N154 VanDerWaalsContact CB-ND2 3.26Å; H18-N154 WeakPolarHBondContact CB-ND2 3.29Å; H18-E156 PolarHBondContact CE1-O 3.14Å; H18-E156 VanDerWaalsContact CE1-O 3.3Å; H18-E156 PolarHBondContact ND1-O 3.14Å; H18-C157 HydrophobicContact CB-CB 4.15Å
19	L	88.4	Confident	89.4	Confident	70 Å²	70	53.1 Å²	53.1	37%	0.366	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	82.9	175.2	-70.7	178.7	0	0	0	109.7	R12 M13 E14 R21 L57	R12-L19 HydrophobicContact CB-CB 4.04Å; M13-L19 CarbonylContact O-C 3.5Å; M13-L19 WeakPolarHBondContact O-CA 3.37Å; E14-L19 HydrophobicContact CB-CD2 4.15Å; E14-L19 HydrophobicContact CG-CD2 4.42Å; L19-R21 PolarHBondContact O-N 3.21Å; L19-L57 HydrophobicContact CD2-CD2 3.88Å
20	D	87.4	Confident	89.6	Confident	6 Å²	6	48.7 Å²	48.7	3%	0.032	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	118.7	-179.9	-98.6	-64.5	0	0	0	110.3	R12 M13 N15 F33 N35	R12-D20 CarbonylContact C-O 3.5Å; R12-D20 WeakPolarHBondContact CA-O 3.4Å; M13-D20 PolarHBondContact N-O 2.82Å; M13-D20 PolarHBondContact O-N 2.95Å; N15-D20 VanDerWaalsContact CB-OD2 3.31Å; N15-D20 WeakPolarHBondContact CB-OD2 3.03Å; N15-D20 PolarHBondContact ND2-OD2 2.99Å; D20-F33 WeakPolarHBondContact O-CZ 3.41Å; D20-N35 WeakPolarHBondContact CB-ND2 3.22Å; D20-N35 PolarHBondContact OD1-ND2 2.8Å
21	R	90.3	Very high	89.8	Confident	144 Å²	144	45.8 Å²	45.8	54%	0.543	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	140.5	179.2	-61.7	-164.1	-170.1	-156.1	10.8	111.6	D10 R12 L19 N36	D10-R21 IonicContact OD1-NH1 2.69Å; R12-R21 HydrophobicContact CG-CG 4.22Å; L19-R21 PolarHBondContact O-N 3.21Å; R21-N36 WeakPolarHBondContact O-CB 3.36Å; R21-N36 PolarHBondContact O-N 3.36Å
22	G	90.8	Very high	89.9	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.8	-166.8	-179.2	0	0	0	0	0	113	T9 V11 Y34 N36	T9-G22 CarbonylContact C-O 3.59Å; V11-G22 PolarHBondContact N-O 2.88Å; V11-G22 CarbonylContact O-C 3.39Å; V11-G22 PolarHBondContact O-N 3.4Å; G22-Y34 CarbonylContact C-O 3.44Å; G22-Y34 WeakPolarHBondContact CA-O 3.28Å; G22-N36 WeakPolarHBondContact CA-ND2 3.4Å
23	R	92.1	Very high	89.9	Confident	104 Å²	104	43 Å²	43	39%	0.392	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	145.1	168.2	58.7	175.9	-179.2	-154.3	-7.8	109.4	F8 F33 Y34	F8-R23 CarbonylContact O-C 3.52Å; F8-R23 WeakPolarHBondContact O-CA 3.31Å; F8-R23 WeakPolarHBondContact O-CB 3.38Å; R23-F33 WeakPolarHBondContact O-CA 3.24Å; R23-Y34 HydrophobicContact CG-CD2 3.95Å; R23-Y34 HydrophobicContact CG-CG 4.25Å; R23-Y34 PolarHBondContact N-O 3.06Å; R23-Y34 PolarHBondContact O-N 3.47Å
24	M	93.6	Very high	89.8	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	125.8	175.7	-169.5	-179.8	68.4	0	0	109.7	E7 F8 V11 L26 V32 F33 L63 F75 F78	E7-M24 WeakPolarHBondContact CA-O 3.44Å; F8-M24 HydrophobicContact CD2-CE 3.78Å; F8-M24 HydrophobicContact CE2-CE 4.05Å; F8-M24 PolarHBondContact N-O 3.05Å; F8-M24 PolarHBondContact O-N 2.9Å; V11-M24 HydrophobicContact CB-CB 4.15Å; V11-M24 HydrophobicContact CG1-CB 4.13Å; V11-M24 HydrophobicContact CG2-CB 3.95Å; M24-L26 HydrophobicContact CE-CD1 4.07Å; M24-L26 HydrophobicContact CE-CD2 3.81Å; M24-L26 HydrophobicContact CE-CG 3.99Å; M24-L26 HydrophobicContact CG-CD2 4.14Å; M24-L26 HydrophobicContact SD-CD2 3.99Å; M24-V32 WeakPolarHBondContact CA-O 3.19Å; M24-F33 HydrophobicContact CB-CD2 4.48Å; M24-L63 HydrophobicContact CE-CD2 4.05Å; M24-F75 HydrophobicContact SD-CG 4.44Å; M24-F78 HydrophobicContact CE-CE1 3.59Å; M24-F78 HydrophobicContact CE-CZ 3.53Å; M24-F78 HydrophobicContact SD-CZ 4.28Å
25	K	93.1	Very high	89.7	Confident	39 Å²	39	44.6 Å²	44.6	17%	0.17	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	130.2	169.9	-64.6	-178.9	-170	-85.9	0	108.6	V4 E7 V32 Y34	V4-K25 HydrophobicContact CG1-CB 4.06Å; V4-K25 HydrophobicContact CG1-CD 4.45Å; V4-K25 HydrophobicContact CG1-CG 4.21Å; V4-K25 HydrophobicContact CG2-CB 4.48Å; V4-K25 HydrophobicContact CG2-CD 4.05Å; E7-K25 HydrophobicContact CB-CG 4.39Å; E7-K25 HydrophobicContact CG-CG 3.99Å; E7-K25 VanDerWaalsContact OE1-CE 3.32Å; E7-K25 WeakPolarHBondContact OE1-CE 3.15Å; E7-K25 IonicContact OE1-NZ 2.67Å; E7-K25 PolarHBondContact OE1-NZ 2.63Å; E7-K25 IonicContact OE2-NZ 2.59Å; E7-K25 PolarHBondContact OE2-NZ 2.68Å; K25-V32 PolarHBondContact N-O 2.93Å; K25-V32 PolarHBondContact O-N 2.92Å; K25-Y34 HydrophobicContact CB-CE2 4.42Å; K25-Y34 HydrophobicContact CD-CE2 3.76Å; K25-Y34 HydrophobicContact CG-CE2 4.05Å
26	L	93.6	Very high	89.7	Confident	0 Å²	0	46 Å²	46	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	126.9	171.5	-56.8	-178.1	0	0	0	108.9	V5 L6 F8 M24 A31 L86 F89 F90 W94	V5-L26 PolarHBondContact N-O 3.28Å; L6-L26 HydrophobicContact CB-CB 4.26Å; L6-L26 HydrophobicContact CB-CD1 4.38Å; L6-L26 HydrophobicContact CD1-CD1 4.28Å; L6-L26 PolarHBondContact N-O 2.57Å; L6-L26 PolarHBondContact O-N 3.09Å; F8-L26 HydrophobicContact CE2-CD1 4.07Å; M24-L26 HydrophobicContact CE-CD1 4.07Å; M24-L26 HydrophobicContact CE-CD2 3.81Å; M24-L26 HydrophobicContact CE-CG 3.99Å; M24-L26 HydrophobicContact CG-CD2 4.14Å; M24-L26 HydrophobicContact SD-CD2 3.99Å; L26-A31 HydrophobicContact CD2-CB 3.56Å; L26-L86 HydrophobicContact CD1-CD2 3.53Å; L26-F89 HydrophobicContact CB-CD1 4.42Å; L26-F89 HydrophobicContact CB-CE1 3.74Å; L26-F89 HydrophobicContact CB-CE2 4.36Å; L26-F89 HydrophobicContact CB-CZ 3.71Å; L26-F89 HydrophobicContact CD1-CD1 3.8Å; L26-F89 HydrophobicContact CD1-CE1 3.76Å; L26-F89 HydrophobicContact CG-CE1 4.28Å; L26-F90 HydrophobicContact CD1-CE1 4.17Å; L26-W94 HydrophobicContact CD2-CH2 4.1Å; L26-W94 HydrophobicContact CD2-CZ2 4.41Å
27	T	92.2	Very high	89.5	Confident	16 Å²	16	50 Å²	50	10%	0.098	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	165	173.6	72.9	0	0	0	0	109.3	N3 V4 Q29 S30 F89 W94	N3-T27 WeakPolarHBondContact O-CA 3.49Å; N3-T27 WeakPolarHBondContact O-CB 3.38Å; V4-T27 HydrophobicContact CG2-CG2 4.42Å; T27-Q29 PolarHBondContact O-N 3.48Å; T27-Q29 PolarHBondContact OG1-N 3.13Å; T27-S30 PolarHBondContact N-O 3.44Å; T27-S30 PolarHBondContact O-N 3.18Å; T27-S30 PolarHBondContact OG1-N 3.13Å; T27-S30 PolarHBondContact OG1-O 3.06Å; T27-S30 PolarHBondContact OG1-OG 3.44Å; T27-S30 VanDerWaalsContact OG1-OG 3.11Å; T27-F89 WeakPolarHBondContact O-CZ 3.45Å; T27-W94 PolarHBondContact O-NE1 3.01Å; T27-W94 VanDerWaalsContact O-NE1 3.14Å
28	E	89.5	Confident	89.1	Confident	86 Å²	86	52.1 Å²	52.1	40%	0.402	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.1	-25.3	173.4	-63.1	163.1	-147.3	0	0	113.4	N3 V5 W94	N3-E28 WeakPolarHBondContact CB-OE1 3.33Å; N3-E28 PolarHBondContact ND2-OE1 3.34Å; V5-E28 HydrophobicContact CG2-CG 4.07Å; E28-W94 VanDerWaalsContact O-CD1 3.29Å; E28-W94 PolarHBondContact O-NE1 2.82Å
29	Q	90.5	Very high	88.7	Confident	150 Å²	150	52.9 Å²	52.9	70%	0.701	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.4	-11.2	-172.5	-59.8	-177.6	3	0	0	115.1	T27 A46	T27-Q29 PolarHBondContact O-N 3.48Å; T27-Q29 PolarHBondContact OG1-N 3.13Å; Q29-A46 WeakPolarHBondContact O-CB 3.39Å; Q29-A46 PolarHBondContact O-N 2.95Å
30	S	92.7	Very high	88.3	Confident	19 Å²	19	52.2 Å²	52.2	13%	0.133	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.1	153.7	-175.6	61.4	0	0	0	0	114.6	T27 I44	T27-S30 PolarHBondContact N-O 3.44Å; T27-S30 PolarHBondContact O-N 3.18Å; T27-S30 PolarHBondContact OG1-N 3.13Å; T27-S30 PolarHBondContact OG1-O 3.06Å; T27-S30 PolarHBondContact OG1-OG 3.44Å; T27-S30 VanDerWaalsContact OG1-OG 3.11Å; S30-I44 CarbonylContact C-O 3.49Å; S30-I44 WeakPolarHBondContact CA-O 3.03Å; S30-I44 WeakPolarHBondContact CB-O 3.32Å
31	A	92.9	Very high	88.2	Confident	2 Å²	2	55.4 Å²	55.4	2%	0.017	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	140.2	154.8	0	0	0	0	0	109.8	L26 T43 I44 F65 W94	L26-A31 HydrophobicContact CD2-CB 3.56Å; A31-T43 WeakPolarHBondContact O-CA 3.09Å; A31-I44 HydrophobicContact CB-CB 4.43Å; A31-I44 PolarHBondContact N-O 3.32Å; A31-I44 PolarHBondContact O-N 3.12Å; A31-F65 HydrophobicContact CB-CE2 3.8Å; A31-F65 HydrophobicContact CB-CZ 4.38Å; A31-W94 HydrophobicContact CB-CH2 4.08Å
32	V	92.9	Very high	88	Confident	13 Å²	13	51.6 Å²	51.6	8%	0.079	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	112.2	174.9	-170.8	0	0	0	0	109.2	M24 K25 Y34 T41 T43	M24-V32 WeakPolarHBondContact CA-O 3.19Å; K25-V32 PolarHBondContact N-O 2.93Å; K25-V32 PolarHBondContact O-N 2.92Å; V32-Y34 HydrophobicContact CB-CE2 4.04Å; V32-Y34 HydrophobicContact CG1-CD2 4.18Å; V32-Y34 HydrophobicContact CG1-CE1 4.19Å; V32-Y34 HydrophobicContact CG1-CE2 3.51Å; V32-T41 HydrophobicContact CG1-CG2 3.36Å; V32-T43 HydrophobicContact CG2-CG2 4.17Å
33	F	91.9	Very high	88.1	Confident	5 Å²	5	55.6 Å²	55.6	2%	0.022	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	133.5	172.3	-179.2	-103.7	0	0	0	110.2	V11 M13 D20 R23 M24 N35 T41 E42 F75	V11-F33 HydrophobicContact CB-CE2 4.37Å; V11-F33 HydrophobicContact CG1-CD2 4.31Å; V11-F33 HydrophobicContact CG1-CE2 4.16Å; M13-F33 HydrophobicContact CB-CD1 3.94Å; M13-F33 HydrophobicContact CB-CD2 4.49Å; M13-F33 HydrophobicContact CB-CE1 3.49Å; M13-F33 VanDerWaalsContact CB-CE1 3.49Å; M13-F33 HydrophobicContact CB-CE2 4.11Å; M13-F33 HydrophobicContact CB-CG 4.41Å; M13-F33 HydrophobicContact CB-CZ 3.59Å; M13-F33 HydrophobicContact CG-CE1 4.42Å; M13-F33 HydrophobicContact SD-CD1 3.77Å; M13-F33 HydrophobicContact SD-CE1 4.19Å; M13-F33 HydrophobicContact SD-CG 4.3Å; D20-F33 WeakPolarHBondContact O-CZ 3.41Å; R23-F33 WeakPolarHBondContact O-CA 3.24Å; M24-F33 HydrophobicContact CB-CD2 4.48Å; F33-N35 HydrophobicContact CE1-CB 3.96Å; F33-T41 CarbonylContact O-C 3.57Å; F33-T41 WeakPolarHBondContact O-CA 3.42Å; F33-E42 PolarHBondContact N-O 3.3Å; F33-E42 PolarHBondContact O-N 3.09Å; F33-F75 HydrophobicContact CB-CE1 3.79Å; F33-F75 HydrophobicContact CB-CZ 4.38Å; F33-F75 HydrophobicContact CD1-CE1 4.5Å; F33-F75 HydrophobicContact CD2-CD1 4.14Å; F33-F75 AromaticContact CD2-CE1 3.96Å; F33-F75 HydrophobicContact CD2-CE1 3.96Å; F33-F75 HydrophobicContact CG-CD1 4.46Å; F33-F75 AromaticContact CG-CE1 3.83Å; F33-F75 HydrophobicContact CG-CE1 3.83Å
34	Y	89.4	Confident	88.1	Confident	65 Å²	65	50.9 Å²	50.9	26%	0.255	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	114.8	174.4	-58.3	-96.9	0	0	0	108.7	G22 R23 K25 V32 N36 T41	G22-Y34 CarbonylContact C-O 3.44Å; G22-Y34 WeakPolarHBondContact CA-O 3.28Å; R23-Y34 HydrophobicContact CG-CD2 3.95Å; R23-Y34 HydrophobicContact CG-CG 4.25Å; R23-Y34 PolarHBondContact N-O 3.06Å; R23-Y34 PolarHBondContact O-N 3.47Å; K25-Y34 HydrophobicContact CB-CE2 4.42Å; K25-Y34 HydrophobicContact CD-CE2 3.76Å; K25-Y34 HydrophobicContact CG-CE2 4.05Å; V32-Y34 HydrophobicContact CB-CE2 4.04Å; V32-Y34 HydrophobicContact CG1-CD2 4.18Å; V32-Y34 HydrophobicContact CG1-CE1 4.19Å; V32-Y34 HydrophobicContact CG1-CE2 3.51Å; Y34-N36 PolarHBondContact O-N 3.21Å; Y34-T41 HydrophobicContact CD1-CG2 3.76Å; Y34-T41 VanDerWaalsContact CD1-OG1 3.3Å; Y34-T41 WeakPolarHBondContact CD1-OG1 3.44Å; Y34-T41 HydrophobicContact CE1-CG2 3.58Å; Y34-T41 HydrophobicContact CG-CG2 4.43Å
35	N	85.6	Confident	88	Confident	16 Å²	16	52.6 Å²	52.6	9%	0.086	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	120.7	176.4	-179.8	-40.4	0	0	0	109.8	D20 F33 K37 T38 G39 A40	D20-N35 WeakPolarHBondContact CB-ND2 3.22Å; D20-N35 PolarHBondContact OD1-ND2 2.8Å; F33-N35 HydrophobicContact CE1-CB 3.96Å; N35-K37 PolarHBondContact O-N 2.94Å; N35-K37 WeakPolarHBondContact OD1-CA 3.25Å; N35-K37 WeakPolarHBondContact OD1-CB 3.17Å; N35-K37 PolarHBondContact OD1-N 3.32Å; N35-T38 WeakPolarHBondContact CB-OG1 3.37Å; N35-T38 PolarHBondContact ND2-OG1 2.91Å; N35-T38 PolarHBondContact OD1-N 3.07Å; N35-T38 PolarHBondContact OD1-OG1 3.18Å; N35-G39 WeakPolarHBondContact O-CA 3.31Å; N35-G39 PolarHBondContact O-N 2.99Å; N35-A40 PolarHBondContact N-O 3.46Å
36	N	85.1	Confident	87.8	Confident	104 Å²	104	51.5 Å²	51.5	56%	0.556	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-15.7	-175.3	-69.6	-19.7	0	0	0	113.5	R21 G22 Y34	R21-N36 WeakPolarHBondContact O-CB 3.36Å; R21-N36 PolarHBondContact O-N 3.36Å; G22-N36 WeakPolarHBondContact CA-ND2 3.4Å; Y34-N36 PolarHBondContact O-N 3.21Å
37	K	77.5	Confident	87.7	Confident	122 Å²	122	59.8 Å²	59.8	53%	0.53	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-44	-176.2	178.4	-178.3	175.4	-178.3	0	112.8	N35 E156	N35-K37 PolarHBondContact O-N 2.94Å; N35-K37 WeakPolarHBondContact OD1-CA 3.25Å; N35-K37 WeakPolarHBondContact OD1-CB 3.17Å; N35-K37 PolarHBondContact OD1-N 3.32Å; K37-E156 IonicContact NZ-OE1 2.68Å; K37-E156 PolarHBondContact NZ-OE1 3.46Å; K37-E156 IonicContact NZ-OE2 3.81Å; K37-E156 PolarHBondContact NZ-OE2 3.4Å
38	T	76.3	Confident	87.7	Confident	90 Å²	90	62.8 Å²	62.8	55%	0.552	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-16.4	-178.4	61	0	0	0	0	113.2	N35 A40	N35-T38 WeakPolarHBondContact CB-OG1 3.37Å; N35-T38 PolarHBondContact ND2-OG1 2.91Å; N35-T38 PolarHBondContact OD1-N 3.07Å; N35-T38 PolarHBondContact OD1-OG1 3.18Å; T38-A40 PolarHBondContact O-N 3.1Å; T38-A40 VanDerWaalsContact OG1-CB 3.3Å; T38-A40 WeakPolarHBondContact OG1-CB 3.19Å; T38-A40 PolarHBondContact OG1-N 3.45Å
39	G	76.9	Confident	87.8	Confident	60 Å²	60	59 Å²	59	62%	0.619	33%	0.328	S	S	*	.			trans	70.1	-0.7	-169.4	0	0	0	0	0	113.8	N35	N35-G39 WeakPolarHBondContact O-CA 3.31Å; N35-G39 PolarHBondContact O-N 2.99Å
40	A	79.6	Confident	87.9	Confident	55 Å²	55	57.2 Å²	57.2	46%	0.455	32%	0.32	S	S	.	.			trans	-63.1	139.5	178	0	0	0	0	0	110.6	N35 T38	N35-A40 PolarHBondContact N-O 3.46Å; T38-A40 PolarHBondContact O-N 3.1Å; T38-A40 VanDerWaalsContact OG1-CB 3.3Å; T38-A40 WeakPolarHBondContact OG1-CB 3.19Å; T38-A40 PolarHBondContact OG1-N 3.45Å
41	T	86.2	Confident	87.8	Confident	73 Å²	73	57.3 Å²	57.3	45%	0.448	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	118.9	176.4	-56.5	0	0	0	0	108.3	V32 F33 Y34	V32-T41 HydrophobicContact CG1-CG2 3.36Å; F33-T41 CarbonylContact O-C 3.57Å; F33-T41 WeakPolarHBondContact O-CA 3.42Å; Y34-T41 HydrophobicContact CD1-CG2 3.76Å; Y34-T41 VanDerWaalsContact CD1-OG1 3.3Å; Y34-T41 WeakPolarHBondContact CD1-OG1 3.44Å; Y34-T41 HydrophobicContact CE1-CG2 3.58Å; Y34-T41 HydrophobicContact CG-CG2 4.43Å
42	E	86.4	Confident	87.8	Confident	65 Å²	65	57.3 Å²	57.3	30%	0.304	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	110.4	179.3	-166.9	156	-178.8	0	0	109.4	M13 F33 K71 Y73	M13-E42 VanDerWaalsContact CE-OE2 3.28Å; M13-E42 WeakPolarHBondContact CE-OE2 3.46Å; F33-E42 PolarHBondContact N-O 3.3Å; F33-E42 PolarHBondContact O-N 3.09Å; E42-K71 IonicContact OE1-NZ 2.82Å; E42-K71 PolarHBondContact OE1-NZ 3.32Å; E42-Y73 HydrophobicContact CG-CE1 4.09Å; E42-Y73 WeakPolarHBondContact OE1-CE1 3.39Å
43	T	91.5	Very high	87.8	Confident	84 Å²	84	57.3 Å²	57.3	52%	0.515	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	130	-176.5	-61.4	0	0	0	0	109.8	A31 V32	A31-T43 WeakPolarHBondContact O-CA 3.09Å; V32-T43 HydrophobicContact CG2-CG2 4.17Å
44	I	92	Very high	87.9	Confident	5 Å²	5	58.1 Å²	58.1	3%	0.026	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	113.9	176.3	-50.2	168.7	0	0	0	106.8	S30 A31 I49 F65 Y73 F75	S30-I44 CarbonylContact C-O 3.49Å; S30-I44 WeakPolarHBondContact CA-O 3.03Å; S30-I44 WeakPolarHBondContact CB-O 3.32Å; A31-I44 HydrophobicContact CB-CB 4.43Å; A31-I44 PolarHBondContact N-O 3.32Å; A31-I44 PolarHBondContact O-N 3.12Å; I44-I49 HydrophobicContact CG2-CD1 3.98Å; I44-I49 HydrophobicContact CG2-CG1 3.71Å; I44-F65 HydrophobicContact CD1-CD2 3.74Å; I44-F65 HydrophobicContact CD1-CE2 4.35Å; I44-Y73 HydrophobicContact CD1-CD1 3.34Å; I44-Y73 HydrophobicContact CD1-CD2 4.1Å; I44-Y73 HydrophobicContact CD1-CE1 3.68Å; I44-Y73 HydrophobicContact CD1-CE2 4.44Å; I44-Y73 HydrophobicContact CD1-CG 3.55Å; I44-Y73 HydrophobicContact CG1-CD1 3.88Å; I44-Y73 HydrophobicContact CG1-CE1 3.65Å; I44-Y73 HydrophobicContact CG1-CG 4.36Å; I44-F75 HydrophobicContact CD1-CE2 3.98Å; I44-F75 HydrophobicContact CD1-CZ 3.97Å
45	S	92	Very high	88	Confident	35 Å²	35	55.3 Å²	55.3	25%	0.245	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	136.5	174.8	145	0	0	0	0	109.6	K47 D48	S45-K47 PolarHBondContact O-N 3.26Å; S45-K47 PolarHBondContact OG-N 3.01Å; S45-D48 VanDerWaalsContact CB-CG 3.43Å; S45-D48 WeakPolarHBondContact CB-OD1 3.49Å; S45-D48 WeakPolarHBondContact O-CB 3.28Å; S45-D48 PolarHBondContact O-N 3.32Å; S45-D48 PolarHBondContact OG-OD1 3.35Å
46	A	90.3	Very high	88.1	Confident	17 Å²	17	60.8 Å²	60.8	14%	0.14	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-62.4	-23.8	178.8	0	0	0	0	0	112.6	Q29 D48 W94	Q29-A46 WeakPolarHBondContact O-CB 3.39Å; Q29-A46 PolarHBondContact O-N 2.95Å; A46-D48 VanDerWaalsContact C-N 3.26Å; A46-D48 PolarHBondContact O-N 3.05Å; A46-W94 HydrophobicContact CB-CB 4.45Å; A46-W94 HydrophobicContact CB-CD2 3.74Å; A46-W94 HydrophobicContact CB-CE3 4.44Å; A46-W94 HydrophobicContact CB-CG 3.7Å; A46-W94 HydrophobicContact CB-CZ2 4.37Å
47	K	91.4	Very high	88	Confident	174 Å²	174	57.7 Å²	57.7	76%	0.757	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-74.4	-16.5	174.7	-60.3	-177.3	178.7	-178.7	0	113.4	S45 Q68	S45-K47 PolarHBondContact O-N 3.26Å; S45-K47 PolarHBondContact OG-N 3.01Å; K47-Q68 PolarHBondContact O-NE2 3.25Å
48	D	91.8	Very high	88	Confident	79 Å²	79	55 Å²	55	42%	0.422	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-97.6	-9.3	-174.5	-50.4	13.4	0	0	0	110.7	S45 A46 A67 Q68	S45-D48 VanDerWaalsContact CB-CG 3.43Å; S45-D48 WeakPolarHBondContact CB-OD1 3.49Å; S45-D48 WeakPolarHBondContact O-CB 3.28Å; S45-D48 PolarHBondContact O-N 3.32Å; S45-D48 PolarHBondContact OG-OD1 3.35Å; A46-D48 VanDerWaalsContact C-N 3.26Å; A46-D48 PolarHBondContact O-N 3.05Å; D48-A67 CarbonylContact O-C 3.56Å; D48-A67 WeakPolarHBondContact O-CA 3.43Å; D48-Q68 PolarHBondContact O-N 3.24Å
49	I	91.8	Very high	88	Confident	7 Å²	7	58.6 Å²	58.6	4%	0.036	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	130.9	177.3	-58.8	174.6	0	0	0	109	I44 F65 W94 L96	I44-I49 HydrophobicContact CG2-CD1 3.98Å; I44-I49 HydrophobicContact CG2-CG1 3.71Å; I49-F65 HydrophobicContact CD1-CB 4.44Å; I49-F65 HydrophobicContact CD1-CD1 4.07Å; I49-F65 HydrophobicContact CD1-CD2 4.29Å; I49-F65 HydrophobicContact CD1-CE1 4.34Å; I49-F65 HydrophobicContact CD1-CG 4.04Å; I49-F65 HydrophobicContact CG1-CB 4.46Å; I49-F65 HydrophobicContact CG2-CB 4.35Å; I49-F65 HydrophobicContact CG2-CD1 4.38Å; I49-W94 HydrophobicContact CD1-CE3 4.02Å; I49-W94 HydrophobicContact CD1-CH2 4.06Å; I49-W94 HydrophobicContact CD1-CZ3 3.49Å; I49-W94 VanDerWaalsContact CD1-CZ3 3.49Å; I49-L96 HydrophobicContact CB-CD1 4.03Å; I49-L96 HydrophobicContact CG2-CD1 3.67Å
50	E	91.3	Very high	88.5	Confident	111 Å²	111	57 Å²	57	52%	0.519	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	-45.9	175.2	-175	-179.5	170.4	0	0	110.8	L66 Q68	E50-L66 HydrophobicContact CB-CD2 4.32Å; E50-L66 HydrophobicContact CB-CG 4.26Å; E50-L66 HydrophobicContact CG-CD2 4.28Å; E50-L66 PolarHBondContact N-O 2.72Å; E50-Q68 HydrophobicContact CB-CG 4.23Å
51	S	91.7	Very high	89.1	Confident	22 Å²	22	55.1 Å²	55.1	15%	0.154	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	155.5	176.4	78	0	0	0	0	113.7	H53 L66	S51-H53 PolarHBondContact OG-CD2 2.88Å; S51-H53 PolarHBondContact OG-CE1 2.92Å; S51-H53 PolarHBondContact OG-NE2 3.44Å; S51-L66 PolarHBondContact N-O 2.71Å; S51-L66 PolarHBondContact O-N 3.14Å
52	C	93.4	Very high	89.4	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.007	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	114.2	176.4	-64.1	0	0	0	0	109.5	R64 F65 F90 L98 E99	C52-R64 WeakPolarHBondContact CA-O 2.94Å; C52-F65 HydrophobicContact CB-CD1 4.32Å; C52-F65 HydrophobicContact CB-CE1 4.49Å; C52-F65 VanDerWaalsContact SG-CD1 3.59Å; C52-F90 HydrophobicContact CB-CD2 4.32Å; C52-F90 HydrophobicContact CB-CE2 4.4Å; C52-L98 HydrophobicContact CB-CD1 3.96Å; C52-E99 PolarHBondContact O-N 3.13Å
53	H	92.7	Very high	89.7	Confident	13 Å²	13	48.6 Å²	48.6	6%	0.06	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	133.9	179.2	-56.5	166.8	0	0	0	111.6	S51 R64 E99	S51-H53 PolarHBondContact OG-CD2 2.88Å; S51-H53 PolarHBondContact OG-CE1 2.92Å; S51-H53 PolarHBondContact OG-NE2 3.44Å; H53-R64 HydrophobicContact CB-CB 4.36Å; H53-R64 PolarHBondContact N-O 2.93Å; H53-R64 PolarHBondContact O-N 3.12Å; H53-E99 CarbonylContact C-O 3.59Å; H53-E99 VanDerWaalsContact CA-O 3.3Å; H53-E99 WeakPolarHBondContact CA-O 3.28Å
54	W	93.8	Very high	89.8	Confident	23 Å²	23	45.1 Å²	45.1	9%	0.087	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	135.8	168.5	-170.6	-110	0	0	0	110	P61 L63 F78 D82 H83 L86 L98 E99 T100 K101	W54-P61 HydrophobicContact CH2-CB 3.88Å; W54-P61 HydrophobicContact CZ2-CB 3.48Å; W54-P61 VanDerWaalsContact CZ2-CB 3.48Å; W54-P61 HydrophobicContact CZ2-CG 4.44Å; W54-L63 HydrophobicContact CE3-CB 4.3Å; W54-L63 HydrophobicContact CZ3-CB 4.27Å; W54-F78 HydrophobicContact CH2-CB 3.69Å; W54-F78 HydrophobicContact CH2-CG 4.22Å; W54-F78 HydrophobicContact CZ3-CB 4.19Å; W54-F78 HydrophobicContact CZ3-CD2 4.28Å; W54-F78 HydrophobicContact CZ3-CG 4.23Å; W54-D82 HydrophobicContact CH2-CB 4.43Å; W54-H83 AromaticContact CD1-CD2 3.38Å; W54-H83 AromaticContact CD2-CD2 3.75Å; W54-H83 AromaticContact CE2-CD2 3.74Å; W54-H83 AromaticContact CG-CD2 3.5Å; W54-H83 VanDerWaalsContact CG-CD2 3.5Å; W54-H83 HydrophobicContact CH2-CB 4.46Å; W54-H83 HydrophobicContact CZ2-CB 3.77Å; W54-H83 AromaticContact NE1-CD2 3.53Å; W54-H83 AromaticContact NE1-CG 3.92Å; W54-L86 HydrophobicContact CE3-CD1 4.33Å; W54-L86 HydrophobicContact CH2-CD1 4.11Å; W54-L86 HydrophobicContact CZ3-CD1 3.52Å; W54-L98 HydrophobicContact CB-CD1 3.92Å; W54-L98 HydrophobicContact CB-CD2 4.22Å; W54-L98 HydrophobicContact CB-CG 3.91Å; W54-L98 HydrophobicContact CE3-CD2 4.38Å; W54-E99 PolarHBondContact N-O 2.94Å; W54-T100 CarbonylContact O-C 3.54Å; W54-T100 WeakPolarHBondContact O-CA 3.48Å; W54-K101 PolarHBondContact O-N 3.41Å
55	S	90.5	Very high	89.8	Confident	6 Å²	6	44.9 Å²	44.9	4%	0.042	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165	-176.7	-176.6	54.6	0	0	0	0	108.9	A62 R64	S55-A62 PolarHBondContact N-O 3.02Å; S55-A62 WeakPolarHBondContact O-CA 3.48Å; S55-A62 PolarHBondContact O-N 3.36Å; S55-A62 VanDerWaalsContact O-O 3.06Å; S55-R64 PolarHBondContact OG-NE 3.4Å; S55-R64 PolarHBondContact OG-NH2 3.07Å
56	R	87.9	Confident	89.8	Confident	130 Å²	130	43.3 Å²	43.3	49%	0.491	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	155.8	165.9	-66.8	-176	171.2	179.1	-3.8	111.4	G60 R64 E80 I103	R56-G60 CarbonylContact C-O 3.42Å; R56-G60 VanDerWaalsContact CA-O 3.26Å; R56-G60 WeakPolarHBondContact CA-O 3.45Å; R56-G60 WeakPolarHBondContact CB-O 3.45Å; R56-R64 PolarHBondContact O-NH2 2.93Å; R56-E80 IonicContact CZ-OE1 3.5Å; R56-E80 IonicContact NH2-OE1 2.7Å; R56-E80 PolarHBondContact NH2-OE1 3.15Å; R56-I103 HydrophobicContact CB-CD1 3.84Å
57	L	83.4	Confident	89.7	Confident	40 Å²	40	42.6 Å²	42.6	21%	0.209	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	99.4	172	-174.8	64.8	0	0	0	107.5	L19 N59 G60 A62	L19-L57 HydrophobicContact CD2-CD2 3.88Å; L57-N59 PolarHBondContact O-N 2.89Å; L57-G60 PolarHBondContact N-O 3.17Å; L57-A62 HydrophobicContact CB-CB 3.43Å; L57-A62 VanDerWaalsContact CB-CB 3.43Å
58	G	78	Confident	89.5	Confident	64 Å²	64	40.5 Å²	40.5	66%	0.66	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.1	-129.9	-161.3	0	0	0	0	0	110.7
59	N	76.8	Confident	89	Confident	166 Å²	166	42.1 Å²	42.1	89%	0.888	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-11.3	-173.3	-64	9.9	0	0	0	114.4	L57	L57-N59 PolarHBondContact O-N 2.89Å
60	G	86	Confident	88.5	Confident	26 Å²	26	42.2 Å²	42.2	27%	0.268	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	156.8	-172.6	0	0	0	0	0	114	R56 L57	R56-G60 CarbonylContact C-O 3.42Å; R56-G60 VanDerWaalsContact CA-O 3.26Å; R56-G60 WeakPolarHBondContact CA-O 3.45Å; R56-G60 WeakPolarHBondContact CB-O 3.45Å; L57-G60 PolarHBondContact N-O 3.17Å
61	P	91.5	Very high	88.2	Confident	16 Å²	16	39.6 Å²	39.6	10%	0.104	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	148.5	165.7	-21.6	32.3	0	0	0	113	W54 F78 E80	W54-P61 HydrophobicContact CH2-CB 3.88Å; W54-P61 HydrophobicContact CZ2-CB 3.48Å; W54-P61 VanDerWaalsContact CZ2-CB 3.48Å; W54-P61 HydrophobicContact CZ2-CG 4.44Å; P61-F78 HydrophobicContact CB-CB 4.47Å; P61-F78 VanDerWaalsContact CD-O 3.32Å; P61-F78 WeakPolarHBondContact CD-O 3.43Å; P61-F78 WeakPolarHBondContact CG-O 3.45Å; P61-E80 HydrophobicContact CG-CG 3.7Å
62	A	92.7	Very high	88	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.008	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	140.6	-173.9	0	0	0	0	0	112.6	S55 L57 F75	S55-A62 PolarHBondContact N-O 3.02Å; S55-A62 WeakPolarHBondContact O-CA 3.48Å; S55-A62 PolarHBondContact O-N 3.36Å; S55-A62 VanDerWaalsContact O-O 3.06Å; L57-A62 HydrophobicContact CB-CB 3.43Å; L57-A62 VanDerWaalsContact CB-CB 3.43Å; A62-F75 CarbonylContact C-O 3.54Å; A62-F75 WeakPolarHBondContact CA-O 3.48Å; A62-F75 VanDerWaalsContact CB-O 3.28Å; A62-F75 WeakPolarHBondContact CB-O 3.25Å
63	L	94	Very high	87.9	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	131.2	176.3	176.1	64.8	0	0	0	108.9	M24 W54 F65 F75 F78 L86 F90 L98	M24-L63 HydrophobicContact CE-CD2 4.05Å; W54-L63 HydrophobicContact CE3-CB 4.3Å; W54-L63 HydrophobicContact CZ3-CB 4.27Å; L63-F65 HydrophobicContact CD1-CD1 4.49Å; L63-F65 HydrophobicContact CD1-CE1 3.92Å; L63-F65 HydrophobicContact CD1-CZ 4.43Å; L63-F65 HydrophobicContact CD2-CE1 3.95Å; L63-F65 HydrophobicContact CD2-CE2 4.26Å; L63-F65 HydrophobicContact CD2-CZ 3.59Å; L63-F65 HydrophobicContact CG-CE1 3.98Å; L63-F65 HydrophobicContact CG-CZ 4.05Å; L63-F75 PolarHBondContact N-O 2.68Å; L63-F75 PolarHBondContact O-N 2.9Å; L63-F78 HydrophobicContact CB-CD2 4.19Å; L63-F78 HydrophobicContact CB-CE2 3.61Å; L63-F78 HydrophobicContact CB-CZ 4.08Å; L63-F78 HydrophobicContact CD2-CE2 4.46Å; L63-F78 HydrophobicContact CD2-CZ 4.09Å; L63-L86 HydrophobicContact CD2-CD1 4.28Å; L63-L86 HydrophobicContact CD2-CD2 4.35Å; L63-F90 HydrophobicContact CD1-CE2 3.74Å; L63-F90 HydrophobicContact CD1-CZ 3.87Å; L63-F90 HydrophobicContact CD2-CZ 3.94Å; L63-L98 HydrophobicContact CD1-CD1 3.86Å
64	R	92.7	Very high	87.8	Confident	12 Å²	12	40.7 Å²	40.7	5%	0.045	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	133.6	177	-48.5	-177.3	-168.1	-174.4	2.1	109.7	C52 H53 S55 R56 M72 Y73 R74 D131	C52-R64 WeakPolarHBondContact CA-O 2.94Å; H53-R64 HydrophobicContact CB-CB 4.36Å; H53-R64 PolarHBondContact N-O 2.93Å; H53-R64 PolarHBondContact O-N 3.12Å; S55-R64 PolarHBondContact OG-NE 3.4Å; S55-R64 PolarHBondContact OG-NH2 3.07Å; R56-R64 PolarHBondContact O-NH2 2.93Å; R64-M72 HydrophobicContact CB-CG 4.33Å; R64-M72 HydrophobicContact CB-SD 4.14Å; R64-M72 HydrophobicContact CG-SD 4.48Å; R64-Y73 CarbonylContact C-O 3.57Å; R64-Y73 VanDerWaalsContact CA-O 3.23Å; R64-Y73 WeakPolarHBondContact CA-O 3.44Å; R64-R74 HydrophobicContact CG-CG 4.28Å; R64-D131 IonicContact CZ-OD1 3.72Å; R64-D131 IonicContact CZ-OD2 2.63Å; R64-D131 IonicContact NH1-OD1 3.63Å; R64-D131 PolarHBondContact NH1-OD1 3.09Å; R64-D131 IonicContact NH1-OD2 2.64Å; R64-D131 PolarHBondContact NH1-OD2 3.05Å; R64-D131 IonicContact NH2-OD1 3.56Å
65	F	92.6	Very high	87.8	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	124	170.5	-57.4	-48.8	0	0	0	108.8	A31 I44 I49 C52 L63 M72 Y73 F75 F90 W94	A31-F65 HydrophobicContact CB-CE2 3.8Å; A31-F65 HydrophobicContact CB-CZ 4.38Å; I44-F65 HydrophobicContact CD1-CD2 3.74Å; I44-F65 HydrophobicContact CD1-CE2 4.35Å; I49-F65 HydrophobicContact CD1-CB 4.44Å; I49-F65 HydrophobicContact CD1-CD1 4.07Å; I49-F65 HydrophobicContact CD1-CD2 4.29Å; I49-F65 HydrophobicContact CD1-CE1 4.34Å; I49-F65 HydrophobicContact CD1-CG 4.04Å; I49-F65 HydrophobicContact CG1-CB 4.46Å; I49-F65 HydrophobicContact CG2-CB 4.35Å; I49-F65 HydrophobicContact CG2-CD1 4.38Å; C52-F65 HydrophobicContact CB-CD1 4.32Å; C52-F65 HydrophobicContact CB-CE1 4.49Å; C52-F65 VanDerWaalsContact SG-CD1 3.59Å; L63-F65 HydrophobicContact CD1-CD1 4.49Å; L63-F65 HydrophobicContact CD1-CE1 3.92Å; L63-F65 HydrophobicContact CD1-CZ 4.43Å; L63-F65 HydrophobicContact CD2-CE1 3.95Å; L63-F65 HydrophobicContact CD2-CE2 4.26Å; L63-F65 HydrophobicContact CD2-CZ 3.59Å; L63-F65 HydrophobicContact CG-CE1 3.98Å; L63-F65 HydrophobicContact CG-CZ 4.05Å; F65-M72 CarbonylContact O-C 3.53Å; F65-M72 WeakPolarHBondContact O-CA 3.37Å; F65-Y73 PolarHBondContact N-O 2.73Å; F65-Y73 PolarHBondContact O-N 3.11Å; F65-F75 HydrophobicContact CD2-CD2 4.3Å; F65-F75 AromaticContact CD2-CE2 3.8Å; F65-F75 HydrophobicContact CD2-CE2 3.8Å; F65-F75 HydrophobicContact CE2-CD2 4.32Å; F65-F75 AromaticContact CE2-CE2 4Å; F65-F75 HydrophobicContact CE2-CE2 4Å; F65-F90 HydrophobicContact CE1-CE1 4.03Å; F65-F90 HydrophobicContact CE1-CE2 4.43Å; F65-F90 AromaticContact CE1-CZ 3.74Å; F65-F90 HydrophobicContact CE1-CZ 3.74Å; F65-F90 HydrophobicContact CZ-CE1 4.15Å; F65-F90 AromaticContact CZ-CZ 3.99Å; F65-F90 HydrophobicContact CZ-CZ 3.99Å; F65-W94 HydrophobicContact CE1-CH2 4.45Å; F65-W94 AromaticContact CE1-CZ3 3.84Å; F65-W94 HydrophobicContact CE1-CZ3 3.84Å; F65-W94 HydrophobicContact CZ-CH2 4Å; F65-W94 AromaticContact CZ-CZ3 3.85Å; F65-W94 HydrophobicContact CZ-CZ3 3.85Å
66	L	91.1	Very high	87.9	Confident	2 Å²	2	39.7 Å²	39.7	1%	0.01	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	121.7	162	179.8	65	0	0	0	107.3	E50 S51 L116	E50-L66 HydrophobicContact CB-CD2 4.32Å; E50-L66 HydrophobicContact CB-CG 4.26Å; E50-L66 HydrophobicContact CG-CD2 4.28Å; E50-L66 PolarHBondContact N-O 2.72Å; S51-L66 PolarHBondContact N-O 2.71Å; S51-L66 PolarHBondContact O-N 3.14Å; L66-L116 HydrophobicContact CD1-CG 4.49Å; L66-L116 HydrophobicContact CD2-CD1 3.81Å; L66-L116 HydrophobicContact CD2-CD2 4.43Å; L66-L116 HydrophobicContact CD2-CG 3.94Å
67	A	89.6	Confident	88	Confident	2 Å²	2	35.5 Å²	35.5	2%	0.017	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	152	171.4	0	0	0	0	0	110.9	D48 N69 G70 K71 Y73	D48-A67 CarbonylContact O-C 3.56Å; D48-A67 WeakPolarHBondContact O-CA 3.43Å; A67-N69 WeakPolarHBondContact CB-OD1 3.44Å; A67-N69 PolarHBondContact O-N 2.97Å; A67-G70 WeakPolarHBondContact O-CA 3.49Å; A67-G70 PolarHBondContact O-N 3.31Å; A67-K71 PolarHBondContact N-O 3.45Å; A67-Y73 HydrophobicContact CB-CD2 4.38Å; A67-Y73 HydrophobicContact CB-CE2 3.89Å
68	Q	86.9	Confident	88.5	Confident	129 Å²	129	33.9 Å²	33.9	60%	0.603	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-16.8	-178.9	-68.8	166.1	12.8	0	0	114.2	K47 D48 E50 G70	K47-Q68 PolarHBondContact O-NE2 3.25Å; D48-Q68 PolarHBondContact O-N 3.24Å; E50-Q68 HydrophobicContact CB-CG 4.23Å; Q68-G70 PolarHBondContact O-N 2.91Å
69	N	81.1	Confident	89.1	Confident	113 Å²	113	36.4 Å²	36.4	60%	0.604	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.1	7.6	171.4	66	15.2	0	0	0	113.5	A67 K71	A67-N69 WeakPolarHBondContact CB-OD1 3.44Å; A67-N69 PolarHBondContact O-N 2.97Å; N69-K71 VanDerWaalsContact C-N 3.28Å; N69-K71 PolarHBondContact O-N 3.49Å; N69-K71 VanDerWaalsContact OD1-CB 3.22Å; N69-K71 WeakPolarHBondContact OD1-CB 3.31Å; N69-K71 PolarHBondContact OD1-N 2.82Å
70	G	81.8	Confident	89.7	Confident	9 Å²	9	34.6 Å²	34.6	9%	0.093	19%	0.19	C	C	.	.	S	Bend	trans	80.5	-9.4	-178	0	0	0	0	0	115.3	A67 Q68 M72 S118	A67-G70 WeakPolarHBondContact O-CA 3.49Å; A67-G70 PolarHBondContact O-N 3.31Å; Q68-G70 PolarHBondContact O-N 2.91Å; G70-M72 PolarHBondContact O-N 2.77Å; G70-S118 WeakPolarHBondContact O-CA 3.3Å; G70-S118 WeakPolarHBondContact O-CB 3.46Å; G70-S118 PolarHBondContact O-N 2.84Å
71	K	83.6	Confident	90	Very high	57 Å²	57	36.7 Å²	36.7	25%	0.248	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-71.3	122.3	178.4	-179.6	176.7	164.3	-176.6	0	110	E42 A67 N69 Y73	E42-K71 IonicContact OE1-NZ 2.82Å; E42-K71 PolarHBondContact OE1-NZ 3.32Å; A67-K71 PolarHBondContact N-O 3.45Å; N69-K71 VanDerWaalsContact C-N 3.28Å; N69-K71 PolarHBondContact O-N 3.49Å; N69-K71 VanDerWaalsContact OD1-CB 3.22Å; N69-K71 WeakPolarHBondContact OD1-CB 3.31Å; N69-K71 PolarHBondContact OD1-N 2.82Å; K71-Y73 HydrophobicContact CB-CE2 4.04Å; K71-Y73 HydrophobicContact CD-CD2 4.29Å; K71-Y73 HydrophobicContact CD-CE1 4.2Å; K71-Y73 HydrophobicContact CD-CE2 3.65Å; K71-Y73 VanDerWaalsContact CE-CE1 3.5Å; K71-Y73 VanDerWaalsContact CE-CZ 3.46Å; K71-Y73 HydrophobicContact CG-CD2 4.02Å; K71-Y73 HydrophobicContact CG-CE2 3.72Å
72	M	88.1	Confident	90	Very high	14 Å²	14	36.5 Å²	36.5	7%	0.069	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	126.4	164.8	-173.4	174.3	-72.4	0	0	110.2	R64 F65 G70 R74 L116 N119	R64-M72 HydrophobicContact CB-CG 4.33Å; R64-M72 HydrophobicContact CB-SD 4.14Å; R64-M72 HydrophobicContact CG-SD 4.48Å; F65-M72 CarbonylContact O-C 3.53Å; F65-M72 WeakPolarHBondContact O-CA 3.37Å; G70-M72 PolarHBondContact O-N 2.77Å; M72-R74 HydrophobicContact CG-CG 4.07Å; M72-R74 HydrophobicContact SD-CG 4.22Å; M72-L116 HydrophobicContact CE-CD2 3.72Å; M72-N119 HydrophobicContact CB-CB 4.34Å; M72-N119 HydrophobicContact CE-CB 4.11Å; M72-N119 VanDerWaalsContact CE-ND2 3.27Å; M72-N119 WeakPolarHBondContact CE-ND2 3.49Å; M72-N119 PolarHBondContact SD-ND2 2.97Å
73	Y	90.4	Very high	90	Very high	26 Å²	26	38.6 Å²	38.6	10%	0.102	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	135.3	169.5	-63.8	-110.2	0	0	0	108.3	M13 E42 I44 R64 F65 A67 K71 F75	M13-Y73 HydrophobicContact CE-CD1 3.91Å; E42-Y73 HydrophobicContact CG-CE1 4.09Å; E42-Y73 WeakPolarHBondContact OE1-CE1 3.39Å; I44-Y73 HydrophobicContact CD1-CD1 3.34Å; I44-Y73 HydrophobicContact CD1-CD2 4.1Å; I44-Y73 HydrophobicContact CD1-CE1 3.68Å; I44-Y73 HydrophobicContact CD1-CE2 4.44Å; I44-Y73 HydrophobicContact CD1-CG 3.55Å; I44-Y73 HydrophobicContact CG1-CD1 3.88Å; I44-Y73 HydrophobicContact CG1-CE1 3.65Å; I44-Y73 HydrophobicContact CG1-CG 4.36Å; R64-Y73 CarbonylContact C-O 3.57Å; R64-Y73 VanDerWaalsContact CA-O 3.23Å; R64-Y73 WeakPolarHBondContact CA-O 3.44Å; F65-Y73 PolarHBondContact N-O 2.73Å; F65-Y73 PolarHBondContact O-N 3.11Å; A67-Y73 HydrophobicContact CB-CD2 4.38Å; A67-Y73 HydrophobicContact CB-CE2 3.89Å; K71-Y73 HydrophobicContact CB-CE2 4.04Å; K71-Y73 HydrophobicContact CD-CD2 4.29Å; K71-Y73 HydrophobicContact CD-CE1 4.2Å; K71-Y73 HydrophobicContact CD-CE2 3.65Å; K71-Y73 VanDerWaalsContact CE-CE1 3.5Å; K71-Y73 VanDerWaalsContact CE-CZ 3.46Å; K71-Y73 HydrophobicContact CG-CD2 4.02Å; K71-Y73 HydrophobicContact CG-CE2 3.72Å; Y73-F75 HydrophobicContact CD1-CZ 4.49Å
74	R	91.7	Very high	90	Very high	18 Å²	18	42.8 Å²	42.8	7%	0.068	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	122.7	-176.4	-59	179.3	-177.5	-179.1	1.1	110.5	E14 R64 M72 N119 D131 P133	E14-R74 HydrophobicContact CB-CB 3.99Å; E14-R74 PolarHBondContact N-O 3.48Å; E14-R74 IonicContact OE2-NH1 2.81Å; R64-R74 HydrophobicContact CG-CG 4.28Å; M72-R74 HydrophobicContact CG-CG 4.07Å; M72-R74 HydrophobicContact SD-CG 4.22Å; R74-N119 PolarHBondContact NH2-OD1 3.41Å; R74-D131 IonicContact CZ-OD1 3.53Å; R74-D131 IonicContact CZ-OD2 2.6Å; R74-D131 VanDerWaalsContact CZ-OD2 3.3Å; R74-D131 IonicContact NE-OD2 2.78Å; R74-D131 PolarHBondContact NH1-O 3.04Å; R74-D131 IonicContact NH1-OD1 3.56Å; R74-D131 PolarHBondContact NH2-O 3.19Å; R74-D131 IonicContact NH2-OD1 2.62Å; R74-D131 IonicContact NH2-OD2 2.96Å; R74-D131 PolarHBondContact NH2-OD2 3.44Å; R74-P133 VanDerWaalsContact NH2-CD 3.26Å
75	F	93.5	Very high	89.9	Confident	2 Å²	2	47.1 Å²	47.1	1%	0.009	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	130.7	179.5	-57.7	-79.1	0	0	0	109.7	V11 R12 M13 M24 F33 I44 A62 L63 F65 Y73 F78	V11-F75 HydrophobicContact CG1-CB 3.97Å; V11-F75 HydrophobicContact CG1-CD1 4.09Å; V11-F75 HydrophobicContact CG1-CG 4.42Å; R12-F75 CarbonylContact O-C 3.5Å; R12-F75 WeakPolarHBondContact O-CA 3.32Å; M13-F75 HydrophobicContact CB-CD1 3.99Å; M13-F75 HydrophobicContact CB-CE1 3.97Å; M13-F75 HydrophobicContact CG-CD1 4.14Å; M13-F75 HydrophobicContact CG-CE1 3.79Å; M13-F75 HydrophobicContact SD-CD1 4.48Å; M13-F75 HydrophobicContact SD-CE1 3.58Å; M13-F75 VanDerWaalsContact SD-CE1 3.58Å; M13-F75 HydrophobicContact SD-CZ 4.04Å; M24-F75 HydrophobicContact SD-CG 4.44Å; F33-F75 HydrophobicContact CB-CE1 3.79Å; F33-F75 HydrophobicContact CB-CZ 4.38Å; F33-F75 HydrophobicContact CD1-CE1 4.5Å; F33-F75 HydrophobicContact CD2-CD1 4.14Å; F33-F75 AromaticContact CD2-CE1 3.96Å; F33-F75 HydrophobicContact CD2-CE1 3.96Å; F33-F75 HydrophobicContact CG-CD1 4.46Å; F33-F75 AromaticContact CG-CE1 3.83Å; F33-F75 HydrophobicContact CG-CE1 3.83Å; I44-F75 HydrophobicContact CD1-CE2 3.98Å; I44-F75 HydrophobicContact CD1-CZ 3.97Å; A62-F75 CarbonylContact C-O 3.54Å; A62-F75 WeakPolarHBondContact CA-O 3.48Å; A62-F75 VanDerWaalsContact CB-O 3.28Å; A62-F75 WeakPolarHBondContact CB-O 3.25Å; L63-F75 PolarHBondContact N-O 2.68Å; L63-F75 PolarHBondContact O-N 2.9Å; F65-F75 HydrophobicContact CD2-CD2 4.3Å; F65-F75 AromaticContact CD2-CE2 3.8Å; F65-F75 HydrophobicContact CD2-CE2 3.8Å; F65-F75 HydrophobicContact CE2-CD2 4.32Å; F65-F75 AromaticContact CE2-CE2 4Å; F65-F75 HydrophobicContact CE2-CE2 4Å; Y73-F75 HydrophobicContact CD1-CZ 4.49Å; F75-F78 HydrophobicContact CB-CE2 3.74Å; F75-F78 HydrophobicContact CB-CZ 4.07Å
76	G	92.8	Very high	90	Very high	6 Å²	6	47.1 Å²	47.1	6%	0.062	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	178.7	171.7	0	0	0	0	0	111.7	R12	R12-G76 PolarHBondContact N-O 2.74Å; R12-G76 PolarHBondContact O-N 3.2Å
77	G	90.3	Very high	90.1	Very high	43 Å²	43	50.7 Å²	50.7	44%	0.443	27%	0.267	S	S	.	.			trans	88.1	30	-177.9	0	0	0	0	0	113.8
78	F	93.2	Very high	90.2	Very high	5 Å²	5	55 Å²	55	2%	0.022	29%	0.293	C	S	.	.			trans	-100	152.2	169.2	-58.1	-80.6	0	0	0	110.4	F8 V11 M24 W54 P61 L63 F75 D82 L86	F8-F78 HydrophobicContact CB-CE1 4.48Å; F8-F78 HydrophobicContact CD1-CD1 4.06Å; F8-F78 HydrophobicContact CD1-CE1 4.18Å; F8-F78 HydrophobicContact CD2-CE1 4.17Å; F8-F78 HydrophobicContact CE1-CD1 4.19Å; F8-F78 HydrophobicContact CE1-CE1 4.43Å; F8-F78 HydrophobicContact CE2-CE1 4.41Å; F8-F78 HydrophobicContact CG-CD1 4.38Å; F8-F78 HydrophobicContact CG-CE1 4.05Å; V11-F78 HydrophobicContact CG1-CE2 4.31Å; V11-F78 HydrophobicContact CG1-CZ 3.9Å; V11-F78 HydrophobicContact CG2-CD1 4.48Å; V11-F78 HydrophobicContact CG2-CE1 3.81Å; V11-F78 HydrophobicContact CG2-CZ 3.97Å; M24-F78 HydrophobicContact CE-CE1 3.59Å; M24-F78 HydrophobicContact CE-CZ 3.53Å; M24-F78 HydrophobicContact SD-CZ 4.28Å; W54-F78 HydrophobicContact CH2-CB 3.69Å; W54-F78 HydrophobicContact CH2-CG 4.22Å; W54-F78 HydrophobicContact CZ3-CB 4.19Å; W54-F78 HydrophobicContact CZ3-CD2 4.28Å; W54-F78 HydrophobicContact CZ3-CG 4.23Å; P61-F78 HydrophobicContact CB-CB 4.47Å; P61-F78 VanDerWaalsContact CD-O 3.32Å; P61-F78 WeakPolarHBondContact CD-O 3.43Å; P61-F78 WeakPolarHBondContact CG-O 3.45Å; L63-F78 HydrophobicContact CB-CD2 4.19Å; L63-F78 HydrophobicContact CB-CE2 3.61Å; L63-F78 HydrophobicContact CB-CZ 4.08Å; L63-F78 HydrophobicContact CD2-CE2 4.46Å; L63-F78 HydrophobicContact CD2-CZ 4.09Å; F75-F78 HydrophobicContact CB-CE2 3.74Å; F75-F78 HydrophobicContact CB-CZ 4.07Å; F78-D82 HydrophobicContact CB-CB 4.21Å; F78-D82 HydrophobicContact CD1-CB 4.48Å; F78-L86 HydrophobicContact CD1-CD1 4.23Å; F78-L86 HydrophobicContact CE1-CD1 4.39Å
79	D	91.5	Very high	90.5	Very high	118 Å²	118	49.3 Å²	49.3	63%	0.631	27%	0.267	S	S	*	.			trans	-84	159.9	169.8	-73	-38.9	0	0	0	111.1	A81 D82	D79-A81 PolarHBondContact O-N 3.31Å; D79-D82 PolarHBondContact N-OD2 2.97Å; D79-D82 WeakPolarHBondContact O-CB 3.26Å; D79-D82 PolarHBondContact O-N 2.73Å
80	E	89.7	Confident	91.1	Very high	127 Å²	127	43.9 Å²	43.9	59%	0.593	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-27.3	176.5	-62.3	-166.9	148.2	0	0	112.1	R56 P61 D82 H83	R56-E80 IonicContact CZ-OE1 3.5Å; R56-E80 IonicContact NH2-OE1 2.7Å; R56-E80 PolarHBondContact NH2-OE1 3.15Å; P61-E80 HydrophobicContact CG-CG 3.7Å; E80-D82 PolarHBondContact O-N 3.07Å; E80-H83 WeakPolarHBondContact O-CB 3.38Å; E80-H83 PolarHBondContact O-N 3.36Å
81	A	91.6	Very high	91.6	Very high	71 Å²	71	50.4 Å²	50.4	59%	0.587	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-13.7	172.9	0	0	0	0	0	114.3	D79 K85	D79-A81 PolarHBondContact O-N 3.31Å; A81-K85 WeakPolarHBondContact O-CE 3.37Å
82	D	92.1	Very high	91.9	Very high	11 Å²	11	50.7 Å²	50.7	6%	0.059	28%	0.277	C	S	.	.	H	α-helix	trans	-79.6	-19.9	176.8	-65.2	-35.5	0	0	0	112.8	F8 W54 F78 D79 E80 E84 K85 L86	F8-D82 HydrophobicContact CE1-CB 4.08Å; W54-D82 HydrophobicContact CH2-CB 4.43Å; F78-D82 HydrophobicContact CB-CB 4.21Å; F78-D82 HydrophobicContact CD1-CB 4.48Å; D79-D82 PolarHBondContact N-OD2 2.97Å; D79-D82 WeakPolarHBondContact O-CB 3.26Å; D79-D82 PolarHBondContact O-N 2.73Å; E80-D82 PolarHBondContact O-N 3.07Å; D82-E84 PolarHBondContact O-N 3.06Å; D82-K85 WeakPolarHBondContact O-CB 3.27Å; D82-K85 PolarHBondContact O-N 2.69Å; D82-K85 VanDerWaalsContact O-N 3.16Å; D82-K85 WeakPolarHBondContact OD1-CD 3.06Å; D82-K85 WeakPolarHBondContact OD1-CE 3.46Å; D82-K85 IonicContact OD1-NZ 2.77Å; D82-K85 PolarHBondContact OD1-NZ 3.28Å; D82-L86 HydrophobicContact CB-CD1 4.32Å; D82-L86 WeakPolarHBondContact O-CB 3.48Å; D82-L86 WeakPolarHBondContact O-CG 3.47Å; D82-L86 PolarHBondContact O-N 2.94Å
83	H	92.2	Very high	92	Very high	45 Å²	45	52.7 Å²	52.7	21%	0.208	29%	0.288	C	S	.	.	H	α-helix	trans	-52.7	-53.5	179.4	177.9	-110.3	0	0	0	112.1	W54 E80 K85 L86 K87	W54-H83 AromaticContact CD1-CD2 3.38Å; W54-H83 AromaticContact CD2-CD2 3.75Å; W54-H83 AromaticContact CE2-CD2 3.74Å; W54-H83 AromaticContact CG-CD2 3.5Å; W54-H83 VanDerWaalsContact CG-CD2 3.5Å; W54-H83 HydrophobicContact CH2-CB 4.46Å; W54-H83 HydrophobicContact CZ2-CB 3.77Å; W54-H83 AromaticContact NE1-CD2 3.53Å; W54-H83 AromaticContact NE1-CG 3.92Å; E80-H83 WeakPolarHBondContact O-CB 3.38Å; E80-H83 PolarHBondContact O-N 3.36Å; H83-K85 VanDerWaalsContact C-N 3.35Å; H83-K85 PolarHBondContact O-N 2.88Å; H83-L86 PolarHBondContact O-N 3.43Å; H83-K87 WeakPolarHBondContact NE2-CD 3.42Å; H83-K87 WeakPolarHBondContact O-CB 3.42Å; H83-K87 PolarHBondContact O-N 2.94Å
84	E	92.7	Very high	92.1	Very high	88 Å²	88	52.6 Å²	52.6	41%	0.411	29%	0.287	S	S	.	.	H	α-helix	trans	-71	-29.2	-178.8	-65.2	-57.9	132.6	0	0	112.6	D82 K87 T88	D82-E84 PolarHBondContact O-N 3.06Å; E84-K87 IonicContact OE1-NZ 3.14Å; E84-K87 PolarHBondContact OE1-NZ 3.49Å; E84-K87 IonicContact OE2-NZ 2.67Å; E84-K87 PolarHBondContact OE2-NZ 3.12Å; E84-T88 VanDerWaalsContact O-CB 3.25Å; E84-T88 WeakPolarHBondContact O-CB 3.37Å; E84-T88 PolarHBondContact O-N 3.24Å; E84-T88 PolarHBondContact O-OG1 3.28Å
85	K	92.1	Very high	92	Very high	103 Å²	103	59 Å²	59	45%	0.448	32%	0.318	S	S	.	.	H	α-helix	trans	-63.7	-50.9	172.9	-55.6	175.7	-162.2	163.2	0	110.4	A81 D82 H83 T88 F89	A81-K85 WeakPolarHBondContact O-CE 3.37Å; D82-K85 WeakPolarHBondContact O-CB 3.27Å; D82-K85 PolarHBondContact O-N 2.69Å; D82-K85 VanDerWaalsContact O-N 3.16Å; D82-K85 WeakPolarHBondContact OD1-CD 3.06Å; D82-K85 WeakPolarHBondContact OD1-CE 3.46Å; D82-K85 IonicContact OD1-NZ 2.77Å; D82-K85 PolarHBondContact OD1-NZ 3.28Å; H83-K85 VanDerWaalsContact C-N 3.35Å; H83-K85 PolarHBondContact O-N 2.88Å; K85-T88 PolarHBondContact O-N 2.85Å; K85-F89 VanDerWaalsContact O-CB 3.3Å; K85-F89 WeakPolarHBondContact O-CB 3.18Å; K85-F89 PolarHBondContact O-N 3.44Å
86	L	93.3	Very high	91.9	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-65.5	-46.7	-179.4	-70.3	169	0	0	0	111.6	L6 F8 L26 W54 L63 F78 D82 H83 T88 F89 F90 L98	L6-L86 HydrophobicContact CD1-CD2 4.41Å; F8-L86 HydrophobicContact CE2-CD2 3.81Å; F8-L86 HydrophobicContact CZ-CD2 3.73Å; F8-L86 HydrophobicContact CZ-CG 4.12Å; L26-L86 HydrophobicContact CD1-CD2 3.53Å; W54-L86 HydrophobicContact CE3-CD1 4.33Å; W54-L86 HydrophobicContact CH2-CD1 4.11Å; W54-L86 HydrophobicContact CZ3-CD1 3.52Å; L63-L86 HydrophobicContact CD2-CD1 4.28Å; L63-L86 HydrophobicContact CD2-CD2 4.35Å; F78-L86 HydrophobicContact CD1-CD1 4.23Å; F78-L86 HydrophobicContact CE1-CD1 4.39Å; D82-L86 HydrophobicContact CB-CD1 4.32Å; D82-L86 WeakPolarHBondContact O-CB 3.48Å; D82-L86 WeakPolarHBondContact O-CG 3.47Å; D82-L86 PolarHBondContact O-N 2.94Å; H83-L86 PolarHBondContact O-N 3.43Å; L86-T88 VanDerWaalsContact C-N 3.35Å; L86-T88 PolarHBondContact O-N 3.16Å; L86-F89 PolarHBondContact O-N 2.98Å; L86-F89 VanDerWaalsContact O-N 3.16Å; L86-F90 HydrophobicContact CB-CD2 4.43Å; L86-F90 HydrophobicContact CB-CE2 3.82Å; L86-F90 HydrophobicContact CB-CZ 4.17Å; L86-F90 HydrophobicContact CD2-CE2 4.44Å; L86-F90 HydrophobicContact CD2-CZ 3.93Å; L86-F90 WeakPolarHBondContact O-CD2 3.37Å; L86-F90 VanDerWaalsContact O-CG 3.27Å; L86-F90 WeakPolarHBondContact O-CG 3.47Å; L86-F90 PolarHBondContact O-N 3.3Å; L86-L98 HydrophobicContact CB-CD2 4.06Å
87	K	93.4	Very high	91.8	Very high	78 Å²	78	65.8 Å²	65.8	34%	0.339	35%	0.352	S	S	.	.	H	α-helix	trans	-58.1	-42.2	175.4	178.6	176.1	162.7	-141.8	0	112.7	H83 E84 K91 L98	H83-K87 WeakPolarHBondContact NE2-CD 3.42Å; H83-K87 WeakPolarHBondContact O-CB 3.42Å; H83-K87 PolarHBondContact O-N 2.94Å; E84-K87 IonicContact OE1-NZ 3.14Å; E84-K87 PolarHBondContact OE1-NZ 3.49Å; E84-K87 IonicContact OE2-NZ 2.67Å; E84-K87 PolarHBondContact OE2-NZ 3.12Å; K87-K91 WeakPolarHBondContact O-CB 3.27Å; K87-K91 PolarHBondContact O-N 3.09Å; K87-L98 HydrophobicContact CB-CB 4.18Å; K87-L98 HydrophobicContact CB-CD2 4.09Å; K87-L98 HydrophobicContact CG-CB 4.44Å
88	T	92.9	Very high	91.9	Very high	92 Å²	92	64.5 Å²	64.5	56%	0.564	34%	0.335	S	S	*	.	H	α-helix	trans	-66	-46.1	173.5	-57.9	0	0	0	0	110.9	E84 K85 L86 A92	E84-T88 VanDerWaalsContact O-CB 3.25Å; E84-T88 WeakPolarHBondContact O-CB 3.37Å; E84-T88 PolarHBondContact O-N 3.24Å; E84-T88 PolarHBondContact O-OG1 3.28Å; K85-T88 PolarHBondContact O-N 2.85Å; L86-T88 VanDerWaalsContact C-N 3.35Å; L86-T88 PolarHBondContact O-N 3.16Å; T88-A92 VanDerWaalsContact O-CB 3.29Å; T88-A92 WeakPolarHBondContact O-CB 3.22Å; T88-A92 PolarHBondContact O-N 2.95Å
89	F	92.8	Very high	91.9	Very high	9 Å²	9	69.6 Å²	69.6	4%	0.039	36%	0.359	C	S	.	.	H	α-helix	trans	-62.1	-47.9	-179.6	168.2	-95.7	0	0	0	113.1	V5 L6 L26 T27 K85 L86 A92 N93 W94	V5-F89 HydrophobicContact CB-CD2 4.04Å; V5-F89 HydrophobicContact CB-CE2 3.69Å; V5-F89 HydrophobicContact CG1-CD2 3.71Å; V5-F89 HydrophobicContact CG1-CE2 3.84Å; V5-F89 HydrophobicContact CG2-CE2 4.14Å; L6-F89 HydrophobicContact CD1-CB 3.66Å; L6-F89 HydrophobicContact CD1-CD1 4.38Å; L6-F89 HydrophobicContact CD1-CD2 4.25Å; L6-F89 HydrophobicContact CD1-CG 3.82Å; L6-F89 HydrophobicContact CG-CD2 4.45Å; L26-F89 HydrophobicContact CB-CD1 4.42Å; L26-F89 HydrophobicContact CB-CE1 3.74Å; L26-F89 HydrophobicContact CB-CE2 4.36Å; L26-F89 HydrophobicContact CB-CZ 3.71Å; L26-F89 HydrophobicContact CD1-CD1 3.8Å; L26-F89 HydrophobicContact CD1-CE1 3.76Å; L26-F89 HydrophobicContact CG-CE1 4.28Å; T27-F89 WeakPolarHBondContact O-CZ 3.45Å; K85-F89 VanDerWaalsContact O-CB 3.3Å; K85-F89 WeakPolarHBondContact O-CB 3.18Å; K85-F89 PolarHBondContact O-N 3.44Å; L86-F89 PolarHBondContact O-N 2.98Å; L86-F89 VanDerWaalsContact O-N 3.16Å; F89-A92 PolarHBondContact O-N 2.98Å; F89-N93 HydrophobicContact CD2-CB 4.45Å; F89-N93 WeakPolarHBondContact CD2-ND2 3.39Å; F89-N93 HydrophobicContact CE2-CB 3.98Å; F89-N93 WeakPolarHBondContact CE2-ND2 3.34Å; F89-N93 HydrophobicContact CZ-CB 4.24Å; F89-N93 WeakPolarHBondContact O-CB 3.19Å; F89-N93 PolarHBondContact O-N 3.29Å; F89-N93 PolarHBondContact O-ND2 3.48Å; F89-W94 HydrophobicContact CE1-CD2 4.18Å; F89-W94 AromaticContact CE1-CE2 3.66Å; F89-W94 HydrophobicContact CE1-CH2 4.16Å; F89-W94 AromaticContact CE1-CZ2 3.65Å; F89-W94 HydrophobicContact CE1-CZ2 3.65Å; F89-W94 AromaticContact CE1-NE1 3.99Å; F89-W94 AromaticContact CZ-CE2 3.85Å; F89-W94 AromaticContact CZ-CZ2 3.97Å; F89-W94 HydrophobicContact CZ-CZ2 3.97Å; F89-W94 AromaticContact CZ-NE1 3.74Å
90	F	93.1	Very high	91.9	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-64.7	-42.9	-180	-59.7	-38.9	0	0	0	111.9	L26 C52 L63 F65 L86 A92 W94 H95 L96 L98	L26-F90 HydrophobicContact CD1-CE1 4.17Å; C52-F90 HydrophobicContact CB-CD2 4.32Å; C52-F90 HydrophobicContact CB-CE2 4.4Å; L63-F90 HydrophobicContact CD1-CE2 3.74Å; L63-F90 HydrophobicContact CD1-CZ 3.87Å; L63-F90 HydrophobicContact CD2-CZ 3.94Å; F65-F90 HydrophobicContact CE1-CE1 4.03Å; F65-F90 HydrophobicContact CE1-CE2 4.43Å; F65-F90 AromaticContact CE1-CZ 3.74Å; F65-F90 HydrophobicContact CE1-CZ 3.74Å; F65-F90 HydrophobicContact CZ-CE1 4.15Å; F65-F90 AromaticContact CZ-CZ 3.99Å; F65-F90 HydrophobicContact CZ-CZ 3.99Å; L86-F90 HydrophobicContact CB-CD2 4.43Å; L86-F90 HydrophobicContact CB-CE2 3.82Å; L86-F90 HydrophobicContact CB-CZ 4.17Å; L86-F90 HydrophobicContact CD2-CE2 4.44Å; L86-F90 HydrophobicContact CD2-CZ 3.93Å; L86-F90 WeakPolarHBondContact O-CD2 3.37Å; L86-F90 VanDerWaalsContact O-CG 3.27Å; L86-F90 WeakPolarHBondContact O-CG 3.47Å; L86-F90 PolarHBondContact O-N 3.3Å; F90-A92 VanDerWaalsContact C-N 3.34Å; F90-A92 PolarHBondContact O-N 2.91Å; F90-W94 AromaticContact CD1-CD2 3.99Å; F90-W94 HydrophobicContact CD1-CD2 3.99Å; F90-W94 AromaticContact CD1-CE3 3.36Å; F90-W94 HydrophobicContact CD1-CE3 3.36Å; F90-W94 HydrophobicContact CD1-CH2 4.16Å; F90-W94 AromaticContact CD1-CZ3 3.47Å; F90-W94 HydrophobicContact CD1-CZ3 3.47Å; F90-W94 VanDerWaalsContact CD1-CZ3 3.47Å; F90-W94 AromaticContact CE1-CE3 3.76Å; F90-W94 HydrophobicContact CE1-CE3 3.76Å; F90-W94 AromaticContact CE1-CH2 3.75Å; F90-W94 HydrophobicContact CE1-CH2 3.75Å; F90-W94 AromaticContact CE1-CZ3 3.31Å; F90-W94 HydrophobicContact CE1-CZ3 3.31Å; F90-W94 HydrophobicContact CG-CE3 4.31Å; F90-W94 HydrophobicContact CZ-CZ3 4.34Å; F90-W94 CarbonylContact O-C 3.37Å; F90-W94 WeakPolarHBondContact O-CA 3.43Å; F90-W94 PolarHBondContact O-N 2.72Å; F90-H95 PolarHBondContact O-N 2.74Å; F90-L96 CarbonylContact C-O 3.6Å; F90-L96 WeakPolarHBondContact CB-O 3.4Å; F90-L96 PolarHBondContact O-N 3.05Å; F90-L98 HydrophobicContact CD2-CB 4.19Å; F90-L98 HydrophobicContact CD2-CD1 4.28Å; F90-L98 HydrophobicContact CD2-CD2 4.41Å; F90-L98 HydrophobicContact CE2-CD1 4Å; F90-L98 HydrophobicContact CE2-CD2 4.22Å
91	K	92.1	Very high	91.8	Very high	146 Å²	146	63.6 Å²	63.6	64%	0.635	33%	0.331	S	S	*	.	H	α-helix	trans	-62.9	-40.5	177.2	-173.4	174	-178.1	176	0	112.2	K87 H95 L96	K87-K91 WeakPolarHBondContact O-CB 3.27Å; K87-K91 PolarHBondContact O-N 3.09Å; K91-H95 PolarHBondContact O-ND1 3.42Å; K91-L96 PolarHBondContact N-O 3.21Å
92	A	90.9	Very high	91.7	Very high	63 Å²	63	65.4 Å²	65.4	52%	0.521	33%	0.331	S	S	.	.	H	α-helix	trans	-73.3	-44.5	-179	0	0	0	0	0	113.4	T88 F89 F90 H95	T88-A92 VanDerWaalsContact O-CB 3.29Å; T88-A92 WeakPolarHBondContact O-CB 3.22Å; T88-A92 PolarHBondContact O-N 2.95Å; F89-A92 PolarHBondContact O-N 2.98Å; F90-A92 VanDerWaalsContact C-N 3.34Å; F90-A92 PolarHBondContact O-N 2.91Å; A92-H95 PolarHBondContact O-CE1 3.17Å
93	N	90.4	Very high	91.5	Very high	56 Å²	56	67.7 Å²	67.7	30%	0.299	34%	0.343	S	S	.	.	H	α-helix	trans	-104.6	-34.4	-166.9	-60.1	-87.8	0	0	0	114.2	F89	F89-N93 HydrophobicContact CD2-CB 4.45Å; F89-N93 WeakPolarHBondContact CD2-ND2 3.39Å; F89-N93 HydrophobicContact CE2-CB 3.98Å; F89-N93 WeakPolarHBondContact CE2-ND2 3.34Å; F89-N93 HydrophobicContact CZ-CB 4.24Å; F89-N93 WeakPolarHBondContact O-CB 3.19Å; F89-N93 PolarHBondContact O-N 3.29Å; F89-N93 PolarHBondContact O-ND2 3.48Å
94	W	91.5	Very high	91.4	Very high	24 Å²	24	66 Å²	66	9%	0.091	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.3	-8.6	-176.4	-57	-11.1	0	0	0	112.7	L26 T27 E28 A31 A46 I49 F65 F89 F90 L96	L26-W94 HydrophobicContact CD2-CH2 4.1Å; L26-W94 HydrophobicContact CD2-CZ2 4.41Å; T27-W94 PolarHBondContact O-NE1 3.01Å; T27-W94 VanDerWaalsContact O-NE1 3.14Å; E28-W94 VanDerWaalsContact O-CD1 3.29Å; E28-W94 PolarHBondContact O-NE1 2.82Å; A31-W94 HydrophobicContact CB-CH2 4.08Å; A46-W94 HydrophobicContact CB-CB 4.45Å; A46-W94 HydrophobicContact CB-CD2 3.74Å; A46-W94 HydrophobicContact CB-CE3 4.44Å; A46-W94 HydrophobicContact CB-CG 3.7Å; A46-W94 HydrophobicContact CB-CZ2 4.37Å; I49-W94 HydrophobicContact CD1-CE3 4.02Å; I49-W94 HydrophobicContact CD1-CH2 4.06Å; I49-W94 HydrophobicContact CD1-CZ3 3.49Å; I49-W94 VanDerWaalsContact CD1-CZ3 3.49Å; F65-W94 HydrophobicContact CE1-CH2 4.45Å; F65-W94 AromaticContact CE1-CZ3 3.84Å; F65-W94 HydrophobicContact CE1-CZ3 3.84Å; F65-W94 HydrophobicContact CZ-CH2 4Å; F65-W94 AromaticContact CZ-CZ3 3.85Å; F65-W94 HydrophobicContact CZ-CZ3 3.85Å; F89-W94 HydrophobicContact CE1-CD2 4.18Å; F89-W94 AromaticContact CE1-CE2 3.66Å; F89-W94 HydrophobicContact CE1-CH2 4.16Å; F89-W94 AromaticContact CE1-CZ2 3.65Å; F89-W94 HydrophobicContact CE1-CZ2 3.65Å; F89-W94 AromaticContact CE1-NE1 3.99Å; F89-W94 AromaticContact CZ-CE2 3.85Å; F89-W94 AromaticContact CZ-CZ2 3.97Å; F89-W94 HydrophobicContact CZ-CZ2 3.97Å; F89-W94 AromaticContact CZ-NE1 3.74Å; F90-W94 AromaticContact CD1-CD2 3.99Å; F90-W94 HydrophobicContact CD1-CD2 3.99Å; F90-W94 AromaticContact CD1-CE3 3.36Å; F90-W94 HydrophobicContact CD1-CE3 3.36Å; F90-W94 HydrophobicContact CD1-CH2 4.16Å; F90-W94 AromaticContact CD1-CZ3 3.47Å; F90-W94 HydrophobicContact CD1-CZ3 3.47Å; F90-W94 VanDerWaalsContact CD1-CZ3 3.47Å; F90-W94 AromaticContact CE1-CE3 3.76Å; F90-W94 HydrophobicContact CE1-CE3 3.76Å; F90-W94 AromaticContact CE1-CH2 3.75Å; F90-W94 HydrophobicContact CE1-CH2 3.75Å; F90-W94 AromaticContact CE1-CZ3 3.31Å; F90-W94 HydrophobicContact CE1-CZ3 3.31Å; F90-W94 HydrophobicContact CG-CE3 4.31Å; F90-W94 HydrophobicContact CZ-CZ3 4.34Å; F90-W94 CarbonylContact O-C 3.37Å; F90-W94 WeakPolarHBondContact O-CA 3.43Å; F90-W94 PolarHBondContact O-N 2.72Å; W94-L96 HydrophobicContact CB-CD1 4.37Å; W94-L96 HydrophobicContact CB-CG 4.32Å; W94-L96 HydrophobicContact CE3-CD1 4.38Å; W94-L96 PolarHBondContact O-N 2.99Å
95	H	89.8	Confident	91.1	Very high	153 Å²	153	67.6 Å²	67.6	71%	0.708	36%	0.355	S	S	*	.			trans	57.3	22.5	-174.3	-49.9	-39.7	0	0	0	114.7	F90 K91 A92	F90-H95 PolarHBondContact O-N 2.74Å; K91-H95 PolarHBondContact O-ND1 3.42Å; A92-H95 PolarHBondContact O-CE1 3.17Å
96	L	90.7	Very high	90.9	Very high	36 Å²	36	67.9 Å²	67.9	19%	0.188	36%	0.357	C	S	.	.			trans	-95.3	144.8	175.4	-65.3	175.8	0	0	0	111.1	I49 F90 K91 W94	I49-L96 HydrophobicContact CB-CD1 4.03Å; I49-L96 HydrophobicContact CG2-CD1 3.67Å; F90-L96 CarbonylContact C-O 3.6Å; F90-L96 WeakPolarHBondContact CB-O 3.4Å; F90-L96 PolarHBondContact O-N 3.05Å; K91-L96 PolarHBondContact N-O 3.21Å; W94-L96 HydrophobicContact CB-CD1 4.37Å; W94-L96 HydrophobicContact CB-CG 4.32Å; W94-L96 HydrophobicContact CE3-CD1 4.38Å; W94-L96 PolarHBondContact O-N 2.99Å
97	N	91.9	Very high	90.7	Very high	113 Å²	113	71 Å²	71	60%	0.604	39%	0.389	S	S	*	.			trans	-84.9	148.8	169.9	-67.7	-45.1	0	0	0	110.4
98	L	93	Very high	90.6	Very high	16 Å²	16	68.4 Å²	68.4	8%	0.084	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	106.8	170.1	-173.8	55.7	0	0	0	108.9	C52 W54 L63 L86 K87 F90	C52-L98 HydrophobicContact CB-CD1 3.96Å; W54-L98 HydrophobicContact CB-CD1 3.92Å; W54-L98 HydrophobicContact CB-CD2 4.22Å; W54-L98 HydrophobicContact CB-CG 3.91Å; W54-L98 HydrophobicContact CE3-CD2 4.38Å; L63-L98 HydrophobicContact CD1-CD1 3.86Å; L86-L98 HydrophobicContact CB-CD2 4.06Å; K87-L98 HydrophobicContact CB-CB 4.18Å; K87-L98 HydrophobicContact CB-CD2 4.09Å; K87-L98 HydrophobicContact CG-CB 4.44Å; F90-L98 HydrophobicContact CD2-CB 4.19Å; F90-L98 HydrophobicContact CD2-CD1 4.28Å; F90-L98 HydrophobicContact CD2-CD2 4.41Å; F90-L98 HydrophobicContact CE2-CD1 4Å; F90-L98 HydrophobicContact CE2-CD2 4.22Å
99	E	91.9	Very high	90.5	Very high	112 Å²	112	71.3 Å²	71.3	52%	0.523	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	124.1	-177	-63.3	-172	178.2	0	0	111.1	C52 H53 W54 K101	C52-E99 PolarHBondContact O-N 3.13Å; H53-E99 CarbonylContact C-O 3.59Å; H53-E99 VanDerWaalsContact CA-O 3.3Å; H53-E99 WeakPolarHBondContact CA-O 3.28Å; W54-E99 PolarHBondContact N-O 2.94Å; E99-K101 PolarHBondContact O-N 2.89Å
100	T	91.5	Very high	90.4	Very high	73 Å²	73	77.6 Å²	77.6	45%	0.448	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	106.8	177.9	-62.2	0	0	0	0	110.7	W54	W54-T100 CarbonylContact O-C 3.54Å; W54-T100 WeakPolarHBondContact O-CA 3.48Å
101	K	88.8	Confident	90.4	Very high	46 Å²	46	79.4 Å²	79.4	20%	0.2	44%	0.435	C	S	.	.			trans	-79.7	121.6	170.9	-84.9	-154	169.1	-162.5	0	110.6	W54 E99 E121 E123	W54-K101 PolarHBondContact O-N 3.41Å; E99-K101 PolarHBondContact O-N 2.89Å; K101-E121 IonicContact NZ-OE1 2.69Å; K101-E121 PolarHBondContact NZ-OE1 3.46Å; K101-E121 IonicContact NZ-OE2 3.63Å; K101-E121 PolarHBondContact NZ-OE2 2.93Å; K101-E123 IonicContact NZ-OE1 3.82Å; K101-E123 PolarHBondContact NZ-OE1 3.27Å
102	N	88.9	Confident	90.3	Very high	109 Å²	109	74.9 Å²	74.9	58%	0.583	43%	0.425	S	S	*	.			trans	-71.9	144.1	173.8	-69	-47.6	0	0	0	111.2	Q127 L128	N102-Q127 HydrophobicContact CB-CG 4.28Å; N102-L128 PolarHBondContact O-N 2.89Å
103	I	88.3	Confident	90.3	Very high	60 Å²	60	72.9 Å²	72.9	31%	0.308	41%	0.405	S	S	.	.	B	Isolated β-bridge	trans	-109.4	135.8	-178.6	-70.6	169.2	0	0	0	110.6	R56 C105 L128	R56-I103 HydrophobicContact CB-CD1 3.84Å; I103-C105 PolarHBondContact O-N 2.75Å; I103-C105 VanDerWaalsContact O-N 3.12Å; I103-L128 CarbonylContact C-O 3.55Å; I103-L128 VanDerWaalsContact CA-O 3.26Å; I103-L128 WeakPolarHBondContact CA-O 3.4Å
104	C	88.7	Confident	90.3	Very high	9 Å²	9	74 Å²	74	6%	0.061	41%	0.407	C	S	.	.			trans	-81.9	88.3	-177	-164.1	0	0	0	0	111.9	K106 Q127 L128 I129	C104-K106 PolarHBondContact O-N 3.23Å; C104-K106 VanDerWaalsContact O-N 3.15Å; C104-Q127 HydrophobicContact CB-CB 3.7Å; C104-L128 PolarHBondContact N-O 3.33Å; C104-I129 HydrophobicContact CB-CG1 3.73Å
105	C	86.3	Confident	90.1	Very high	121 Å²	121	75.2 Å²	75.2	82%	0.818	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	8.4	176.6	-62.3	0	0	0	0	114.5	I103 G107	I103-C105 PolarHBondContact O-N 2.75Å; I103-C105 VanDerWaalsContact O-N 3.12Å; C105-G107 VanDerWaalsContact C-N 3.3Å; C105-G107 PolarHBondContact O-N 3.26Å
106	K	89.1	Confident	89.9	Confident	110 Å²	110	69.9 Å²	69.9	48%	0.478	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-18	-175.1	-62.3	-172.9	-172.7	-170.9	0	114.5	C104 V108 H124 E125	C104-K106 PolarHBondContact O-N 3.23Å; C104-K106 VanDerWaalsContact O-N 3.15Å; K106-V108 VanDerWaalsContact C-N 3.34Å; K106-V108 HydrophobicContact CB-CG1 4.05Å; K106-V108 HydrophobicContact CB-CG2 4.45Å; K106-H124 PolarHBondContact NZ-NE2 2.85Å; K106-E125 IonicContact NZ-OE1 3.8Å; K106-E125 PolarHBondContact NZ-OE1 2.7Å; K106-E125 IonicContact NZ-OE2 3.59Å; K106-E125 PolarHBondContact NZ-OE2 3.14Å
107	G	88	Confident	89.5	Confident	66 Å²	66	69.4 Å²	69.4	68%	0.68	39%	0.393	S	S	*	.			trans	71.6	24.5	-175.2	0	0	0	0	0	114.5	C105	C105-G107 VanDerWaalsContact C-N 3.3Å; C105-G107 PolarHBondContact O-N 3.26Å
108	V	91.5	Very high	89.2	Confident	22 Å²	22	65.1 Å²	65.1	13%	0.133	37%	0.372	C	S	.	.			trans	-78.5	146.4	176.4	-67.1	0	0	0	0	111.7	K106 Y110 H124 I129	K106-V108 VanDerWaalsContact C-N 3.34Å; K106-V108 HydrophobicContact CB-CG1 4.05Å; K106-V108 HydrophobicContact CB-CG2 4.45Å; V108-Y110 HydrophobicContact CB-CD1 4.14Å; V108-Y110 HydrophobicContact CB-CE1 3.82Å; V108-Y110 HydrophobicContact CG1-CE1 3.77Å; V108-H124 HydrophobicContact CG2-CB 4.09Å; V108-I129 HydrophobicContact CG2-CD1 4.04Å
109	N	91	Very high	89	Confident	154 Å²	154	64.3 Å²	64.3	82%	0.824	37%	0.368	S	S	*	.	S	Bend	trans	-109.1	17.6	179.6	-62	-53.6	0	0	0	112.8
110	Y	91.3	Very high	89	Confident	140 Å²	140	59 Å²	59	55%	0.549	34%	0.343	S	S	.	.			trans	-132.3	147.3	-179	57.3	-90.1	0	0	0	109.5	V108 H124	V108-Y110 HydrophobicContact CB-CD1 4.14Å; V108-Y110 HydrophobicContact CB-CE1 3.82Å; V108-Y110 HydrophobicContact CG1-CE1 3.77Å; Y110-H124 AromaticContact CD2-CE1 3.94Å; Y110-H124 AromaticContact CD2-ND1 3.86Å; Y110-H124 AromaticContact CE2-CE1 3.1Å; Y110-H124 WeakPolarHBondContact CE2-CE1 3.43Å; Y110-H124 AromaticContact CE2-ND1 3.66Å; Y110-H124 AromaticContact CZ-CE1 3.91Å
111	G	92.3	Very high	89	Confident	39 Å²	39	55.9 Å²	55.9	40%	0.402	32%	0.324	S	S	.	.			trans	168.1	179.8	-170.2	0	0	0	0	0	111.2	F122 E123	G111-F122 WeakPolarHBondContact O-CE2 3.34Å; G111-E123 CarbonylContact C-O 3.46Å; G111-E123 WeakPolarHBondContact CA-O 3.17Å
112	A	90.9	Very high	89.2	Confident	51 Å²	51	54.6 Å²	54.6	42%	0.421	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	141.8	176.9	0	0	0	0	0	111.4	F122 E123	A112-F122 WeakPolarHBondContact O-CA 2.99Å; A112-E123 PolarHBondContact N-O 2.77Å; A112-E123 PolarHBondContact O-N 3.02Å
113	L	90	Very high	89.4	Confident	21 Å²	21	50.1 Å²	50.1	11%	0.11	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	107	170.3	-73.9	170.5	0	0	0	109.8	L120 F122 L147 F166 Y181	L113-L120 HydrophobicContact CB-CD1 4.27Å; L113-L120 HydrophobicContact CD2-CD1 4Å; L113-L120 HydrophobicContact CD2-CD2 4.22Å; L113-L120 HydrophobicContact CD2-CG 4.06Å; L113-F122 HydrophobicContact CD2-CB 4.2Å; L113-F122 HydrophobicContact CD2-CD2 3.65Å; L113-F122 HydrophobicContact CD2-CE2 4.49Å; L113-F122 HydrophobicContact CD2-CG 4.32Å; L113-F122 HydrophobicContact CG-CD2 3.99Å; L113-F122 HydrophobicContact CG-CE2 4.47Å; L113-L147 HydrophobicContact CD1-CD2 4.26Å; L113-F166 HydrophobicContact CD1-CD1 4.3Å; L113-F166 HydrophobicContact CD1-CE1 4.47Å; L113-F166 HydrophobicContact CD1-CG 4.32Å; L113-F166 HydrophobicContact CD2-CD1 4.33Å; L113-F166 HydrophobicContact CD2-CE1 3.72Å; L113-F166 HydrophobicContact CD2-CE2 4.42Å; L113-F166 HydrophobicContact CD2-CZ 3.78Å; L113-F166 HydrophobicContact CG-CE1 4.49Å; L113-Y181 HydrophobicContact CB-CD1 4.4Å; L113-Y181 HydrophobicContact CB-CE1 3.68Å; L113-Y181 HydrophobicContact CD1-CD1 4.26Å; L113-Y181 HydrophobicContact CD1-CE1 4.17Å
114	K	90.5	Very high	89.6	Confident	78 Å²	78	48.8 Å²	48.8	34%	0.339	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	150.8	174.9	-59.2	-175.8	-168.2	167.7	0	109.9	E121 E123 D126	K114-E121 PolarHBondContact N-O 2.59Å; K114-E121 PolarHBondContact O-N 2.83Å; K114-E123 VanDerWaalsContact CD-OE2 3.3Å; K114-E123 WeakPolarHBondContact CD-OE2 3.49Å; K114-E123 VanDerWaalsContact CE-OE2 3.26Å; K114-E123 WeakPolarHBondContact CE-OE2 3.4Å; K114-E123 IonicContact NZ-OE2 3.7Å; K114-E123 PolarHBondContact NZ-OE2 3.03Å; K114-D126 IonicContact NZ-OD1 2.66Å; K114-D126 PolarHBondContact NZ-OD1 3.14Å
115	F	87.8	Confident	89.7	Confident	51 Å²	51	53.9 Å²	53.9	22%	0.224	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	112.9	177.9	-68.9	-97.6	0	0	0	111	L120 L134 Y181 K184 I185 K188	F115-L120 HydrophobicContact CD1-CD1 3.99Å; F115-L120 HydrophobicContact CD2-CD1 4.41Å; F115-L120 HydrophobicContact CE1-CD1 3.79Å; F115-L120 HydrophobicContact CE2-CD1 4.21Å; F115-L120 HydrophobicContact CG-CD1 4.31Å; F115-L120 HydrophobicContact CZ-CD1 3.9Å; F115-L134 HydrophobicContact CD1-CD1 4.08Å; F115-L134 HydrophobicContact CE1-CD1 4.13Å; F115-Y181 AromaticContact CE2-CD1 3.89Å; F115-Y181 HydrophobicContact CE2-CD1 3.89Å; F115-Y181 AromaticContact CE2-CE1 4Å; F115-Y181 HydrophobicContact CE2-CE1 4Å; F115-Y181 HydrophobicContact CZ-CD1 4.1Å; F115-K184 HydrophobicContact CE1-CB 4.21Å; F115-K184 HydrophobicContact CE2-CB 4.04Å; F115-K184 HydrophobicContact CE2-CD 4.27Å; F115-K184 HydrophobicContact CZ-CB 3.61Å; F115-I185 HydrophobicContact CE1-CG1 3.78Å; F115-I185 HydrophobicContact CZ-CG1 3.9Å; F115-K188 HydrophobicContact CB-CD 4.4Å; F115-K188 HydrophobicContact CD1-CD 3.84Å; F115-K188 HydrophobicContact CE1-CD 4.49Å; F115-K188 HydrophobicContact CG-CD 4.42Å
116	L	85.3	Confident	89.7	Confident	41 Å²	41	54.1 Å²	54.1	22%	0.215	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	104.9	176.8	179.1	70.6	0	0	0	109.2	L66 M72 S118 N119 E121	L66-L116 HydrophobicContact CD1-CG 4.49Å; L66-L116 HydrophobicContact CD2-CD1 3.81Å; L66-L116 HydrophobicContact CD2-CD2 4.43Å; L66-L116 HydrophobicContact CD2-CG 3.94Å; M72-L116 HydrophobicContact CE-CD2 3.72Å; L116-S118 PolarHBondContact O-N 3.1Å; L116-N119 PolarHBondContact N-O 3.31Å; L116-N119 WeakPolarHBondContact O-CA 3.4Å; L116-N119 WeakPolarHBondContact O-CB 3.39Å; L116-N119 PolarHBondContact O-N 3.22Å; L116-E121 HydrophobicContact CB-CG 4.27Å; L116-E121 WeakPolarHBondContact CB-OE2 3.46Å
117	G	82.6	Confident	89.8	Confident	25 Å²	25	51.7 Å²	51.7	26%	0.258	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.8	-123.9	-169.8	0	0	0	0	0	111.4	K188	G117-K188 WeakPolarHBondContact O-CD 3.5Å; G117-K188 WeakPolarHBondContact O-CE 3.44Å; G117-K188 PolarHBondContact O-NZ 2.82Å
118	S	85.4	Confident	89.9	Confident	23 Å²	23	48.8 Å²	48.8	16%	0.161	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	31.2	169.4	-68.6	0	0	0	0	112.7	G70 L116 L134 K188	G70-S118 WeakPolarHBondContact O-CA 3.3Å; G70-S118 WeakPolarHBondContact O-CB 3.46Å; G70-S118 PolarHBondContact O-N 2.84Å; L116-S118 PolarHBondContact O-N 3.1Å; S118-L134 VanDerWaalsContact O-CB 3.26Å; S118-L134 WeakPolarHBondContact O-CB 3.48Å; S118-L134 WeakPolarHBondContact O-CG 3.24Å; S118-L134 PolarHBondContact O-N 2.81Å; S118-K188 VanDerWaalsContact CB-O 3.3Å; S118-K188 WeakPolarHBondContact CB-O 3.48Å; S118-K188 PolarHBondContact OG-O 3.36Å
119	N	88.6	Confident	89.9	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	134.2	171.6	-159.7	54.8	0	0	0	109	M72 R74 L116 D131 I132	M72-N119 HydrophobicContact CB-CB 4.34Å; M72-N119 HydrophobicContact CE-CB 4.11Å; M72-N119 VanDerWaalsContact CE-ND2 3.27Å; M72-N119 WeakPolarHBondContact CE-ND2 3.49Å; M72-N119 PolarHBondContact SD-ND2 2.97Å; R74-N119 PolarHBondContact NH2-OD1 3.41Å; L116-N119 PolarHBondContact N-O 3.31Å; L116-N119 WeakPolarHBondContact O-CA 3.4Å; L116-N119 WeakPolarHBondContact O-CB 3.39Å; L116-N119 PolarHBondContact O-N 3.22Å; N119-D131 WeakPolarHBondContact ND2-CB 3.42Å; N119-D131 PolarHBondContact ND2-OD2 3.01Å; N119-I132 PolarHBondContact OD1-O 3.11Å
120	L	91.7	Very high	89.9	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	114.6	174.4	179.4	67.9	0	0	0	108.5	L113 F115 D131 I132 L134 L149 I185	L113-L120 HydrophobicContact CB-CD1 4.27Å; L113-L120 HydrophobicContact CD2-CD1 4Å; L113-L120 HydrophobicContact CD2-CD2 4.22Å; L113-L120 HydrophobicContact CD2-CG 4.06Å; F115-L120 HydrophobicContact CD1-CD1 3.99Å; F115-L120 HydrophobicContact CD2-CD1 4.41Å; F115-L120 HydrophobicContact CE1-CD1 3.79Å; F115-L120 HydrophobicContact CE2-CD1 4.21Å; F115-L120 HydrophobicContact CG-CD1 4.31Å; F115-L120 HydrophobicContact CZ-CD1 3.9Å; L120-D131 CarbonylContact O-C 3.58Å; L120-D131 VanDerWaalsContact O-CA 3.23Å; L120-D131 WeakPolarHBondContact O-CA 3.49Å; L120-I132 HydrophobicContact CB-CB 4.41Å; L120-I132 PolarHBondContact N-O 2.99Å; L120-I132 PolarHBondContact O-N 3.48Å; L120-L134 HydrophobicContact CB-CD2 3.74Å; L120-L134 HydrophobicContact CB-CG 4.21Å; L120-L134 HydrophobicContact CD2-CD2 4.33Å; L120-L149 HydrophobicContact CD2-CD2 3.83Å; L120-I185 HydrophobicContact CD2-CD1 4.11Å; L120-I185 HydrophobicContact CD2-CG1 4.47Å
121	E	92.5	Very high	89.9	Confident	8 Å²	8	39.7 Å²	39.7	4%	0.037	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	131.3	-177	-58.7	-168.2	118.3	0	0	109.6	K101 K114 L116 E123 L128 D131	K101-E121 IonicContact NZ-OE1 2.69Å; K101-E121 PolarHBondContact NZ-OE1 3.46Å; K101-E121 IonicContact NZ-OE2 3.63Å; K101-E121 PolarHBondContact NZ-OE2 2.93Å; K114-E121 PolarHBondContact N-O 2.59Å; K114-E121 PolarHBondContact O-N 2.83Å; L116-E121 HydrophobicContact CB-CG 4.27Å; L116-E121 WeakPolarHBondContact CB-OE2 3.46Å; E121-E123 HydrophobicContact CB-CG 4.32Å; E121-L128 HydrophobicContact CB-CD1 3.83Å; E121-L128 HydrophobicContact CG-CD1 4.31Å; E121-D131 HydrophobicContact CB-CB 4.39Å; E121-D131 HydrophobicContact CG-CB 3.9Å
122	F	93.4	Very high	89.7	Confident	18 Å²	18	38.2 Å²	38.2	8%	0.079	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	110.2	174.7	-171.2	-121.7	0	0	0	108.9	G111 A112 L113 I129 F130 F166	G111-F122 WeakPolarHBondContact O-CE2 3.34Å; A112-F122 WeakPolarHBondContact O-CA 2.99Å; L113-F122 HydrophobicContact CD2-CB 4.2Å; L113-F122 HydrophobicContact CD2-CD2 3.65Å; L113-F122 HydrophobicContact CD2-CE2 4.49Å; L113-F122 HydrophobicContact CD2-CG 4.32Å; L113-F122 HydrophobicContact CG-CD2 3.99Å; L113-F122 HydrophobicContact CG-CE2 4.47Å; F122-I129 HydrophobicContact CD1-CB 4.05Å; F122-I129 HydrophobicContact CD1-CD1 3.53Å; F122-I129 HydrophobicContact CD1-CG1 4.35Å; F122-I129 HydrophobicContact CD1-CG2 4.38Å; F122-I129 HydrophobicContact CE1-CD1 3.53Å; F122-I129 HydrophobicContact CG-CD1 4.44Å; F122-I129 HydrophobicContact CZ-CD1 4.45Å; F122-I129 WeakPolarHBondContact O-CB 3.49Å; F122-I129 PolarHBondContact O-N 3.44Å; F122-F130 HydrophobicContact CB-CD1 4.46Å; F122-F130 HydrophobicContact CB-CD2 4.05Å; F122-F130 HydrophobicContact CB-CE1 4.15Å; F122-F130 HydrophobicContact CB-CE2 3.68Å; F122-F130 HydrophobicContact CB-CG 4.42Å; F122-F130 HydrophobicContact CB-CZ 3.75Å; F122-F130 HydrophobicContact CD1-CD1 4.16Å; F122-F130 AromaticContact CD1-CE1 3.51Å; F122-F130 HydrophobicContact CD1-CE1 3.51Å; F122-F130 HydrophobicContact CD1-CE2 4.5Å; F122-F130 AromaticContact CD1-CZ 3.72Å; F122-F130 HydrophobicContact CD1-CZ 3.72Å; F122-F130 HydrophobicContact CE1-CE1 4.27Å; F122-F130 HydrophobicContact CG-CE1 4.15Å; F122-F130 HydrophobicContact CG-CE2 4.35Å; F122-F130 AromaticContact CG-CZ 3.91Å; F122-F130 HydrophobicContact CG-CZ 3.91Å; F122-F130 PolarHBondContact N-O 2.9Å; F122-F166 HydrophobicContact CD2-CE1 4.13Å; F122-F166 HydrophobicContact CE2-CD1 4.5Å; F122-F166 HydrophobicContact CE2-CE1 4.33Å; F122-F166 HydrophobicContact CG-CE1 4.3Å
123	E	93.4	Very high	89.6	Confident	16 Å²	16	36.5 Å²	36.5	8%	0.075	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	144.5	-169.1	-60.2	-168.4	158.3	0	0	112.1	K101 G111 A112 K114 E121 Q127 L128	K101-E123 IonicContact NZ-OE1 3.82Å; K101-E123 PolarHBondContact NZ-OE1 3.27Å; G111-E123 CarbonylContact C-O 3.46Å; G111-E123 WeakPolarHBondContact CA-O 3.17Å; A112-E123 PolarHBondContact N-O 2.77Å; A112-E123 PolarHBondContact O-N 3.02Å; K114-E123 VanDerWaalsContact CD-OE2 3.3Å; K114-E123 WeakPolarHBondContact CD-OE2 3.49Å; K114-E123 VanDerWaalsContact CE-OE2 3.26Å; K114-E123 WeakPolarHBondContact CE-OE2 3.4Å; K114-E123 IonicContact NZ-OE2 3.7Å; K114-E123 PolarHBondContact NZ-OE2 3.03Å; E121-E123 HydrophobicContact CB-CG 4.32Å; E123-Q127 WeakPolarHBondContact CA-O 3.43Å; E123-L128 HydrophobicContact CG-CD1 3.79Å
124	H	92.7	Very high	89.4	Confident	32 Å²	32	35.5 Å²	35.5	15%	0.148	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	125.7	176.2	170.3	77.4	0	0	0	109.1	K106 V108 Y110 D126 Q127 I129	K106-H124 PolarHBondContact NZ-NE2 2.85Å; V108-H124 HydrophobicContact CG2-CB 4.09Å; Y110-H124 AromaticContact CD2-CE1 3.94Å; Y110-H124 AromaticContact CD2-ND1 3.86Å; Y110-H124 AromaticContact CE2-CE1 3.1Å; Y110-H124 WeakPolarHBondContact CE2-CE1 3.43Å; Y110-H124 AromaticContact CE2-ND1 3.66Å; Y110-H124 AromaticContact CZ-CE1 3.91Å; H124-D126 PolarHBondContact O-N 3.06Å; H124-Q127 PolarHBondContact N-O 2.88Å; H124-Q127 WeakPolarHBondContact O-CB 3.47Å; H124-Q127 PolarHBondContact O-N 2.7Å; H124-I129 HydrophobicContact CB-CD1 3.75Å; H124-I129 HydrophobicContact CB-CG1 4.17Å
125	E	89.7	Confident	89	Confident	116 Å²	116	35 Å²	35	54%	0.542	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.9	41.5	-172.1	-65.1	166.9	-140.2	0	0	112.5	K106 Q127	K106-E125 IonicContact NZ-OE1 3.8Å; K106-E125 PolarHBondContact NZ-OE1 2.7Å; K106-E125 IonicContact NZ-OE2 3.59Å; K106-E125 PolarHBondContact NZ-OE2 3.14Å; E125-Q127 PolarHBondContact O-N 3.16Å
126	D	86.4	Confident	88.8	Confident	125 Å²	125	33.9 Å²	33.9	67%	0.668	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.1	21.5	-174.4	-59.8	-50	0	0	0	115.2	K114 H124	K114-D126 IonicContact NZ-OD1 2.66Å; K114-D126 PolarHBondContact NZ-OD1 3.14Å; H124-D126 PolarHBondContact O-N 3.06Å
127	Q	90.8	Very high	88.6	Confident	60 Å²	60	31.9 Å²	31.9	28%	0.28	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	134.8	165.8	-59.2	-177	-9.5	0	0	110	N102 C104 E123 H124 E125 I129	N102-Q127 HydrophobicContact CB-CG 4.28Å; C104-Q127 HydrophobicContact CB-CB 3.7Å; E123-Q127 WeakPolarHBondContact CA-O 3.43Å; H124-Q127 PolarHBondContact N-O 2.88Å; H124-Q127 WeakPolarHBondContact O-CB 3.47Å; H124-Q127 PolarHBondContact O-N 2.7Å; E125-Q127 PolarHBondContact O-N 3.16Å; Q127-I129 PolarHBondContact O-N 3.2Å
128	L	90.8	Very high	88.4	Confident	4 Å²	4	32.8 Å²	32.8	2%	0.021	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	119.4	-179.5	-172.9	65.3	0	0	0	110.9	N102 I103 C104 E121 E123 F130 D131	N102-L128 PolarHBondContact O-N 2.89Å; I103-L128 CarbonylContact C-O 3.55Å; I103-L128 VanDerWaalsContact CA-O 3.26Å; I103-L128 WeakPolarHBondContact CA-O 3.4Å; C104-L128 PolarHBondContact N-O 3.33Å; E121-L128 HydrophobicContact CB-CD1 3.83Å; E121-L128 HydrophobicContact CG-CD1 4.31Å; E123-L128 HydrophobicContact CG-CD1 3.79Å; L128-F130 WeakPolarHBondContact CD1-O 3.3Å; L128-D131 HydrophobicContact CD1-CB 4.22Å; L128-D131 HydrophobicContact CD2-CB 4.3Å
129	I	91.6	Very high	88	Confident	41 Å²	41	32.8 Å²	32.8	21%	0.21	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	-52.7	171.7	-55.8	165.8	0	0	0	108.6	C104 V108 F122 H124 Q127	C104-I129 HydrophobicContact CB-CG1 3.73Å; V108-I129 HydrophobicContact CG2-CD1 4.04Å; F122-I129 HydrophobicContact CD1-CB 4.05Å; F122-I129 HydrophobicContact CD1-CD1 3.53Å; F122-I129 HydrophobicContact CD1-CG1 4.35Å; F122-I129 HydrophobicContact CD1-CG2 4.38Å; F122-I129 HydrophobicContact CE1-CD1 3.53Å; F122-I129 HydrophobicContact CG-CD1 4.44Å; F122-I129 HydrophobicContact CZ-CD1 4.45Å; F122-I129 WeakPolarHBondContact O-CB 3.49Å; F122-I129 PolarHBondContact O-N 3.44Å; H124-I129 HydrophobicContact CB-CD1 3.75Å; H124-I129 HydrophobicContact CB-CG1 4.17Å; Q127-I129 PolarHBondContact O-N 3.2Å
130	F	90.5	Very high	87.8	Confident	69 Å²	69	33 Å²	33	30%	0.303	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-159	166.4	172.4	61.5	-104.3	0	0	0	110.9	F122 L128 I132 F166	F122-F130 HydrophobicContact CB-CD1 4.46Å; F122-F130 HydrophobicContact CB-CD2 4.05Å; F122-F130 HydrophobicContact CB-CE1 4.15Å; F122-F130 HydrophobicContact CB-CE2 3.68Å; F122-F130 HydrophobicContact CB-CG 4.42Å; F122-F130 HydrophobicContact CB-CZ 3.75Å; F122-F130 HydrophobicContact CD1-CD1 4.16Å; F122-F130 AromaticContact CD1-CE1 3.51Å; F122-F130 HydrophobicContact CD1-CE1 3.51Å; F122-F130 HydrophobicContact CD1-CE2 4.5Å; F122-F130 AromaticContact CD1-CZ 3.72Å; F122-F130 HydrophobicContact CD1-CZ 3.72Å; F122-F130 HydrophobicContact CE1-CE1 4.27Å; F122-F130 HydrophobicContact CG-CE1 4.15Å; F122-F130 HydrophobicContact CG-CE2 4.35Å; F122-F130 AromaticContact CG-CZ 3.91Å; F122-F130 HydrophobicContact CG-CZ 3.91Å; F122-F130 PolarHBondContact N-O 2.9Å; L128-F130 WeakPolarHBondContact CD1-O 3.3Å; F130-I132 HydrophobicContact CD2-CD1 4.02Å; F130-I132 HydrophobicContact CD2-CG1 4.06Å; F130-I132 HydrophobicContact CE2-CD1 3.63Å; F130-I132 HydrophobicContact CE2-CG1 4.18Å; F130-F166 HydrophobicContact CE2-CE1 4.25Å; F130-F166 AromaticContact CE2-CZ 3.9Å; F130-F166 HydrophobicContact CE2-CZ 3.9Å; F130-F166 AromaticContact CZ-CE1 3.68Å; F130-F166 HydrophobicContact CZ-CE1 3.68Å; F130-F166 AromaticContact CZ-CZ 3.73Å; F130-F166 HydrophobicContact CZ-CZ 3.73Å
131	D	90.3	Very high	87.5	Confident	15 Å²	15	34.9 Å²	34.9	8%	0.08	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	150.3	170.7	64.7	-39.8	0	0	0	113.4	R64 R74 N119 L120 E121 L128	R64-D131 IonicContact CZ-OD1 3.72Å; R64-D131 IonicContact CZ-OD2 2.63Å; R64-D131 IonicContact NH1-OD1 3.63Å; R64-D131 PolarHBondContact NH1-OD1 3.09Å; R64-D131 IonicContact NH1-OD2 2.64Å; R64-D131 PolarHBondContact NH1-OD2 3.05Å; R64-D131 IonicContact NH2-OD1 3.56Å; R74-D131 IonicContact CZ-OD1 3.53Å; R74-D131 IonicContact CZ-OD2 2.6Å; R74-D131 VanDerWaalsContact CZ-OD2 3.3Å; R74-D131 IonicContact NE-OD2 2.78Å; R74-D131 PolarHBondContact NH1-O 3.04Å; R74-D131 IonicContact NH1-OD1 3.56Å; R74-D131 PolarHBondContact NH2-O 3.19Å; R74-D131 IonicContact NH2-OD1 2.62Å; R74-D131 IonicContact NH2-OD2 2.96Å; R74-D131 PolarHBondContact NH2-OD2 3.44Å; N119-D131 WeakPolarHBondContact ND2-CB 3.42Å; N119-D131 PolarHBondContact ND2-OD2 3.01Å; L120-D131 CarbonylContact O-C 3.58Å; L120-D131 VanDerWaalsContact O-CA 3.23Å; L120-D131 WeakPolarHBondContact O-CA 3.49Å; E121-D131 HydrophobicContact CB-CB 4.39Å; E121-D131 HydrophobicContact CG-CB 3.9Å; L128-D131 HydrophobicContact CD1-CB 4.22Å; L128-D131 HydrophobicContact CD2-CB 4.3Å
132	I	89.3	Confident	87.2	Confident	9 Å²	9	35.6 Å²	35.6	5%	0.046	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	120.6	-169.4	-65.5	166.2	0	0	0	109.2	N119 L120 F130 L134 V137 L149 F151 I164	N119-I132 PolarHBondContact OD1-O 3.11Å; L120-I132 HydrophobicContact CB-CB 4.41Å; L120-I132 PolarHBondContact N-O 2.99Å; L120-I132 PolarHBondContact O-N 3.48Å; F130-I132 HydrophobicContact CD2-CD1 4.02Å; F130-I132 HydrophobicContact CD2-CG1 4.06Å; F130-I132 HydrophobicContact CE2-CD1 3.63Å; F130-I132 HydrophobicContact CE2-CG1 4.18Å; I132-L134 PolarHBondContact O-N 2.77Å; I132-V137 HydrophobicContact CG2-CG2 4.12Å; I132-L149 HydrophobicContact CD1-CD2 4.45Å; I132-F151 HydrophobicContact CD1-CZ 4.13Å; I132-F151 HydrophobicContact CG2-CE1 3.49Å; I132-F151 VanDerWaalsContact CG2-CE1 3.49Å; I132-F151 HydrophobicContact CG2-CZ 3.92Å; I132-I164 HydrophobicContact CD1-CD1 3.84Å
133	P	88.2	Confident	86.8	Confident	15 Å²	15	37.3 Å²	37.3	10%	0.097	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	122.7	170.5	-11.3	28.5	0	0	0	107.9	R74 N135 N136	R74-P133 VanDerWaalsContact NH2-CD 3.26Å; P133-N135 PolarHBondContact O-N 3.05Å; P133-N135 VanDerWaalsContact O-N 3.13Å; P133-N136 WeakPolarHBondContact O-CB 3.08Å; P133-N136 PolarHBondContact O-N 2.87Å
134	L	86.9	Confident	86.3	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-68.5	-13.1	-178.8	-64	179.3	0	0	0	112.5	F115 S118 L120 I132 N136 V137 I185 K188 A189 G190	F115-L134 HydrophobicContact CD1-CD1 4.08Å; F115-L134 HydrophobicContact CE1-CD1 4.13Å; S118-L134 VanDerWaalsContact O-CB 3.26Å; S118-L134 WeakPolarHBondContact O-CB 3.48Å; S118-L134 WeakPolarHBondContact O-CG 3.24Å; S118-L134 PolarHBondContact O-N 2.81Å; L120-L134 HydrophobicContact CB-CD2 3.74Å; L120-L134 HydrophobicContact CB-CG 4.21Å; L120-L134 HydrophobicContact CD2-CD2 4.33Å; I132-L134 PolarHBondContact O-N 2.77Å; L134-N136 PolarHBondContact O-N 3.4Å; L134-V137 HydrophobicContact CD2-CG2 3.94Å; L134-V137 PolarHBondContact O-N 2.82Å; L134-I185 HydrophobicContact CD2-CG1 4.46Å; L134-I185 HydrophobicContact CD2-CG2 4.13Å; L134-K188 HydrophobicContact CD1-CB 3.63Å; L134-A189 HydrophobicContact CB-CB 3.95Å; L134-A189 WeakPolarHBondContact O-CA 3.14Å; L134-A189 VanDerWaalsContact O-CB 3.24Å; L134-A189 WeakPolarHBondContact O-CB 3.31Å; L134-G190 PolarHBondContact O-N 3.35Å
135	N	81.2	Confident	86.1	Confident	68 Å²	68	45.4 Å²	45.4	36%	0.364	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-69.1	-18.4	167.9	-64.4	-16.6	0	0	0	113.3	P133 G190	P133-N135 PolarHBondContact O-N 3.05Å; P133-N135 VanDerWaalsContact O-N 3.13Å; N135-G190 PolarHBondContact OD1-N 3.27Å
136	N	82.7	Confident	86.1	Confident	26 Å²	26	44 Å²	44	14%	0.139	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-88.5	-13.4	176.1	-61.8	3.8	0	0	0	111.9	E14 P133 L134 S138 F151 H152	E14-N136 PolarHBondContact OE1-ND2 3.16Å; P133-N136 WeakPolarHBondContact O-CB 3.08Å; P133-N136 PolarHBondContact O-N 2.87Å; L134-N136 PolarHBondContact O-N 3.4Å; N136-S138 PolarHBondContact O-N 3.44Å; N136-F151 HydrophobicContact CB-CD1 4.37Å; N136-H152 PolarHBondContact O-CD2 3Å; N136-H152 PolarHBondContact O-N 3.08Å
137	V	82.9	Confident	86.3	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	118.2	177.4	-178.6	0	0	0	0	109	I132 L134 N139 L149 F151 I185 V191	I132-V137 HydrophobicContact CG2-CG2 4.12Å; L134-V137 HydrophobicContact CD2-CG2 3.94Å; L134-V137 PolarHBondContact O-N 2.82Å; V137-N139 WeakPolarHBondContact CG1-O 3.39Å; V137-L149 HydrophobicContact CG2-CD2 4.07Å; V137-F151 HydrophobicContact CG2-CD1 4.35Å; V137-F151 HydrophobicContact CG2-CE1 3.72Å; V137-F151 HydrophobicContact CG2-CZ 4.44Å; V137-I185 HydrophobicContact CG1-CG2 4.44Å; V137-V191 WeakPolarHBondContact O-CG2 3.41Å
138	S	77.3	Confident	86.3	Confident	43 Å²	43	36 Å²	36	30%	0.301	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	-31.1	179.3	65.7	0	0	0	0	113.5	N136 E150 H152	N136-S138 PolarHBondContact O-N 3.44Å; S138-E150 PolarHBondContact N-O 2.86Å; S138-E150 PolarHBondContact OG-O 3.02Å; S138-H152 VanDerWaalsContact CB-CE1 3.49Å; S138-H152 WeakPolarHBondContact CB-CE1 3.33Å
139	N	77.8	Confident	86.2	Confident	24 Å²	24	35.9 Å²	35.9	13%	0.128	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	153.2	177.5	178.9	33.8	0	0	0	109.8	V137 E150	V137-N139 WeakPolarHBondContact CG1-O 3.39Å; N139-E150 HydrophobicContact CB-CB 4.26Å; N139-E150 WeakPolarHBondContact CB-OE2 3.09Å; N139-E150 PolarHBondContact N-O 3.34Å; N139-E150 PolarHBondContact ND2-OE2 2.93Å; N139-E150 PolarHBondContact O-N 3.05Å
140	C	84.4	Confident	86	Confident	5 Å²	5	35.2 Å²	35.2	3%	0.034	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	121	174.4	-174.4	0	0	0	0	110.3	T148 I185 V186	C140-T148 CarbonylContact C-O 3.51Å; C140-T148 VanDerWaalsContact CA-O 3.32Å; C140-T148 WeakPolarHBondContact CA-O 3.47Å; C140-T148 PolarHBondContact SG-O 2.91Å; C140-T148 VanDerWaalsContact SG-O 3.41Å; C140-I185 HydrophobicContact CB-CG2 3.98Å; C140-V186 HydrophobicContact CB-CG2 4.12Å
141	L	84.6	Confident	85.7	Confident	39 Å²	39	32.5 Å²	32.5	20%	0.204	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	146.9	179.1	-56.8	175	0	0	0	109.1	T148	L141-T148 PolarHBondContact N-O 2.78Å; L141-T148 PolarHBondContact O-N 2.89Å
142	A	87	Confident	85.2	Confident	23 Å²	23	36.2 Å²	36.2	19%	0.19	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	144.9	169.2	0	0	0	0	0	108.6	E146 A178 E179 K182	A142-E146 WeakPolarHBondContact CA-O 3.34Å; A142-A178 HydrophobicContact CB-CB 3.93Å; A142-E179 HydrophobicContact CB-CG 4.13Å; A142-K182 HydrophobicContact CB-CB 4.12Å; A142-K182 HydrophobicContact CB-CD 3.61Å
143	A	83.8	Confident	84.7	Confident	54 Å²	54	39 Å²	39	45%	0.446	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	172.3	167.2	0	0	0	0	0	107.2	N145 E146	A143-N145 PolarHBondContact O-N 2.7Å; A143-E146 PolarHBondContact N-O 3.46Å; A143-E146 PolarHBondContact O-N 3.36Å
144	K	84.2	Confident	84.2	Confident	183 Å²	183	39.2 Å²	39.2	80%	0.796	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.9	107.2	-174.5	-174.2	172.2	-176.9	171.2	0	112.2	E146 D176	K144-E146 PolarHBondContact O-N 2.92Å; K144-D176 VanDerWaalsContact CA-OD2 3.31Å; K144-D176 WeakPolarHBondContact CA-OD2 3.5Å
145	N	87.1	Confident	83.8	Confident	35 Å²	35	44.3 Å²	44.3	19%	0.187	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.5	18.6	-177.3	-55	31.7	0	0	0	114.9	A143 H167 V168	A143-N145 PolarHBondContact O-N 2.7Å; N145-H167 WeakPolarHBondContact O-CA 3.26Å; N145-H167 PolarHBondContact O-ND1 2.86Å; N145-V168 WeakPolarHBondContact CA-O 3.1Å; N145-V168 WeakPolarHBondContact CB-O 3.47Å; N145-V168 PolarHBondContact O-N 2.7Å
146	E	90.6	Very high	83.8	Confident	85 Å²	85	45.7 Å²	45.7	40%	0.397	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	122.3	174.9	-73.1	-161.2	173.7	0	0	111.4	A142 A143 K144 R165 F166	A142-E146 WeakPolarHBondContact CA-O 3.34Å; A143-E146 PolarHBondContact N-O 3.46Å; A143-E146 PolarHBondContact O-N 3.36Å; K144-E146 PolarHBondContact O-N 2.92Å; E146-R165 IonicContact OE2-NH1 2.63Å; E146-F166 WeakPolarHBondContact CA-O 3.33Å
147	L	91.2	Very high	83.8	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	116.3	177.4	176	71.7	0	0	0	109.8	L113 L149 R165 F166 V168 A178 Y181 K182 I185	L113-L147 HydrophobicContact CD1-CD2 4.26Å; L147-L149 HydrophobicContact CD2-CD1 4.26Å; L147-L149 HydrophobicContact CG-CD1 3.92Å; L147-R165 WeakPolarHBondContact O-CA 3.23Å; L147-F166 HydrophobicContact CB-CB 4.32Å; L147-F166 HydrophobicContact CD2-CD2 4.29Å; L147-F166 PolarHBondContact N-O 3.08Å; L147-F166 PolarHBondContact O-N 2.91Å; L147-V168 HydrophobicContact CB-CG2 3.72Å; L147-V168 HydrophobicContact CD2-CG2 4.38Å; L147-A178 HydrophobicContact CB-CB 4.31Å; L147-Y181 HydrophobicContact CD2-CG 4.26Å; L147-K182 HydrophobicContact CD1-CB 4.02Å; L147-I185 HydrophobicContact CD1-CD1 4.32Å; L147-I185 HydrophobicContact CD2-CD1 3.9Å; L147-I185 HydrophobicContact CG-CD1 4.45Å
148	T	90.6	Very high	83.8	Confident	19 Å²	19	51.2 Å²	51.2	12%	0.117	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	129.2	-175.9	-51.6	0	0	0	0	111.2	C140 L141 E150 E163 I164 R165	C140-T148 CarbonylContact C-O 3.51Å; C140-T148 VanDerWaalsContact CA-O 3.32Å; C140-T148 WeakPolarHBondContact CA-O 3.47Å; C140-T148 PolarHBondContact SG-O 2.91Å; C140-T148 VanDerWaalsContact SG-O 3.41Å; L141-T148 PolarHBondContact N-O 2.78Å; L141-T148 PolarHBondContact O-N 2.89Å; T148-E150 HydrophobicContact CG2-CG 4.48Å; T148-E163 HydrophobicContact CG2-CG 3.99Å; T148-I164 WeakPolarHBondContact CA-O 3.4Å; T148-R165 HydrophobicContact CG2-CG 3.7Å; T148-R165 WeakPolarHBondContact OG1-CD 3.35Å; T148-R165 WeakPolarHBondContact OG1-CG 3.35Å
149	L	89	Confident	84.3	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	120.3	172.5	-72.7	68.9	0	0	0	108.5	L120 I132 V137 L147 F151 E163 I164 F166 I185	L120-L149 HydrophobicContact CD2-CD2 3.83Å; I132-L149 HydrophobicContact CD1-CD2 4.45Å; V137-L149 HydrophobicContact CG2-CD2 4.07Å; L147-L149 HydrophobicContact CD2-CD1 4.26Å; L147-L149 HydrophobicContact CG-CD1 3.92Å; L149-F151 HydrophobicContact CB-CE2 4.01Å; L149-F151 HydrophobicContact CB-CZ 3.79Å; L149-F151 HydrophobicContact CD2-CZ 4.2Å; L149-F151 WeakPolarHBondContact O-CE2 3.35Å; L149-E163 CarbonylContact O-C 3.5Å; L149-E163 WeakPolarHBondContact O-CA 3.49Å; L149-I164 PolarHBondContact N-O 3.42Å; L149-I164 PolarHBondContact O-N 2.98Å; L149-F166 HydrophobicContact CD1-CD2 4Å; L149-F166 HydrophobicContact CD1-CE2 3.91Å; L149-F166 HydrophobicContact CD2-CE2 4.44Å; L149-I185 HydrophobicContact CD1-CD1 4.03Å; L149-I185 HydrophobicContact CD2-CD1 4.3Å; L149-I185 HydrophobicContact CG-CD1 4.34Å
150	E	85.9	Confident	84.6	Confident	27 Å²	27	55.5 Å²	55.5	13%	0.126	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	130.7	174.5	-64.4	-177.1	119.5	0	0	110	S138 N139 T148	S138-E150 PolarHBondContact N-O 2.86Å; S138-E150 PolarHBondContact OG-O 3.02Å; N139-E150 HydrophobicContact CB-CB 4.26Å; N139-E150 WeakPolarHBondContact CB-OE2 3.09Å; N139-E150 PolarHBondContact N-O 3.34Å; N139-E150 PolarHBondContact ND2-OE2 2.93Å; N139-E150 PolarHBondContact O-N 3.05Å; T148-E150 HydrophobicContact CG2-CG 4.48Å
151	F	85.3	Confident	84.8	Confident	13 Å²	13	59.7 Å²	59.7	6%	0.057	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	148.1	-171	-66.4	-77.5	0	0	0	113.8	I132 N136 V137 L149 L161 M162 I164	I132-F151 HydrophobicContact CD1-CZ 4.13Å; I132-F151 HydrophobicContact CG2-CE1 3.49Å; I132-F151 VanDerWaalsContact CG2-CE1 3.49Å; I132-F151 HydrophobicContact CG2-CZ 3.92Å; N136-F151 HydrophobicContact CB-CD1 4.37Å; V137-F151 HydrophobicContact CG2-CD1 4.35Å; V137-F151 HydrophobicContact CG2-CE1 3.72Å; V137-F151 HydrophobicContact CG2-CZ 4.44Å; L149-F151 HydrophobicContact CB-CE2 4.01Å; L149-F151 HydrophobicContact CB-CZ 3.79Å; L149-F151 HydrophobicContact CD2-CZ 4.2Å; L149-F151 WeakPolarHBondContact O-CE2 3.35Å; F151-L161 HydrophobicContact CD2-CD2 3.86Å; F151-L161 HydrophobicContact CD2-CG 3.86Å; F151-L161 HydrophobicContact CE2-CD2 3.76Å; F151-L161 HydrophobicContact CE2-CG 4.13Å; F151-L161 HydrophobicContact CG-CD2 4.36Å; F151-L161 HydrophobicContact CG-CG 4.48Å; F151-L161 HydrophobicContact CZ-CD2 4.17Å; F151-M162 PolarHBondContact N-O 3.22Å; F151-I164 HydrophobicContact CE2-CB 4.07Å; F151-I164 HydrophobicContact CE2-CD1 4.22Å; F151-I164 HydrophobicContact CE2-CG1 3.94Å; F151-I164 HydrophobicContact CZ-CD1 4.43Å
152	H	79.4	Confident	84.8	Confident	93 Å²	93	61.1 Å²	61.1	43%	0.431	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-57.3	143	158.6	-69.5	-70	0	0	0	108.9	V16 N136 S138	V16-H152 HydrophobicContact CG1-CB 3.87Å; V16-H152 WeakPolarHBondContact CG1-O 3.17Å; N136-H152 PolarHBondContact O-CD2 3Å; N136-H152 PolarHBondContact O-N 3.08Å; S138-H152 VanDerWaalsContact CB-CE1 3.49Å; S138-H152 WeakPolarHBondContact CB-CE1 3.33Å
153	Q	78	Confident	85	Confident	66 Å²	66	64.3 Å²	64.3	31%	0.308	34%	0.341	S	S	.	.			trans	-108.4	127.7	-179.4	-172.5	-179.4	-2.6	0	0	108.5	D155 M162	Q153-D155 PolarHBondContact NE2-OD1 3.46Å; Q153-M162 HydrophobicContact CB-CE 4.25Å; Q153-M162 HydrophobicContact CB-SD 3.99Å; Q153-M162 VanDerWaalsContact CD-SD 3.53Å; Q153-M162 HydrophobicContact CG-CE 4.36Å; Q153-M162 HydrophobicContact CG-SD 3.65Å
154	N	78.8	Confident	85.3	Confident	21 Å²	21	63.4 Å²	63.4	11%	0.112	33%	0.328	C	S	.	.			trans	-90.1	110.3	166.4	-169.1	-26.9	0	0	0	108.5	N15 V16 H18 E156 C157 S160	N15-N154 PolarHBondContact O-ND2 3.49Å; V16-N154 HydrophobicContact CB-CB 4.18Å; V16-N154 HydrophobicContact CG1-CB 4.45Å; V16-N154 WeakPolarHBondContact O-CB 3.23Å; H18-N154 VanDerWaalsContact CB-ND2 3.26Å; H18-N154 WeakPolarHBondContact CB-ND2 3.29Å; N154-E156 PolarHBondContact O-N 2.95Å; N154-E156 VanDerWaalsContact O-N 3.07Å; N154-E156 VanDerWaalsContact OD1-CB 3.25Å; N154-E156 WeakPolarHBondContact OD1-CB 3.36Å; N154-E156 WeakPolarHBondContact OD1-CG 3.48Å; N154-E156 PolarHBondContact OD1-N 3.34Å; N154-C157 HydrophobicContact CB-CB 4.11Å; N154-C157 WeakPolarHBondContact O-CB 3.47Å; N154-C157 PolarHBondContact O-N 3.24Å; N154-S160 PolarHBondContact O-OG 2.85Å; N154-S160 VanDerWaalsContact O-OG 3.12Å
155	D	78.9	Confident	85.8	Confident	106 Å²	106	61.4 Å²	61.4	57%	0.567	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-6.2	-179.5	-72.6	-17.8	0	0	0	113	Q153 R269	Q153-D155 PolarHBondContact NE2-OD1 3.46Å; D155-R269 VanDerWaalsContact CG-NH2 3.32Å; D155-R269 IonicContact OD1-CZ 3.72Å; D155-R269 IonicContact OD1-NH1 2.69Å; D155-R269 IonicContact OD1-NH2 3.08Å; D155-R269 PolarHBondContact OD1-NH2 2.86Å; D155-R269 IonicContact OD2-CZ 3.93Å; D155-R269 IonicContact OD2-NH1 3.24Å; D155-R269 PolarHBondContact OD2-NH1 2.89Å; D155-R269 IonicContact OD2-NH2 3.59Å; D155-R269 PolarHBondContact OD2-NH2 2.93Å; D155-R269 VanDerWaalsContact OD2-NH2 3.15Å
156	E	80.5	Confident	86	Confident	98 Å²	98	60.7 Å²	60.7	46%	0.458	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-8.4	170.9	-42.2	-163.9	126.6	0	0	113.1	H18 K37 N154	H18-E156 PolarHBondContact CE1-O 3.14Å; H18-E156 VanDerWaalsContact CE1-O 3.3Å; H18-E156 PolarHBondContact ND1-O 3.14Å; K37-E156 IonicContact NZ-OE1 2.68Å; K37-E156 PolarHBondContact NZ-OE1 3.46Å; K37-E156 IonicContact NZ-OE2 3.81Å; K37-E156 PolarHBondContact NZ-OE2 3.4Å; N154-E156 PolarHBondContact O-N 2.95Å; N154-E156 VanDerWaalsContact O-N 3.07Å; N154-E156 VanDerWaalsContact OD1-CB 3.25Å; N154-E156 WeakPolarHBondContact OD1-CB 3.36Å; N154-E156 WeakPolarHBondContact OD1-CG 3.48Å; N154-E156 PolarHBondContact OD1-N 3.34Å
157	C	82.8	Confident	86.1	Confident	17 Å²	17	63.1 Å²	63.1	12%	0.115	32%	0.322	C	S	.	.			trans	-89.8	114	174.8	-174.6	0	0	0	0	110.9	G17 H18 N154 V159 S160	G17-C157 PolarHBondContact O-SG 2.81Å; H18-C157 HydrophobicContact CB-CB 4.15Å; N154-C157 HydrophobicContact CB-CB 4.11Å; N154-C157 WeakPolarHBondContact O-CB 3.47Å; N154-C157 PolarHBondContact O-N 3.24Å; C157-V159 PolarHBondContact O-N 3.29Å; C157-V159 VanDerWaalsContact O-N 3.17Å; C157-V159 PolarHBondContact SG-O 3.5Å; C157-S160 PolarHBondContact O-OG 2.76Å
158	P	83	Confident	86.1	Confident	125 Å²	125	63.6 Å²	63.6	81%	0.812	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-19	-173	28.4	-36.3	0	0	0	113.9
159	V	87.1	Confident	85.8	Confident	128 Å²	128	67 Å²	67	78%	0.776	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.3	78.8	173.3	-174.4	0	0	0	0	108	C157	C157-V159 PolarHBondContact O-N 3.29Å; C157-V159 VanDerWaalsContact O-N 3.17Å; C157-V159 PolarHBondContact SG-O 3.5Å
160	S	84.8	Confident	85.4	Confident	29 Å²	29	68.9 Å²	68.9	20%	0.203	36%	0.36	C	S	.	.			trans	-74.1	130.3	176.4	-69.3	0	0	0	0	111.6	N154 C157	N154-S160 PolarHBondContact O-OG 2.85Å; N154-S160 VanDerWaalsContact O-OG 3.12Å; C157-S160 PolarHBondContact O-OG 2.76Å
161	L	87.6	Confident	84.6	Confident	92 Å²	92	74.8 Å²	74.8	48%	0.482	39%	0.393	S	S	.	.			trans	-69.5	127.1	162.1	-178.2	69.2	0	0	0	108.7	F151 I164	F151-L161 HydrophobicContact CD2-CD2 3.86Å; F151-L161 HydrophobicContact CD2-CG 3.86Å; F151-L161 HydrophobicContact CE2-CD2 3.76Å; F151-L161 HydrophobicContact CE2-CG 4.13Å; F151-L161 HydrophobicContact CG-CD2 4.36Å; F151-L161 HydrophobicContact CG-CG 4.48Å; F151-L161 HydrophobicContact CZ-CD2 4.17Å; L161-I164 HydrophobicContact CD1-CD1 4.18Å; L161-I164 HydrophobicContact CD1-CG1 3.92Å; L161-I164 HydrophobicContact CD2-CD1 3.69Å; L161-I164 HydrophobicContact CD2-CG1 4.1Å; L161-I164 HydrophobicContact CG-CD1 4.46Å; L161-I164 HydrophobicContact CG-CG1 4.39Å
162	M	85.4	Confident	83.4	Confident	70 Å²	70	78.9 Å²	78.9	35%	0.345	43%	0.428	S	S	.	.			trans	-109.2	-38.8	-176	-65.2	-60.2	-52.1	0	0	113.2	F151 Q153	F151-M162 PolarHBondContact N-O 3.22Å; Q153-M162 HydrophobicContact CB-CE 4.25Å; Q153-M162 HydrophobicContact CB-SD 3.99Å; Q153-M162 VanDerWaalsContact CD-SD 3.53Å; Q153-M162 HydrophobicContact CG-CE 4.36Å; Q153-M162 HydrophobicContact CG-SD 3.65Å
163	E	90.3	Very high	82.6	Confident	90 Å²	90	78.8 Å²	78.8	42%	0.421	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	139.1	-171.2	-174.5	-166.4	127	0	0	108.6	T148 L149 R165	T148-E163 HydrophobicContact CG2-CG 3.99Å; L149-E163 CarbonylContact O-C 3.5Å; L149-E163 WeakPolarHBondContact O-CA 3.49Å; E163-R165 HydrophobicContact CG-CG 4.48Å; E163-R165 WeakPolarHBondContact OE1-CD 3.18Å; E163-R165 IonicContact OE1-CZ 3.83Å; E163-R165 IonicContact OE1-NE 2.7Å; E163-R165 PolarHBondContact OE1-NE 2.8Å; E163-R165 IonicContact OE1-NH2 3.21Å
164	I	91.9	Very high	81.8	Confident	35 Å²	35	85.6 Å²	85.6	18%	0.179	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	138.3	162.9	-72.1	179.9	0	0	0	108	I132 T148 L149 F151 L161 F166	I132-I164 HydrophobicContact CD1-CD1 3.84Å; T148-I164 WeakPolarHBondContact CA-O 3.4Å; L149-I164 PolarHBondContact N-O 3.42Å; L149-I164 PolarHBondContact O-N 2.98Å; F151-I164 HydrophobicContact CE2-CB 4.07Å; F151-I164 HydrophobicContact CE2-CD1 4.22Å; F151-I164 HydrophobicContact CE2-CG1 3.94Å; F151-I164 HydrophobicContact CZ-CD1 4.43Å; L161-I164 HydrophobicContact CD1-CD1 4.18Å; L161-I164 HydrophobicContact CD1-CG1 3.92Å; L161-I164 HydrophobicContact CD2-CD1 3.69Å; L161-I164 HydrophobicContact CD2-CG1 4.1Å; L161-I164 HydrophobicContact CG-CD1 4.46Å; L161-I164 HydrophobicContact CG-CG1 4.39Å; I164-F166 HydrophobicContact CG2-CD2 3.96Å; I164-F166 HydrophobicContact CG2-CE1 4.42Å; I164-F166 HydrophobicContact CG2-CE2 3.56Å; I164-F166 HydrophobicContact CG2-CZ 3.83Å
165	R	92.9	Very high	81.5	Confident	141 Å²	141	90.8 Å²	90.8	53%	0.532	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	124	170.3	-74.8	-169.3	-78.2	125.9	5.6	110.8	E146 L147 T148 E163	E146-R165 IonicContact OE2-NH1 2.63Å; L147-R165 WeakPolarHBondContact O-CA 3.23Å; T148-R165 HydrophobicContact CG2-CG 3.7Å; T148-R165 WeakPolarHBondContact OG1-CD 3.35Å; T148-R165 WeakPolarHBondContact OG1-CG 3.35Å; E163-R165 HydrophobicContact CG-CG 4.48Å; E163-R165 WeakPolarHBondContact OE1-CD 3.18Å; E163-R165 IonicContact OE1-CZ 3.83Å; E163-R165 IonicContact OE1-NE 2.7Å; E163-R165 PolarHBondContact OE1-NE 2.8Å; E163-R165 IonicContact OE1-NH2 3.21Å
166	F	93	Very high	81.5	Confident	20 Å²	20	87.6 Å²	87.6	9%	0.088	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	140.2	171.7	-62.1	-87.7	0	0	0	109.7	L113 F122 F130 E146 L147 L149 I164	L113-F166 HydrophobicContact CD1-CD1 4.3Å; L113-F166 HydrophobicContact CD1-CE1 4.47Å; L113-F166 HydrophobicContact CD1-CG 4.32Å; L113-F166 HydrophobicContact CD2-CD1 4.33Å; L113-F166 HydrophobicContact CD2-CE1 3.72Å; L113-F166 HydrophobicContact CD2-CE2 4.42Å; L113-F166 HydrophobicContact CD2-CZ 3.78Å; L113-F166 HydrophobicContact CG-CE1 4.49Å; F122-F166 HydrophobicContact CD2-CE1 4.13Å; F122-F166 HydrophobicContact CE2-CD1 4.5Å; F122-F166 HydrophobicContact CE2-CE1 4.33Å; F122-F166 HydrophobicContact CG-CE1 4.3Å; F130-F166 HydrophobicContact CE2-CE1 4.25Å; F130-F166 AromaticContact CE2-CZ 3.9Å; F130-F166 HydrophobicContact CE2-CZ 3.9Å; F130-F166 AromaticContact CZ-CE1 3.68Å; F130-F166 HydrophobicContact CZ-CE1 3.68Å; F130-F166 AromaticContact CZ-CZ 3.73Å; F130-F166 HydrophobicContact CZ-CZ 3.73Å; E146-F166 WeakPolarHBondContact CA-O 3.33Å; L147-F166 HydrophobicContact CB-CB 4.32Å; L147-F166 HydrophobicContact CD2-CD2 4.29Å; L147-F166 PolarHBondContact N-O 3.08Å; L147-F166 PolarHBondContact O-N 2.91Å; L149-F166 HydrophobicContact CD1-CD2 4Å; L149-F166 HydrophobicContact CD1-CE2 3.91Å; L149-F166 HydrophobicContact CD2-CE2 4.44Å; I164-F166 HydrophobicContact CG2-CD2 3.96Å; I164-F166 HydrophobicContact CG2-CE1 4.42Å; I164-F166 HydrophobicContact CG2-CE2 3.56Å; I164-F166 HydrophobicContact CG2-CZ 3.83Å
167	H	92.6	Very high	81.7	Confident	136 Å²	136	84.3 Å²	84.3	63%	0.63	47%	0.465	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81	128.5	157.5	-176.9	49.6	0	0	0	108.6	N145	N145-H167 WeakPolarHBondContact O-CA 3.26Å; N145-H167 PolarHBondContact O-ND1 2.86Å
168	V	90	Very high	81.8	Confident	10 Å²	10	83.5 Å²	83.5	6%	0.061	46%	0.459	C	S	.	.			trans	-112.3	107.6	175.4	-171.4	0	0	0	0	107.5	N145 L147 P177 A178 Y181	N145-V168 WeakPolarHBondContact CA-O 3.1Å; N145-V168 WeakPolarHBondContact CB-O 3.47Å; N145-V168 PolarHBondContact O-N 2.7Å; L147-V168 HydrophobicContact CB-CG2 3.72Å; L147-V168 HydrophobicContact CD2-CG2 4.38Å; V168-P177 HydrophobicContact CG1-CB 3.84Å; V168-P177 HydrophobicContact CG1-CG 3.8Å; V168-A178 HydrophobicContact CB-CB 4.35Å; V168-A178 HydrophobicContact CG2-CB 4.24Å; V168-Y181 HydrophobicContact CG1-CD2 4.03Å; V168-Y181 HydrophobicContact CG1-CE2 4.12Å
169	P	85.4	Confident	82	Confident	91 Å²	91	80.5 Å²	80.5	59%	0.591	43%	0.434	S	S	*	.			trans	-57	146.9	174.6	-25.1	35.4	0	0	0	111.6	P177	P169-P177 VanDerWaalsContact O-CG 3.26Å; P169-P177 WeakPolarHBondContact O-CG 3.41Å
170	S	80.1	Confident	81.9	Confident	38 Å²	38	78.9 Å²	78.9	27%	0.266	42%	0.418	S	S	.	.			trans	-130.4	121.2	176.4	167.3	0	0	0	0	108.3	A172	S170-A172 PolarHBondContact O-N 3.2Å
171	D	68.1	Low	82.1	Confident	152 Å²	152	80.2 Å²	80.2	81%	0.813	42%	0.419	S	S	*	.			trans	-83.4	40.6	-176.1	-62.2	-34.9	0	0	0	112	T173	D171-T173 PolarHBondContact O-N 3.21Å
172	A	61.3	Low	82.1	Confident	98 Å²	98	78.2 Å²	78.2	81%	0.81	41%	0.407	S	S	*	.	S	Bend	trans	59.4	20.1	-179.7	0	0	0	0	0	116.5	S170	S170-A172 PolarHBondContact O-N 3.2Å
173	T	61.3	Low	82	Confident	92 Å²	92	81.1 Å²	81.1	56%	0.564	42%	0.417	S	S	*	.			trans	-67.1	154.7	165.2	51.1	0	0	0	0	111.8	D171 D175	D171-T173 PolarHBondContact O-N 3.21Å; T173-D175 VanDerWaalsContact C-N 3.34Å; T173-D175 PolarHBondContact O-N 3.25Å; T173-D175 PolarHBondContact OG1-O 3.22Å
174	E	63	Low	81.8	Confident	208 Å²	208	80.5 Å²	80.5	97%	0.972	41%	0.413	S	S	*	.	S	Bend	trans	-67.3	-31.8	179.3	-63.1	-167.3	141.9	0	0	113.3
175	D	71.5	Confident	81.5	Confident	130 Å²	130	78.9 Å²	78.9	70%	0.695	41%	0.405	S	S	*	.	S	Bend	trans	-76.2	133.6	173.7	-79.2	-61.4	0	0	0	112.1	T173 P177	T173-D175 VanDerWaalsContact C-N 3.34Å; T173-D175 PolarHBondContact O-N 3.25Å; T173-D175 PolarHBondContact OG1-O 3.22Å; D175-P177 WeakPolarHBondContact O-CD 3.38Å
176	D	78.3	Confident	81	Confident	40 Å²	40	74.2 Å²	74.2	21%	0.214	39%	0.392	C	S	.	.			trans	-79.8	113.8	170.7	-172.8	-17.4	0	0	0	110.2	K144 A178 E179 E180	K144-D176 VanDerWaalsContact CA-OD2 3.31Å; K144-D176 WeakPolarHBondContact CA-OD2 3.5Å; D176-A178 PolarHBondContact O-N 3.42Å; D176-A178 VanDerWaalsContact OD1-CB 3.27Å; D176-A178 WeakPolarHBondContact OD1-CB 3.45Å; D176-A178 PolarHBondContact OD1-N 2.88Å; D176-E179 PolarHBondContact O-N 2.79Å; D176-E180 PolarHBondContact O-N 3.39Å
177	P	85.1	Confident	80.3	Confident	29 Å²	29	76.6 Å²	76.6	19%	0.188	41%	0.411	C	S	.	.	H	α-helix	trans	-63.3	-22.5	-179.8	25.2	-32.9	0	0	0	112.8	V168 P169 D175 E179 E180 Y181	V168-P177 HydrophobicContact CG1-CB 3.84Å; V168-P177 HydrophobicContact CG1-CG 3.8Å; P169-P177 VanDerWaalsContact O-CG 3.26Å; P169-P177 WeakPolarHBondContact O-CG 3.41Å; D175-P177 WeakPolarHBondContact O-CD 3.38Å; P177-E179 VanDerWaalsContact C-N 3.33Å; P177-E179 PolarHBondContact O-N 2.81Å; P177-E180 PolarHBondContact O-N 2.85Å; P177-Y181 WeakPolarHBondContact O-CD2 3.36Å; P177-Y181 PolarHBondContact O-N 2.91Å
178	A	86.1	Confident	79.6	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	40%	0.396	C	S	.	.	H	α-helix	trans	-65	-35.7	173.7	0	0	0	0	0	112	A142 L147 V168 D176 E180 K182	A142-A178 HydrophobicContact CB-CB 3.93Å; L147-A178 HydrophobicContact CB-CB 4.31Å; V168-A178 HydrophobicContact CB-CB 4.35Å; V168-A178 HydrophobicContact CG2-CB 4.24Å; D176-A178 PolarHBondContact O-N 3.42Å; D176-A178 VanDerWaalsContact OD1-CB 3.27Å; D176-A178 WeakPolarHBondContact OD1-CB 3.45Å; D176-A178 PolarHBondContact OD1-N 2.88Å; A178-E180 VanDerWaalsContact C-N 3.35Å; A178-K182 VanDerWaalsContact O-CB 3.25Å; A178-K182 WeakPolarHBondContact O-CB 3.26Å; A178-K182 PolarHBondContact O-N 3.02Å
179	E	85.7	Confident	78.7	Confident	61 Å²	61	73.6 Å²	73.6	29%	0.285	40%	0.397	S	S	.	.	H	α-helix	trans	-69.3	-32	172.8	-83	-68.1	156.7	0	0	112.1	A142 D176 P177 K182 K183	A142-E179 HydrophobicContact CB-CG 4.13Å; D176-E179 PolarHBondContact O-N 2.79Å; P177-E179 VanDerWaalsContact C-N 3.33Å; P177-E179 PolarHBondContact O-N 2.81Å; E179-K182 IonicContact OE1-NZ 2.73Å; E179-K182 PolarHBondContact OE1-NZ 3.01Å; E179-K182 IonicContact OE2-NZ 2.75Å; E179-K182 PolarHBondContact OE2-NZ 3.4Å; E179-K183 WeakPolarHBondContact O-CD 3.1Å; E179-K183 WeakPolarHBondContact O-CG 3.23Å; E179-K183 PolarHBondContact O-N 3.44Å
180	E	86.1	Confident	77.3	Confident	94 Å²	94	71.4 Å²	71.4	44%	0.439	39%	0.391	S	S	.	.	H	α-helix	trans	-69.5	-45.2	174.6	-153.2	-135.3	177.5	0	0	111.9	D176 P177 A178 K182 K183 K184	D176-E180 PolarHBondContact O-N 3.39Å; P177-E180 PolarHBondContact O-N 2.85Å; A178-E180 VanDerWaalsContact C-N 3.35Å; E180-K182 PolarHBondContact O-N 3.46Å; E180-K183 PolarHBondContact O-N 2.93Å; E180-K184 VanDerWaalsContact CD-CE 3.41Å; E180-K184 WeakPolarHBondContact O-CG 3.37Å; E180-K184 PolarHBondContact O-N 2.91Å; E180-K184 WeakPolarHBondContact OE1-CE 3.31Å; E180-K184 IonicContact OE1-NZ 2.83Å; E180-K184 PolarHBondContact OE1-NZ 3.42Å; E180-K184 IonicContact OE2-NZ 3.66Å; E180-K184 PolarHBondContact OE2-NZ 2.8Å
181	Y	87.5	Confident	76.2	Confident	58 Å²	58	70.7 Å²	70.7	23%	0.227	39%	0.385	C	S	.	.	H	α-helix	trans	-61.7	-40.9	172.5	-85.4	-75.6	0	0	0	112.3	L113 F115 L147 V168 P177 K184 I185	L113-Y181 HydrophobicContact CB-CD1 4.4Å; L113-Y181 HydrophobicContact CB-CE1 3.68Å; L113-Y181 HydrophobicContact CD1-CD1 4.26Å; L113-Y181 HydrophobicContact CD1-CE1 4.17Å; F115-Y181 AromaticContact CE2-CD1 3.89Å; F115-Y181 HydrophobicContact CE2-CD1 3.89Å; F115-Y181 AromaticContact CE2-CE1 4Å; F115-Y181 HydrophobicContact CE2-CE1 4Å; F115-Y181 HydrophobicContact CZ-CD1 4.1Å; L147-Y181 HydrophobicContact CD2-CG 4.26Å; V168-Y181 HydrophobicContact CG1-CD2 4.03Å; V168-Y181 HydrophobicContact CG1-CE2 4.12Å; P177-Y181 WeakPolarHBondContact O-CD2 3.36Å; P177-Y181 PolarHBondContact O-N 2.91Å; Y181-K184 CarbonylContact O-C 3.56Å; Y181-K184 PolarHBondContact O-N 2.81Å; Y181-I185 WeakPolarHBondContact O-CB 3.22Å; Y181-I185 WeakPolarHBondContact O-CG1 3.48Å; Y181-I185 PolarHBondContact O-N 2.88Å
182	K	87.4	Confident	75.8	Confident	50 Å²	50	66.3 Å²	66.3	22%	0.217	36%	0.361	C	S	.	.	H	α-helix	trans	-59	-45.7	174	167.8	176.5	160.6	-127.2	0	111.9	A142 L147 A178 E179 E180 K184 I185 V186	A142-K182 HydrophobicContact CB-CB 4.12Å; A142-K182 HydrophobicContact CB-CD 3.61Å; L147-K182 HydrophobicContact CD1-CB 4.02Å; A178-K182 VanDerWaalsContact O-CB 3.25Å; A178-K182 WeakPolarHBondContact O-CB 3.26Å; A178-K182 PolarHBondContact O-N 3.02Å; E179-K182 IonicContact OE1-NZ 2.73Å; E179-K182 PolarHBondContact OE1-NZ 3.01Å; E179-K182 IonicContact OE2-NZ 2.75Å; E179-K182 PolarHBondContact OE2-NZ 3.4Å; E180-K182 PolarHBondContact O-N 3.46Å; K182-K184 VanDerWaalsContact C-N 3.34Å; K182-K184 PolarHBondContact O-N 2.81Å; K182-I185 PolarHBondContact O-N 3.27Å; K182-V186 WeakPolarHBondContact O-CB 3.46Å; K182-V186 WeakPolarHBondContact O-CG2 3.37Å; K182-V186 PolarHBondContact O-N 3.23Å
183	K	84.6	Confident	75.7	Confident	130 Å²	130	65.3 Å²	65.3	57%	0.565	34%	0.339	S	S	*	.	H	α-helix	trans	-58.6	-44	174	-70.6	160.9	-170.1	168.1	0	111.4	E179 E180 S187	E179-K183 WeakPolarHBondContact O-CD 3.1Å; E179-K183 WeakPolarHBondContact O-CG 3.23Å; E179-K183 PolarHBondContact O-N 3.44Å; E180-K183 PolarHBondContact O-N 2.93Å; K183-S187 WeakPolarHBondContact O-CB 3.18Å; K183-S187 PolarHBondContact O-N 3.14Å; K183-S187 PolarHBondContact O-OG 2.94Å
184	K	85.6	Confident	75.9	Confident	78 Å²	78	64.8 Å²	64.8	34%	0.339	33%	0.331	S	S	.	.	H	α-helix	trans	-67.5	-33.3	177.2	-70.1	168.8	178.5	168.4	0	113.9	F115 E180 Y181 K182 S187	F115-K184 HydrophobicContact CE1-CB 4.21Å; F115-K184 HydrophobicContact CE2-CB 4.04Å; F115-K184 HydrophobicContact CE2-CD 4.27Å; F115-K184 HydrophobicContact CZ-CB 3.61Å; E180-K184 VanDerWaalsContact CD-CE 3.41Å; E180-K184 WeakPolarHBondContact O-CG 3.37Å; E180-K184 PolarHBondContact O-N 2.91Å; E180-K184 WeakPolarHBondContact OE1-CE 3.31Å; E180-K184 IonicContact OE1-NZ 2.83Å; E180-K184 PolarHBondContact OE1-NZ 3.42Å; E180-K184 IonicContact OE2-NZ 3.66Å; E180-K184 PolarHBondContact OE2-NZ 2.8Å; Y181-K184 CarbonylContact O-C 3.56Å; Y181-K184 PolarHBondContact O-N 2.81Å; K182-K184 VanDerWaalsContact C-N 3.34Å; K182-K184 PolarHBondContact O-N 2.81Å; K184-S187 PolarHBondContact O-OG 3.21Å; K184-S187 VanDerWaalsContact O-OG 3.12Å
185	I	86.3	Confident	75.7	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-72.4	-52	175.4	-74.6	165.8	0	0	0	110.1	F115 L120 L134 V137 C140 L147 L149 Y181 K182 S187 K188 A189	F115-I185 HydrophobicContact CE1-CG1 3.78Å; F115-I185 HydrophobicContact CZ-CG1 3.9Å; L120-I185 HydrophobicContact CD2-CD1 4.11Å; L120-I185 HydrophobicContact CD2-CG1 4.47Å; L134-I185 HydrophobicContact CD2-CG1 4.46Å; L134-I185 HydrophobicContact CD2-CG2 4.13Å; V137-I185 HydrophobicContact CG1-CG2 4.44Å; C140-I185 HydrophobicContact CB-CG2 3.98Å; L147-I185 HydrophobicContact CD1-CD1 4.32Å; L147-I185 HydrophobicContact CD2-CD1 3.9Å; L147-I185 HydrophobicContact CG-CD1 4.45Å; L149-I185 HydrophobicContact CD1-CD1 4.03Å; L149-I185 HydrophobicContact CD2-CD1 4.3Å; L149-I185 HydrophobicContact CG-CD1 4.34Å; Y181-I185 WeakPolarHBondContact O-CB 3.22Å; Y181-I185 WeakPolarHBondContact O-CG1 3.48Å; Y181-I185 PolarHBondContact O-N 2.88Å; K182-I185 PolarHBondContact O-N 3.27Å; I185-S187 VanDerWaalsContact C-N 3.26Å; I185-S187 PolarHBondContact O-N 2.79Å; I185-K188 PolarHBondContact O-N 3.12Å; I185-K188 VanDerWaalsContact O-N 3.07Å; I185-A189 WeakPolarHBondContact O-CB 3.35Å; I185-A189 PolarHBondContact O-N 3.39Å
186	V	81.4	Confident	75.5	Confident	44 Å²	44	56.6 Å²	56.6	27%	0.267	31%	0.313	S	S	.	.	H	α-helix	trans	-63.5	-31.8	-178.3	174.4	0	0	0	0	111.9	C140 K182 K188 V191 Q193	C140-V186 HydrophobicContact CB-CG2 4.12Å; K182-V186 WeakPolarHBondContact O-CB 3.46Å; K182-V186 WeakPolarHBondContact O-CG2 3.37Å; K182-V186 PolarHBondContact O-N 3.23Å; V186-K188 VanDerWaalsContact C-N 3.3Å; V186-K188 PolarHBondContact O-N 3.02Å; V186-V191 HydrophobicContact CG1-CG1 4.33Å; V186-Q193 PolarHBondContact O-NE2 2.86Å
187	S	79.4	Confident	75.5	Confident	70 Å²	70	62 Å²	62	49%	0.49	33%	0.334	S	S	.	.	H	α-helix	trans	-70.9	-20.9	175.7	69	0	0	0	0	114.5	K183 K184 I185 Q193	K183-S187 WeakPolarHBondContact O-CB 3.18Å; K183-S187 PolarHBondContact O-N 3.14Å; K183-S187 PolarHBondContact O-OG 2.94Å; K184-S187 PolarHBondContact O-OG 3.21Å; K184-S187 VanDerWaalsContact O-OG 3.12Å; I185-S187 VanDerWaalsContact C-N 3.26Å; I185-S187 PolarHBondContact O-N 2.79Å; S187-Q193 VanDerWaalsContact C-NE2 3.31Å; S187-Q193 VanDerWaalsContact CA-NE2 3.34Å; S187-Q193 PolarHBondContact O-NE2 2.54Å
188	K	76.5	Confident	75.6	Confident	73 Å²	73	61.3 Å²	61.3	32%	0.317	33%	0.331	S	S	.	.	H	α-helix	trans	-111.6	-15.7	-177.3	-73.7	-175.3	157.8	-151.2	0	115	F115 G117 S118 L134 I185 V186	F115-K188 HydrophobicContact CB-CD 4.4Å; F115-K188 HydrophobicContact CD1-CD 3.84Å; F115-K188 HydrophobicContact CE1-CD 4.49Å; F115-K188 HydrophobicContact CG-CD 4.42Å; G117-K188 WeakPolarHBondContact O-CD 3.5Å; G117-K188 WeakPolarHBondContact O-CE 3.44Å; G117-K188 PolarHBondContact O-NZ 2.82Å; S118-K188 VanDerWaalsContact CB-O 3.3Å; S118-K188 WeakPolarHBondContact CB-O 3.48Å; S118-K188 PolarHBondContact OG-O 3.36Å; L134-K188 HydrophobicContact CD1-CB 3.63Å; I185-K188 PolarHBondContact O-N 3.12Å; I185-K188 VanDerWaalsContact O-N 3.07Å; V186-K188 VanDerWaalsContact C-N 3.3Å; V186-K188 PolarHBondContact O-N 3.02Å
189	A	70.9	Confident	75.7	Confident	10 Å²	10	61.4 Å²	61.4	8%	0.083	33%	0.331	C	S	.	.	S	Bend	trans	-77.3	161.6	-179.8	0	0	0	0	0	112.9	L134 I185 V191	L134-A189 HydrophobicContact CB-CB 3.95Å; L134-A189 WeakPolarHBondContact O-CA 3.14Å; L134-A189 VanDerWaalsContact O-CB 3.24Å; L134-A189 WeakPolarHBondContact O-CB 3.31Å; I185-A189 WeakPolarHBondContact O-CB 3.35Å; I185-A189 PolarHBondContact O-N 3.39Å; A189-V191 HydrophobicContact CB-CB 4.14Å; A189-V191 HydrophobicContact CB-CG2 3.81Å; A189-V191 PolarHBondContact O-N 3.28Å; A189-V191 VanDerWaalsContact O-N 3.12Å
190	G	57.4	Low	75.9	Confident	45 Å²	45	58.8 Å²	58.8	46%	0.464	32%	0.32	S	S	.	.	S	Bend	trans	-68.7	2.1	167.3	0	0	0	0	0	114	L134 N135 I192	L134-G190 PolarHBondContact O-N 3.35Å; N135-G190 PolarHBondContact OD1-N 3.27Å; G190-I192 PolarHBondContact O-N 3.47Å
191	V	57.3	Low	76.2	Confident	22 Å²	22	57.1 Å²	57.1	13%	0.133	32%	0.316	C	S	.	.	S	Bend	trans	-57.2	119.3	170.5	176.4	0	0	0	0	108.6	V137 V186 A189 Q193	V137-V191 WeakPolarHBondContact O-CG2 3.41Å; V186-V191 HydrophobicContact CG1-CG1 4.33Å; A189-V191 HydrophobicContact CB-CB 4.14Å; A189-V191 HydrophobicContact CB-CG2 3.81Å; A189-V191 PolarHBondContact O-N 3.28Å; A189-V191 VanDerWaalsContact O-N 3.12Å; V191-Q193 PolarHBondContact O-N 3.04Å
192	I	59.4	Low	76.4	Confident	61 Å²	61	54.7 Å²	54.7	31%	0.313	31%	0.307	S	S	.	.			trans	-61.2	111.4	-178.5	-54.4	172.6	0	0	0	109	G190 F222 N233 P235	G190-I192 PolarHBondContact O-N 3.47Å; I192-F222 HydrophobicContact CD1-CB 4.31Å; I192-F222 HydrophobicContact CG2-CB 4.4Å; I192-F222 HydrophobicContact CG2-CD1 3.53Å; I192-F222 HydrophobicContact CG2-CD2 3.78Å; I192-F222 HydrophobicContact CG2-CE1 3.57Å; I192-F222 HydrophobicContact CG2-CE2 3.79Å; I192-F222 HydrophobicContact CG2-CG 3.65Å; I192-F222 HydrophobicContact CG2-CZ 3.7Å; I192-N233 HydrophobicContact CB-CB 4.08Å; I192-N233 HydrophobicContact CD1-CB 4.48Å; I192-N233 PolarHBondContact O-ND2 2.91Å; I192-P235 HydrophobicContact CD1-CG 3.95Å
193	Q	59.4	Low	76.7	Confident	76 Å²	76	59.3 Å²	59.3	36%	0.355	33%	0.329	S	S	.	.			trans	-78.5	148.1	-179.3	-65.8	170.9	25.9	0	0	110.8	V186 S187 V191 T195 F222	V186-Q193 PolarHBondContact O-NE2 2.86Å; S187-Q193 VanDerWaalsContact C-NE2 3.31Å; S187-Q193 VanDerWaalsContact CA-NE2 3.34Å; S187-Q193 PolarHBondContact O-NE2 2.54Å; V191-Q193 PolarHBondContact O-N 3.04Å; Q193-T195 HydrophobicContact CB-CG2 3.95Å; Q193-T195 PolarHBondContact O-N 3.12Å; Q193-F222 WeakPolarHBondContact O-CZ 3.21Å
194	E	64.7	Low	77	Confident	81 Å²	81	56.4 Å²	56.4	38%	0.379	32%	0.318	S	S	.	.			trans	-72.9	56.9	172.3	-70.7	-172.7	-172.6	0	0	111.8	K217 Y219 A224	E194-K217 WeakPolarHBondContact OE1-CD 3.21Å; E194-K217 IonicContact OE1-NZ 3.59Å; E194-K217 PolarHBondContact OE1-NZ 3.27Å; E194-K217 WeakPolarHBondContact OE2-CD 3.38Å; E194-K217 IonicContact OE2-NZ 3.64Å; E194-K217 PolarHBondContact OE2-NZ 3.21Å; E194-Y219 WeakPolarHBondContact CB-OH 3.2Å; E194-Y219 HydrophobicContact CG-CE2 4.27Å; E194-A224 HydrophobicContact CG-CB 4.24Å
195	T	58	Low	77.4	Confident	104 Å²	104	53.1 Å²	53.1	64%	0.638	30%	0.304	S	S	*	.			trans	-85.7	123.2	-178.7	46.7	0	0	0	0	112	Q193	Q193-T195 HydrophobicContact CB-CG2 3.95Å; Q193-T195 PolarHBondContact O-N 3.12Å
196	G	67.3	Low	77.9	Confident	63 Å²	63	56 Å²	56	65%	0.649	32%	0.319	S	S	*	.	S	Bend	trans	93.7	175.3	-179.2	0	0	0	0	0	114.2
197	K	79.4	Confident	78.5	Confident	154 Å²	154	54 Å²	54	67%	0.67	31%	0.307	S	S	*	.			trans	-73.5	127.8	179.3	-171.7	-179.3	174	-167.5	0	109.9	G288	K197-G288 WeakPolarHBondContact CD-O 3.45Å; K197-G288 PolarHBondContact NZ-O 2.99Å
198	A	86.6	Confident	79.1	Confident	14 Å²	14	51 Å²	51	12%	0.116	29%	0.286	C	S	.	.			trans	-60.1	143.5	171.5	0	0	0	0	0	110.7	V201 K217 Y219	A198-V201 HydrophobicContact CB-CG2 3.91Å; A198-K217 HydrophobicContact CB-CB 4.34Å; A198-Y219 HydrophobicContact CB-CE1 4.08Å; A198-Y219 HydrophobicContact CB-CE2 4.32Å
199	L	88.1	Confident	79.8	Confident	2 Å²	2	47.8 Å²	47.8	1%	0.01	27%	0.273	C	S	.	.	S	Bend	trans	-69.7	-35.7	176.1	174.6	57.9	0	0	0	111.3	I218 L287 G288 L289 L294 Y298 I321	L199-I218 WeakPolarHBondContact CB-O 3.37Å; L199-I218 PolarHBondContact N-O 3.46Å; L199-L287 HydrophobicContact CD1-CB 3.96Å; L199-L287 HydrophobicContact CD1-CD1 4.27Å; L199-L287 HydrophobicContact CD1-CD2 4.35Å; L199-L287 HydrophobicContact CD1-CG 4.44Å; L199-L287 HydrophobicContact CG-CD2 4.48Å; L199-L287 CarbonylContact O-C 3.55Å; L199-L287 VanDerWaalsContact O-CA 3.28Å; L199-L287 WeakPolarHBondContact O-CA 3.21Å; L199-L287 WeakPolarHBondContact O-CD2 3.44Å; L199-G288 PolarHBondContact O-N 3.34Å; L199-L289 HydrophobicContact CD1-CB 4.29Å; L199-L289 HydrophobicContact CD1-CD1 3.91Å; L199-L289 HydrophobicContact CD1-CG 3.9Å; L199-L294 HydrophobicContact CD1-CD2 3.93Å; L199-Y298 HydrophobicContact CD2-CE2 4.19Å; L199-I321 HydrophobicContact CD2-CD1 3.65Å; L199-I321 HydrophobicContact CD2-CG1 4.1Å
200	A	90.3	Very high	80.8	Confident	6 Å²	6	47.3 Å²	47.3	5%	0.05	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	158.6	168.3	0	0	0	0	0	109.5	I218 L287 I317	A200-I218 HydrophobicContact CB-CB 4.34Å; A200-I218 HydrophobicContact CB-CD1 4.33Å; A200-I218 PolarHBondContact O-N 3.39Å; A200-L287 HydrophobicContact CB-CD2 4.01Å; A200-I317 HydrophobicContact CB-CD1 4.2Å
201	V	92.1	Very high	82.5	Confident	58 Å²	58	54.6 Å²	54.6	35%	0.352	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	134.7	172.3	-176.3	0	0	0	0	108	A198 E203 K217	A198-V201 HydrophobicContact CB-CG2 3.91Å; V201-E203 HydrophobicContact CG1-CG 4.14Å; V201-K217 HydrophobicContact CG1-CG 4.16Å; V201-K217 HydrophobicContact CG2-CG 4.2Å
202	L	92.5	Very high	84.2	Confident	7 Å²	7	54.7 Å²	54.7	4%	0.037	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	110	177.9	-59.2	175.4	0	0	0	108.4	I205 D215 I216 I218 L285 L310 L314	L202-I205 HydrophobicContact CB-CD1 4.03Å; L202-I205 HydrophobicContact CB-CG1 3.76Å; L202-D215 CarbonylContact O-C 3.58Å; L202-D215 WeakPolarHBondContact O-CA 3.39Å; L202-I216 HydrophobicContact CB-CB 4.31Å; L202-I216 PolarHBondContact N-O 2.91Å; L202-I216 PolarHBondContact O-N 2.9Å; L202-I218 HydrophobicContact CD1-CD1 4.23Å; L202-L285 HydrophobicContact CD2-CD1 3.5Å; L202-L285 HydrophobicContact CD2-CD2 4.4Å; L202-L310 HydrophobicContact CD2-CD1 4.01Å; L202-L314 HydrophobicContact CD1-CB 4.48Å; L202-L314 HydrophobicContact CD1-CD1 3.68Å
203	E	92.4	Very high	85.9	Confident	148 Å²	148	58.7 Å²	58.7	69%	0.692	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.2	146.2	-170.9	-60.7	-172.5	171.7	0	0	112.7	V201 I205 D215	V201-E203 HydrophobicContact CG1-CG 4.14Å; E203-I205 PolarHBondContact O-N 2.77Å; E203-D215 WeakPolarHBondContact CA-OD1 3.37Å
204	Q	92.2	Very high	87.6	Confident	68 Å²	68	55.6 Å²	55.6	32%	0.318	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	53.1	23.6	171.6	-65.4	-58.7	-73.3	0	0	116.8	L206 R213 D215	Q204-L206 PolarHBondContact O-N 2.76Å; Q204-R213 WeakPolarHBondContact O-CD 3.37Å; Q204-R213 WeakPolarHBondContact O-CG 3.29Å; Q204-R213 PolarHBondContact O-NH1 3.28Å; Q204-D215 PolarHBondContact N-OD1 3.49Å; Q204-D215 PolarHBondContact NE2-OD1 2.83Å; Q204-D215 PolarHBondContact NE2-OD2 3.02Å
205	I	94.7	Very high	89	Confident	10 Å²	10	53.2 Å²	53.2	5%	0.051	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.2	131.7	179	-58.4	-61.4	0	0	0	110.9	L202 E203 C207 R213 Y214 I216 L275 L277 L310	L202-I205 HydrophobicContact CB-CD1 4.03Å; L202-I205 HydrophobicContact CB-CG1 3.76Å; E203-I205 PolarHBondContact O-N 2.77Å; I205-C207 PolarHBondContact O-N 2.99Å; I205-R213 VanDerWaalsContact O-CA 3.31Å; I205-R213 WeakPolarHBondContact O-CA 3.39Å; I205-Y214 PolarHBondContact N-O 2.84Å; I205-Y214 PolarHBondContact O-N 3.07Å; I205-I216 HydrophobicContact CB-CD1 4.02Å; I205-I216 HydrophobicContact CB-CG1 4.31Å; I205-I216 HydrophobicContact CG1-CD1 4.16Å; I205-I216 HydrophobicContact CG1-CG1 4.3Å; I205-I216 HydrophobicContact CG2-CD1 3.92Å; I205-L275 HydrophobicContact CG2-CB 4.27Å; I205-L275 HydrophobicContact CG2-CD1 4.36Å; I205-L275 HydrophobicContact CG2-CD2 4.16Å; I205-L275 HydrophobicContact CG2-CG 4.5Å; I205-L277 HydrophobicContact CD1-CD2 4.4Å; I205-L277 HydrophobicContact CG2-CD2 3.81Å; I205-L310 HydrophobicContact CD1-CD1 4.31Å; I205-L310 HydrophobicContact CD1-CD2 3.85Å
206	L	94.8	Very high	90.7	Very high	61 Å²	61	48.5 Å²	48.5	32%	0.319	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	113.3	179.3	179.5	62.1	0	0	0	110.5	Q204 E276	Q204-L206 PolarHBondContact O-N 2.76Å; L206-E276 HydrophobicContact CD2-CB 4.13Å; L206-E276 HydrophobicContact CD2-CG 4.22Å; L206-E276 HydrophobicContact CG-CB 4.22Å; L206-E276 PolarHBondContact O-N 2.97Å
207	C	94.2	Very high	91.9	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.007	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	123.4	171	-62.7	0	0	0	0	109.7	I205 P210 R211 G212 Y214 I274 L275	I205-C207 PolarHBondContact O-N 2.99Å; C207-P210 CarbonylContact C-O 3.59Å; C207-P210 WeakPolarHBondContact CB-O 3.38Å; C207-R211 WeakPolarHBondContact O-CA 3.06Å; C207-G212 PolarHBondContact N-O 2.84Å; C207-G212 PolarHBondContact O-N 3.36Å; C207-Y214 HydrophobicContact CB-CD2 3.73Å; C207-Y214 HydrophobicContact CB-CE2 3.98Å; C207-Y214 WeakPolarHBondContact SG-CD2 3.5Å; C207-I274 CarbonylContact C-O 3.58Å; C207-I274 WeakPolarHBondContact CA-O 3.32Å; C207-L275 WeakPolarHBondContact SG-CD2 3.35Å
208	A	92.9	Very high	92.5	Very high	6 Å²	6	40.2 Å²	40.2	5%	0.05	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	-29.4	172.7	0	0	0	0	0	112	I274	A208-I274 HydrophobicContact CB-CB 4.32Å; A208-I274 HydrophobicContact CB-CG2 3.93Å; A208-I274 PolarHBondContact N-O 2.82Å
209	T	92	Very high	92.7	Very high	7 Å²	7	40.2 Å²	40.2	4%	0.043	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	117	177.6	-63.9	0	0	0	0	108.8	Y270 L273 I274 H363 P366	T209-Y270 HydrophobicContact CG2-CD1 3.45Å; T209-Y270 VanDerWaalsContact CG2-CD1 3.45Å; T209-Y270 HydrophobicContact CG2-CE1 3.86Å; T209-Y270 HydrophobicContact CG2-CG 4.34Å; T209-L273 CarbonylContact O-C 3.48Å; T209-L273 WeakPolarHBondContact O-CA 3.44Å; T209-I274 PolarHBondContact N-O 3Å; T209-I274 PolarHBondContact O-N 3.23Å; T209-H363 PolarHBondContact OG1-O 2.95Å; T209-P366 HydrophobicContact CG2-CG 4.15Å
210	P	91.8	Very high	92.7	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	cis	-56.8	147.1	-12.8	-15.5	29.1	0	0	0	110.8	C207 G212 Y232 I263 Y270	C207-P210 CarbonylContact C-O 3.59Å; C207-P210 WeakPolarHBondContact CB-O 3.38Å; P210-G212 PolarHBondContact O-N 2.82Å; P210-Y232 HydrophobicContact CG-CE2 4.02Å; P210-I263 HydrophobicContact CG-CD1 3.78Å; P210-Y270 HydrophobicContact CB-CD2 4.15Å; P210-Y270 HydrophobicContact CB-CE2 3.78Å; P210-Y270 HydrophobicContact CG-CD2 3.66Å; P210-Y270 HydrophobicContact CG-CE2 3.84Å; P210-Y270 HydrophobicContact CG-CG 4.11Å
211	R	92.9	Very high	92.4	Very high	197 Å²	197	46.8 Å²	46.8	74%	0.743	23%	0.233	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-75.6	116.1	-175.7	-177.5	179.4	176.1	87.1	-9.2	110.8	C207	C207-R211 WeakPolarHBondContact O-CA 3.06Å
212	G	92.5	Very high	92.3	Very high	25 Å²	25	44.5 Å²	44.5	26%	0.258	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	175.9	-177.9	175.9	0	0	0	0	0	112.8	C207 P210	C207-G212 PolarHBondContact N-O 2.84Å; C207-G212 PolarHBondContact O-N 3.36Å; P210-G212 PolarHBondContact O-N 2.82Å
213	R	95.1	Very high	92.3	Very high	145 Å²	145	44.2 Å²	44.2	55%	0.547	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	136.5	158.3	-74.8	-175	179.4	-95.4	8.5	108.2	Q204 I205	Q204-R213 WeakPolarHBondContact O-CD 3.37Å; Q204-R213 WeakPolarHBondContact O-CG 3.29Å; Q204-R213 PolarHBondContact O-NH1 3.28Å; I205-R213 VanDerWaalsContact O-CA 3.31Å; I205-R213 WeakPolarHBondContact O-CA 3.39Å
214	Y	94.8	Very high	92.2	Very high	10 Å²	10	37.2 Å²	37.2	4%	0.039	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	141.8	-179.3	-66.7	-98.6	0	0	0	110.2	I205 C207 L225 H226 F230 Y232	I205-Y214 PolarHBondContact N-O 2.84Å; I205-Y214 PolarHBondContact O-N 3.07Å; C207-Y214 HydrophobicContact CB-CD2 3.73Å; C207-Y214 HydrophobicContact CB-CE2 3.98Å; C207-Y214 WeakPolarHBondContact SG-CD2 3.5Å; Y214-L225 HydrophobicContact CD1-CB 4.05Å; Y214-H226 CarbonylContact C-O 3.48Å; Y214-H226 WeakPolarHBondContact CA-O 3.37Å; Y214-H226 WeakPolarHBondContact CB-O 3.38Å; Y214-F230 WeakPolarHBondContact CE1-O 3.32Å; Y214-Y232 HydrophobicContact CE1-CD2 4.11Å; Y214-Y232 AromaticContact CE1-CE2 3.74Å; Y214-Y232 HydrophobicContact CE1-CE2 3.74Å; Y214-Y232 AromaticContact CZ-CE2 3.96Å
215	D	94.3	Very high	92.2	Very high	31 Å²	31	34 Å²	34	17%	0.166	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	120.3	168.4	-44.7	-58.3	0	0	0	107.4	L202 E203 Q204 H226	L202-D215 CarbonylContact O-C 3.58Å; L202-D215 WeakPolarHBondContact O-CA 3.39Å; E203-D215 WeakPolarHBondContact CA-OD1 3.37Å; Q204-D215 PolarHBondContact N-OD1 3.49Å; Q204-D215 PolarHBondContact NE2-OD1 2.83Å; Q204-D215 PolarHBondContact NE2-OD2 3.02Å; D215-H226 HydrophobicContact CB-CB 4.33Å; D215-H226 PolarHBondContact N-O 3.44Å; D215-H226 PolarHBondContact O-N 3.39Å; D215-H226 IonicContact OD2-CD2 3.42Å
216	I	94.2	Very high	91.9	Very high	6 Å²	6	37.2 Å²	37.2	3%	0.031	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	103.1	-174.5	-49.4	-178.6	0	0	0	108.6	L202 I205 I218 L225 L275	L202-I216 HydrophobicContact CB-CB 4.31Å; L202-I216 PolarHBondContact N-O 2.91Å; L202-I216 PolarHBondContact O-N 2.9Å; I205-I216 HydrophobicContact CB-CD1 4.02Å; I205-I216 HydrophobicContact CB-CG1 4.31Å; I205-I216 HydrophobicContact CG1-CD1 4.16Å; I205-I216 HydrophobicContact CG1-CG1 4.3Å; I205-I216 HydrophobicContact CG2-CD1 3.92Å; I216-I218 HydrophobicContact CG2-CG1 4.33Å; I216-L225 HydrophobicContact CG1-CG 4.41Å; I216-L225 HydrophobicContact CG2-CD1 4.37Å; I216-L275 HydrophobicContact CD1-CD1 3.79Å; I216-L275 HydrophobicContact CD1-CD2 3.81Å; I216-L275 HydrophobicContact CD1-CG 4.48Å
217	K	92.6	Very high	91.5	Very high	43 Å²	43	34.7 Å²	34.7	19%	0.187	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	127.4	172.4	-56.5	167.5	-171	162.3	0	108.9	E194 A198 V201 Y219 A224	E194-K217 WeakPolarHBondContact OE1-CD 3.21Å; E194-K217 IonicContact OE1-NZ 3.59Å; E194-K217 PolarHBondContact OE1-NZ 3.27Å; E194-K217 WeakPolarHBondContact OE2-CD 3.38Å; E194-K217 IonicContact OE2-NZ 3.64Å; E194-K217 PolarHBondContact OE2-NZ 3.21Å; A198-K217 HydrophobicContact CB-CB 4.34Å; V201-K217 HydrophobicContact CG1-CG 4.16Å; V201-K217 HydrophobicContact CG2-CG 4.2Å; K217-Y219 HydrophobicContact CB-CD2 4.48Å; K217-Y219 HydrophobicContact CB-CE2 3.75Å; K217-A224 HydrophobicContact CB-CB 4.27Å; K217-A224 PolarHBondContact N-O 2.8Å; K217-A224 PolarHBondContact O-N 3.32Å
218	I	92.6	Very high	91	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	121.3	-173.3	-58	-172.5	0	0	0	108.4	L199 A200 L202 I216 L223 L314 I317 I321	L199-I218 WeakPolarHBondContact CB-O 3.37Å; L199-I218 PolarHBondContact N-O 3.46Å; A200-I218 HydrophobicContact CB-CB 4.34Å; A200-I218 HydrophobicContact CB-CD1 4.33Å; A200-I218 PolarHBondContact O-N 3.39Å; L202-I218 HydrophobicContact CD1-CD1 4.23Å; I216-I218 HydrophobicContact CG2-CG1 4.33Å; I218-L223 HydrophobicContact CB-CD2 4.21Å; I218-L223 HydrophobicContact CG1-CD2 4.09Å; I218-L223 HydrophobicContact CG2-CD2 3.86Å; I218-L314 HydrophobicContact CD1-CD1 4.35Å; I218-I317 HydrophobicContact CD1-CG2 3.81Å; I218-I317 HydrophobicContact CG2-CG2 4.05Å; I218-I321 HydrophobicContact CG2-CD1 3.24Å
219	Y	90.4	Very high	90.3	Very high	13 Å²	13	47.8 Å²	47.8	5%	0.051	24%	0.236	C	C	.	.			trans	-115.7	162.2	174.2	-64.1	-94.3	0	0	0	110.5	E194 A198 K217 S221 F222 A224	E194-Y219 WeakPolarHBondContact CB-OH 3.2Å; E194-Y219 HydrophobicContact CG-CE2 4.27Å; A198-Y219 HydrophobicContact CB-CE1 4.08Å; A198-Y219 HydrophobicContact CB-CE2 4.32Å; K217-Y219 HydrophobicContact CB-CD2 4.48Å; K217-Y219 HydrophobicContact CB-CE2 3.75Å; Y219-S221 PolarHBondContact O-N 3.36Å; Y219-F222 CarbonylContact C-O 3.58Å; Y219-F222 WeakPolarHBondContact CA-O 3.25Å; Y219-F222 WeakPolarHBondContact CB-O 3.48Å; Y219-F222 HydrophobicContact CD1-CE1 4.17Å; Y219-F222 HydrophobicContact CD1-CZ 4.08Å; Y219-F222 HydrophobicContact CD2-CD1 4.49Å; Y219-F222 HydrophobicContact CD2-CD2 4.09Å; Y219-F222 AromaticContact CD2-CE1 3.97Å; Y219-F222 HydrophobicContact CD2-CE1 3.97Å; Y219-F222 AromaticContact CD2-CE2 3.52Å; Y219-F222 HydrophobicContact CD2-CE2 3.52Å; Y219-F222 AromaticContact CD2-CZ 3.45Å; Y219-F222 HydrophobicContact CD2-CZ 3.45Å; Y219-F222 VanDerWaalsContact CD2-CZ 3.45Å; Y219-F222 HydrophobicContact CE1-CZ 4.41Å; Y219-F222 AromaticContact CE2-CE2 3.89Å; Y219-F222 HydrophobicContact CE2-CE2 3.89Å; Y219-F222 AromaticContact CE2-CZ 3.85Å; Y219-F222 HydrophobicContact CE2-CZ 3.85Å; Y219-F222 HydrophobicContact CG-CD1 4.25Å; Y219-F222 AromaticContact CG-CE1 3.67Å; Y219-F222 HydrophobicContact CG-CE1 3.67Å; Y219-F222 HydrophobicContact CG-CE2 4.11Å; Y219-F222 AromaticContact CG-CZ 3.59Å; Y219-F222 HydrophobicContact CG-CZ 3.59Å; Y219-F222 PolarHBondContact N-O 3Å; Y219-A224 HydrophobicContact CE2-CB 4.28Å
220	P	87	Confident	89.8	Confident	68 Å²	68	49.7 Å²	49.7	44%	0.442	24%	0.244	S	C	.	.	S	Bend	trans	-62.1	-23.2	-179.2	-26.4	36.5	0	0	0	115.1
221	S	85.4	Confident	89.4	Confident	79 Å²	79	52.3 Å²	52.3	55%	0.552	26%	0.258	S	S	*	.	S	Bend	trans	-118.4	-15.7	-175.5	48.9	0	0	0	0	114.8	Y219 I236	Y219-S221 PolarHBondContact O-N 3.36Å; S221-I236 VanDerWaalsContact C-CG1 3.47Å; S221-I236 PolarHBondContact O-N 2.79Å
222	F	90.2	Very high	89	Confident	9 Å²	9	43.8 Å²	43.8	4%	0.039	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	167.5	178.8	68.4	-76.8	0	0	0	112.2	I192 Q193 Y219 A224 N233 I234	I192-F222 HydrophobicContact CD1-CB 4.31Å; I192-F222 HydrophobicContact CG2-CB 4.4Å; I192-F222 HydrophobicContact CG2-CD1 3.53Å; I192-F222 HydrophobicContact CG2-CD2 3.78Å; I192-F222 HydrophobicContact CG2-CE1 3.57Å; I192-F222 HydrophobicContact CG2-CE2 3.79Å; I192-F222 HydrophobicContact CG2-CG 3.65Å; I192-F222 HydrophobicContact CG2-CZ 3.7Å; Q193-F222 WeakPolarHBondContact O-CZ 3.21Å; Y219-F222 CarbonylContact C-O 3.58Å; Y219-F222 WeakPolarHBondContact CA-O 3.25Å; Y219-F222 WeakPolarHBondContact CB-O 3.48Å; Y219-F222 HydrophobicContact CD1-CE1 4.17Å; Y219-F222 HydrophobicContact CD1-CZ 4.08Å; Y219-F222 HydrophobicContact CD2-CD1 4.49Å; Y219-F222 HydrophobicContact CD2-CD2 4.09Å; Y219-F222 AromaticContact CD2-CE1 3.97Å; Y219-F222 HydrophobicContact CD2-CE1 3.97Å; Y219-F222 AromaticContact CD2-CE2 3.52Å; Y219-F222 HydrophobicContact CD2-CE2 3.52Å; Y219-F222 AromaticContact CD2-CZ 3.45Å; Y219-F222 HydrophobicContact CD2-CZ 3.45Å; Y219-F222 VanDerWaalsContact CD2-CZ 3.45Å; Y219-F222 HydrophobicContact CE1-CZ 4.41Å; Y219-F222 AromaticContact CE2-CE2 3.89Å; Y219-F222 HydrophobicContact CE2-CE2 3.89Å; Y219-F222 AromaticContact CE2-CZ 3.85Å; Y219-F222 HydrophobicContact CE2-CZ 3.85Å; Y219-F222 HydrophobicContact CG-CD1 4.25Å; Y219-F222 AromaticContact CG-CE1 3.67Å; Y219-F222 HydrophobicContact CG-CE1 3.67Å; Y219-F222 HydrophobicContact CG-CE2 4.11Å; Y219-F222 AromaticContact CG-CZ 3.59Å; Y219-F222 HydrophobicContact CG-CZ 3.59Å; Y219-F222 PolarHBondContact N-O 3Å; F222-A224 HydrophobicContact CD2-CB 4.45Å; F222-A224 HydrophobicContact CE2-CB 4.12Å; F222-N233 HydrophobicContact CD2-CB 4.35Å; F222-I234 CarbonylContact C-O 3.56Å; F222-I234 VanDerWaalsContact CA-O 3.22Å; F222-I234 WeakPolarHBondContact CA-O 3.36Å; F222-I234 WeakPolarHBondContact CB-O 3.47Å
223	L	91.6	Very high	88.7	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.01	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	130.8	167.1	-51	174.7	0	0	0	108	I218 L225 N233 I234 I236 I239 M318	I218-L223 HydrophobicContact CB-CD2 4.21Å; I218-L223 HydrophobicContact CG1-CD2 4.09Å; I218-L223 HydrophobicContact CG2-CD2 3.86Å; L223-L225 HydrophobicContact CB-CD1 4.35Å; L223-N233 CarbonylContact O-C 3.56Å; L223-N233 WeakPolarHBondContact O-CA 3.07Å; L223-I234 HydrophobicContact CB-CB 4.42Å; L223-I234 PolarHBondContact N-O 3.01Å; L223-I234 PolarHBondContact O-N 2.99Å; L223-I236 HydrophobicContact CD1-CD1 4.46Å; L223-I236 HydrophobicContact CD2-CD1 3.86Å; L223-I236 HydrophobicContact CG-CD1 3.87Å; L223-I239 HydrophobicContact CD1-CD1 3.86Å; L223-M318 HydrophobicContact CD1-CE 3.73Å; L223-M318 HydrophobicContact CD1-SD 3.97Å; L223-M318 HydrophobicContact CD2-SD 4.16Å
224	A	90	Very high	88.4	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.008	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	118.1	168.9	0	0	0	0	0	109	E194 K217 Y219 F222 N233	E194-A224 HydrophobicContact CG-CB 4.24Å; K217-A224 HydrophobicContact CB-CB 4.27Å; K217-A224 PolarHBondContact N-O 2.8Å; K217-A224 PolarHBondContact O-N 3.32Å; Y219-A224 HydrophobicContact CE2-CB 4.28Å; F222-A224 HydrophobicContact CD2-CB 4.45Å; F222-A224 HydrophobicContact CE2-CB 4.12Å; A224-N233 WeakPolarHBondContact CA-OD1 3.33Å; A224-N233 WeakPolarHBondContact CB-OD1 3.35Å
225	L	91.5	Very high	88.1	Confident	1 Å²	1	40 Å²	40	1%	0.005	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	106.8	167.6	-82.8	69.6	0	0	0	107.5	Y214 I216 L223 N231 Y232 I234 L273	Y214-L225 HydrophobicContact CD1-CB 4.05Å; I216-L225 HydrophobicContact CG1-CG 4.41Å; I216-L225 HydrophobicContact CG2-CD1 4.37Å; L223-L225 HydrophobicContact CB-CD1 4.35Å; L225-N231 CarbonylContact O-C 3.49Å; L225-N231 VanDerWaalsContact O-CA 3.26Å; L225-N231 WeakPolarHBondContact O-CA 3.36Å; L225-Y232 HydrophobicContact CB-CD2 4.27Å; L225-Y232 HydrophobicContact CD2-CD2 4.35Å; L225-Y232 PolarHBondContact N-O 2.87Å; L225-Y232 PolarHBondContact O-N 2.96Å; L225-I234 HydrophobicContact CD1-CD1 3.77Å; L225-I234 HydrophobicContact CD1-CG1 4.39Å; L225-I234 HydrophobicContact CD2-CD1 4.46Å; L225-L273 HydrophobicContact CD1-CD2 4.12Å; L225-L273 HydrophobicContact CD2-CD1 3.77Å; L225-L273 HydrophobicContact CD2-CD2 3.64Å; L225-L273 HydrophobicContact CD2-CG 4.37Å; L225-L273 HydrophobicContact CG-CD2 4.46Å
226	H	88.8	Confident	88	Confident	77 Å²	77	39.5 Å²	39.5	36%	0.356	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	133.4	173.2	-167.3	74.5	0	0	0	110	Y214 D215 N231	Y214-H226 CarbonylContact C-O 3.48Å; Y214-H226 WeakPolarHBondContact CA-O 3.37Å; Y214-H226 WeakPolarHBondContact CB-O 3.38Å; D215-H226 HydrophobicContact CB-CB 4.33Å; D215-H226 PolarHBondContact N-O 3.44Å; D215-H226 PolarHBondContact O-N 3.39Å; D215-H226 IonicContact OD2-CD2 3.42Å; H226-N231 WeakPolarHBondContact CA-OD1 3.29Å; H226-N231 PolarHBondContact ND1-OD1 3.45Å; H226-N231 VanDerWaalsContact ND1-OD1 3.09Å
227	G	87.5	Confident	87.8	Confident	7 Å²	7	44.3 Å²	44.3	7%	0.072	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	158.4	-177.3	0	0	0	0	0	112.2	T229 F230 N231	G227-T229 PolarHBondContact O-N 3.18Å; G227-F230 WeakPolarHBondContact CA-O 3.14Å; G227-F230 PolarHBondContact N-O 3.49Å; G227-N231 PolarHBondContact N-OD1 2.89Å; G227-N231 PolarHBondContact O-OD1 2.77Å
228	K	83.1	Confident	87.6	Confident	188 Å²	188	42.7 Å²	42.7	82%	0.817	24%	0.238	S	C	*	.	S	Bend	trans	-61.7	-0.3	-173.7	-60.6	-166.9	177.4	-167.9	0	116.2
229	T	78.9	Confident	87.7	Confident	95 Å²	95	42.7 Å²	42.7	58%	0.583	24%	0.238	S	C	*	.	S	Bend	trans	-156.5	-33.3	-175.3	-43.9	0	0	0	0	112.3	G227	G227-T229 PolarHBondContact O-N 3.18Å
230	F	80.8	Confident	87.7	Confident	47 Å²	47	46.9 Å²	46.9	21%	0.206	26%	0.261	C	S	.	.			trans	-131.8	139.6	-179.8	-58.3	-85.2	0	0	0	109.5	Y214 G227 Y232 Q265	Y214-F230 WeakPolarHBondContact CE1-O 3.32Å; G227-F230 WeakPolarHBondContact CA-O 3.14Å; G227-F230 PolarHBondContact N-O 3.49Å; F230-Y232 HydrophobicContact CB-CE1 4.07Å; F230-Y232 HydrophobicContact CB-CE2 4.24Å; F230-Y232 WeakPolarHBondContact CB-OH 3.27Å; F230-Q265 HydrophobicContact CD1-CG 3.82Å; F230-Q265 HydrophobicContact CD2-CG 4.12Å; F230-Q265 HydrophobicContact CE1-CG 3.78Å; F230-Q265 HydrophobicContact CE2-CG 4.11Å; F230-Q265 HydrophobicContact CG-CG 3.99Å; F230-Q265 HydrophobicContact CZ-CG 3.94Å
231	N	83.4	Confident	87.9	Confident	55 Å²	55	43.9 Å²	43.9	29%	0.294	24%	0.243	S	C	.	.			trans	-124.1	140.4	177.8	-60.5	-50.5	0	0	0	108.7	L225 H226 G227	L225-N231 CarbonylContact O-C 3.49Å; L225-N231 VanDerWaalsContact O-CA 3.26Å; L225-N231 WeakPolarHBondContact O-CA 3.36Å; H226-N231 WeakPolarHBondContact CA-OD1 3.29Å; H226-N231 PolarHBondContact ND1-OD1 3.45Å; H226-N231 VanDerWaalsContact ND1-OD1 3.09Å; G227-N231 PolarHBondContact N-OD1 2.89Å; G227-N231 PolarHBondContact O-OD1 2.77Å
232	Y	84.8	Confident	88.4	Confident	17 Å²	17	40.1 Å²	40.1	7%	0.067	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	122.2	-178.1	-47.3	-64.3	0	0	0	111.3	P210 Y214 L225 F230 I263 K264 Q265	P210-Y232 HydrophobicContact CG-CE2 4.02Å; Y214-Y232 HydrophobicContact CE1-CD2 4.11Å; Y214-Y232 AromaticContact CE1-CE2 3.74Å; Y214-Y232 HydrophobicContact CE1-CE2 3.74Å; Y214-Y232 AromaticContact CZ-CE2 3.96Å; L225-Y232 HydrophobicContact CB-CD2 4.27Å; L225-Y232 HydrophobicContact CD2-CD2 4.35Å; L225-Y232 PolarHBondContact N-O 2.87Å; L225-Y232 PolarHBondContact O-N 2.96Å; F230-Y232 HydrophobicContact CB-CE1 4.07Å; F230-Y232 HydrophobicContact CB-CE2 4.24Å; F230-Y232 WeakPolarHBondContact CB-OH 3.27Å; Y232-I263 HydrophobicContact CD1-CB 4.37Å; Y232-I263 HydrophobicContact CD2-CD1 4.01Å; Y232-I263 HydrophobicContact CE2-CD1 4.32Å; Y232-I263 HydrophobicContact CG-CB 4.45Å; Y232-I263 HydrophobicContact CG-CD1 4.23Å; Y232-K264 WeakPolarHBondContact CE1-O 3.31Å; Y232-Q265 VanDerWaalsContact OH-CD 3.32Å; Y232-Q265 WeakPolarHBondContact OH-CG 3.26Å; Y232-Q265 PolarHBondContact OH-OE1 2.93Å
233	N	86.1	Confident	88.6	Confident	55 Å²	55	39.8 Å²	39.8	29%	0.294	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	113.8	169.5	-67.1	-42.2	0	0	0	109.3	I192 F222 L223 A224	I192-N233 HydrophobicContact CB-CB 4.08Å; I192-N233 HydrophobicContact CD1-CB 4.48Å; I192-N233 PolarHBondContact O-ND2 2.91Å; F222-N233 HydrophobicContact CD2-CB 4.35Å; L223-N233 CarbonylContact O-C 3.56Å; L223-N233 WeakPolarHBondContact O-CA 3.07Å; A224-N233 WeakPolarHBondContact CA-OD1 3.33Å; A224-N233 WeakPolarHBondContact CB-OD1 3.35Å
234	I	89.3	Confident	88.8	Confident	2 Å²	2	40.7 Å²	40.7	1%	0.01	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	108.2	-173.5	-57.3	-177.6	0	0	0	108.5	F222 L223 L225 I236 S238 I239 L259 I263 L273	F222-I234 CarbonylContact C-O 3.56Å; F222-I234 VanDerWaalsContact CA-O 3.22Å; F222-I234 WeakPolarHBondContact CA-O 3.36Å; F222-I234 WeakPolarHBondContact CB-O 3.47Å; L223-I234 HydrophobicContact CB-CB 4.42Å; L223-I234 PolarHBondContact N-O 3.01Å; L223-I234 PolarHBondContact O-N 2.99Å; L225-I234 HydrophobicContact CD1-CD1 3.77Å; L225-I234 HydrophobicContact CD1-CG1 4.39Å; L225-I234 HydrophobicContact CD2-CD1 4.46Å; I234-I236 PolarHBondContact O-N 2.97Å; I234-S238 WeakPolarHBondContact CG2-OG 3.45Å; I234-I239 HydrophobicContact CG2-CG1 4.2Å; I234-L259 HydrophobicContact CD1-CD1 4.06Å; I234-L259 HydrophobicContact CD1-CD2 4.44Å; I234-L259 HydrophobicContact CG2-CD2 3.62Å; I234-I263 HydrophobicContact CD1-CD1 4.44Å; I234-I263 HydrophobicContact CD1-CG2 3.95Å; I234-I263 HydrophobicContact CG1-CG2 3.78Å; I234-L273 HydrophobicContact CD1-CD2 3.97Å
235	P	88.6	Confident	89.1	Confident	43 Å²	43	40.6 Å²	40.6	28%	0.279	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	137.4	174.5	-21.8	31.7	0	0	0	111	I192 S237 S238	I192-P235 HydrophobicContact CD1-CG 3.95Å; P235-S237 WeakPolarHBondContact CB-OG 3.5Å; P235-S237 PolarHBondContact O-N 2.86Å; P235-S238 WeakPolarHBondContact O-CB 3.42Å; P235-S238 PolarHBondContact O-N 2.9Å; P235-S238 PolarHBondContact O-OG 3.38Å
236	I	91.9	Very high	89.2	Confident	22 Å²	22	42.3 Å²	42.3	11%	0.113	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-59.7	-30.3	176.3	-68.1	-65.6	0	0	0	111.4	S221 L223 I234 S238 I239 I321 V322	S221-I236 VanDerWaalsContact C-CG1 3.47Å; S221-I236 PolarHBondContact O-N 2.79Å; L223-I236 HydrophobicContact CD1-CD1 4.46Å; L223-I236 HydrophobicContact CD2-CD1 3.86Å; L223-I236 HydrophobicContact CG-CD1 3.87Å; I234-I236 PolarHBondContact O-N 2.97Å; I236-S238 VanDerWaalsContact C-N 3.3Å; I236-S238 PolarHBondContact O-N 2.6Å; I236-I239 HydrophobicContact CD1-CD1 3.95Å; I236-I239 PolarHBondContact O-N 2.79Å; I236-I321 HydrophobicContact CD1-CG2 3.64Å; I236-I321 HydrophobicContact CG1-CG2 3.81Å; I236-I321 HydrophobicContact CG2-CG2 4.25Å; I236-V322 HydrophobicContact CD1-CG2 4.13Å; I236-V322 HydrophobicContact CG2-CB 4.45Å; I236-V322 HydrophobicContact CG2-CG2 4.28Å
237	S	89.2	Confident	89.4	Confident	106 Å²	106	39.8 Å²	39.8	74%	0.741	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	-61.1	-31.8	172.5	48.1	0	0	0	0	114	P235 I239	P235-S237 WeakPolarHBondContact CB-OG 3.5Å; P235-S237 PolarHBondContact O-N 2.86Å; S237-I239 VanDerWaalsContact C-N 3.26Å; S237-I239 PolarHBondContact O-N 3.2Å
238	S	89.4	Confident	89.5	Confident	9 Å²	9	42 Å²	42	6%	0.063	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-75.4	-11.8	179.9	72.6	0	0	0	0	113.9	I234 P235 I236 L240 L259 D260	I234-S238 WeakPolarHBondContact CG2-OG 3.45Å; P235-S238 WeakPolarHBondContact O-CB 3.42Å; P235-S238 PolarHBondContact O-N 2.9Å; P235-S238 PolarHBondContact O-OG 3.38Å; I236-S238 VanDerWaalsContact C-N 3.3Å; I236-S238 PolarHBondContact O-N 2.6Å; S238-L240 PolarHBondContact O-N 2.96Å; S238-L240 VanDerWaalsContact O-N 3.08Å; S238-L259 WeakPolarHBondContact O-CA 3.25Å; S238-D260 WeakPolarHBondContact CA-O 3.32Å; S238-D260 VanDerWaalsContact CB-O 3.3Å; S238-D260 WeakPolarHBondContact CB-O 3.47Å; S238-D260 PolarHBondContact O-N 2.99Å
239	I	93.5	Very high	89.8	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	97.6	-177.5	-61.2	174.9	0	0	0	108.8	L223 I234 I236 S237 G241 L242 I257 G258 L259 M318 V322 K324	L223-I239 HydrophobicContact CD1-CD1 3.86Å; I234-I239 HydrophobicContact CG2-CG1 4.2Å; I236-I239 HydrophobicContact CD1-CD1 3.95Å; I236-I239 PolarHBondContact O-N 2.79Å; S237-I239 VanDerWaalsContact C-N 3.26Å; S237-I239 PolarHBondContact O-N 3.2Å; I239-G241 VanDerWaalsContact C-N 3.32Å; I239-G241 PolarHBondContact O-N 3.08Å; I239-L242 HydrophobicContact CG2-CD2 3.81Å; I239-L242 HydrophobicContact CG2-CG 4.45Å; I239-I257 HydrophobicContact CB-CG2 4.33Å; I239-I257 HydrophobicContact CD1-CG2 4.07Å; I239-I257 HydrophobicContact CG1-CG2 3.89Å; I239-I257 HydrophobicContact CG2-CG2 3.63Å; I239-G258 CarbonylContact C-O 3.51Å; I239-G258 WeakPolarHBondContact CA-O 3.23Å; I239-L259 HydrophobicContact CG1-CD2 4.06Å; I239-M318 HydrophobicContact CD1-CE 4.11Å; I239-V322 HydrophobicContact CB-CG1 3.99Å; I239-V322 HydrophobicContact CD1-CG2 3.86Å; I239-V322 HydrophobicContact CG2-CG1 3.77Å; I239-V322 HydrophobicContact CG2-CG2 4.41Å; I239-K324 PolarHBondContact O-NZ 2.69Å
240	L	91.1	Very high	90.2	Very high	102 Å²	102	33.6 Å²	33.6	53%	0.534	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	-41.9	179	-73.3	-171.6	0	0	0	112.1	S238 G258 D260 K324	S238-L240 PolarHBondContact O-N 2.96Å; S238-L240 VanDerWaalsContact O-N 3.08Å; L240-G258 PolarHBondContact N-O 3.21Å; L240-D260 HydrophobicContact CD1-CB 3.56Å; L240-D260 HydrophobicContact CD2-CB 3.86Å; L240-D260 HydrophobicContact CG-CB 3.53Å; L240-K324 WeakPolarHBondContact O-CD 3.3Å; L240-K324 PolarHBondContact O-NZ 2.93Å
241	G	91.1	Very high	90.7	Very high	5 Å²	5	39.9 Å²	39.9	5%	0.052	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177.9	164	174.1	0	0	0	0	0	114.6	I239 G258	I239-G241 VanDerWaalsContact C-N 3.32Å; I239-G241 PolarHBondContact O-N 3.08Å; G241-G258 PolarHBondContact O-N 3.31Å
242	L	95.7	Very high	91.2	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	151.6	-170.9	-56.1	173.4	0	0	0	111.7	I239 F255 V256 I257 M318 V322 I326 R327	I239-L242 HydrophobicContact CG2-CD2 3.81Å; I239-L242 HydrophobicContact CG2-CG 4.45Å; L242-F255 HydrophobicContact CB-CZ 4.47Å; L242-F255 HydrophobicContact CD1-CZ 4.41Å; L242-F255 HydrophobicContact CD2-CE1 4.14Å; L242-F255 HydrophobicContact CD2-CZ 4.18Å; L242-V256 CarbonylContact C-O 3.57Å; L242-V256 WeakPolarHBondContact CA-O 3.16Å; L242-I257 HydrophobicContact CD2-CB 4.39Å; L242-I257 HydrophobicContact CD2-CG1 3.91Å; L242-I257 HydrophobicContact CD2-CG2 4.2Å; L242-M318 HydrophobicContact CD1-CB 3.95Å; L242-M318 HydrophobicContact CD2-CE 3.77Å; L242-V322 HydrophobicContact CD1-CB 4.24Å; L242-V322 HydrophobicContact CD1-CG2 4.3Å; L242-I326 HydrophobicContact CB-CB 4.41Å; L242-I326 HydrophobicContact CB-CG1 3.81Å; L242-I326 HydrophobicContact CD1-CD1 4.45Å; L242-I326 HydrophobicContact CD1-CG1 3.84Å; L242-I326 HydrophobicContact CG-CG1 4.49Å; L242-R327 PolarHBondContact O-N 3.22Å; L242-R327 PolarHBondContact O-NE 2.88Å
243	F	95.4	Very high	91.7	Very high	1 Å²	1	41.4 Å²	41.4	0%	0.004	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	147.1	173.2	-46.5	-107.8	0	0	0	110.6	L245 V256 F272 R327 M355 M360 H368	F243-L245 HydrophobicContact CB-CD1 4.06Å; F243-L245 HydrophobicContact CB-CG 4.15Å; F243-V256 HydrophobicContact CB-CB 4.17Å; F243-V256 HydrophobicContact CD2-CB 4.04Å; F243-V256 HydrophobicContact CD2-CG1 4.2Å; F243-V256 HydrophobicContact CG-CB 4.49Å; F243-V256 PolarHBondContact N-O 2.85Å; F243-V256 PolarHBondContact O-N 2.83Å; F243-F272 HydrophobicContact CE2-CE1 4.35Å; F243-R327 VanDerWaalsContact CA-O 3.23Å; F243-R327 WeakPolarHBondContact CA-O 3.1Å; F243-R327 HydrophobicContact CD1-CB 3.71Å; F243-R327 HydrophobicContact CE1-CB 4.33Å; F243-R327 VanDerWaalsContact CE2-NH2 3.27Å; F243-R327 HydrophobicContact CG-CB 4.31Å; F243-M355 HydrophobicContact CD1-CE 4.2Å; F243-M360 HydrophobicContact CD1-CE 4.24Å; F243-M360 HydrophobicContact CD1-SD 4.2Å; F243-M360 HydrophobicContact CD2-CE 3.79Å; F243-M360 HydrophobicContact CE1-CE 4.16Å; F243-M360 HydrophobicContact CE1-CG 4.48Å; F243-M360 HydrophobicContact CE1-SD 3.75Å; F243-M360 HydrophobicContact CE2-CE 3.71Å; F243-M360 HydrophobicContact CE2-SD 4.19Å; F243-M360 HydrophobicContact CG-CE 4.05Å; F243-M360 HydrophobicContact CZ-CE 3.88Å; F243-M360 HydrophobicContact CZ-SD 3.72Å; F243-H368 AromaticContact CE1-CD2 3.38Å; F243-H368 WeakPolarHBondContact CE1-CD2 3.2Å; F243-H368 AromaticContact CE1-NE2 3.64Å; F243-H368 HydrophobicContact CZ-CB 4.37Å; F243-H368 AromaticContact CZ-CD2 3.34Å; F243-H368 WeakPolarHBondContact CZ-CD2 3.37Å; F243-H368 AromaticContact CZ-CG 3.81Å; F243-H368 AromaticContact CZ-NE2 3.69Å
244	L	96.1	Very high	92.2	Very high	21 Å²	21	39.2 Å²	39.2	11%	0.11	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	117.8	171.5	173.4	66.4	0	0	0	107.7	M253 F255 Y311 I326 R327 I328	L244-M253 HydrophobicContact CD1-CB 4.1Å; L244-M253 HydrophobicContact CD1-CE 3.7Å; L244-M253 HydrophobicContact CD2-CE 4.33Å; L244-M253 HydrophobicContact CG-CE 3.8Å; L244-F255 HydrophobicContact CB-CD2 4.38Å; L244-F255 HydrophobicContact CD1-CD2 4.19Å; L244-Y311 HydrophobicContact CD1-CD2 3.9Å; L244-Y311 HydrophobicContact CD2-CD2 3.99Å; L244-Y311 HydrophobicContact CD2-CE2 4.35Å; L244-I326 HydrophobicContact CB-CG2 3.65Å; L244-R327 PolarHBondContact N-O 2.86Å; L244-I328 HydrophobicContact CB-CG2 4.37Å
245	L	95.2	Very high	92.5	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	121.1	-163.8	-58.7	167.1	0	0	0	109.8	F243 F254 V256 P329 Y353 M355 M360 I362	F243-L245 HydrophobicContact CB-CD1 4.06Å; F243-L245 HydrophobicContact CB-CG 4.15Å; L245-F254 HydrophobicContact CB-CB 4.39Å; L245-F254 PolarHBondContact N-O 2.88Å; L245-F254 PolarHBondContact O-N 3.36Å; L245-V256 HydrophobicContact CD1-CG2 4.37Å; L245-P329 HydrophobicContact CD2-CG 3.92Å; L245-Y353 HydrophobicContact CB-CD1 4.36Å; L245-Y353 HydrophobicContact CB-CE1 4Å; L245-Y353 HydrophobicContact CB-CE2 4.43Å; L245-Y353 HydrophobicContact CD1-CD2 4.3Å; L245-Y353 HydrophobicContact CD1-CE2 4.45Å; L245-Y353 HydrophobicContact CD2-CD1 4.21Å; L245-Y353 HydrophobicContact CD2-CG 4.25Å; L245-M355 HydrophobicContact CD2-CE 3.61Å; L245-M355 HydrophobicContact CD2-SD 3.59Å; L245-M355 VanDerWaalsContact CD2-SD 3.59Å; L245-M360 HydrophobicContact CD1-CG 3.92Å; L245-I362 HydrophobicContact CD1-CD1 3.33Å
246	P	94.4	Very high	92.9	Very high	36 Å²	36	37 Å²	37	23%	0.234	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	132.7	-179.6	31.2	-33.5	0	0	0	111	M253 P329 P339 Y353	P246-M253 HydrophobicContact CB-CE 4.07Å; P246-M253 HydrophobicContact CB-SD 3.77Å; P246-P329 HydrophobicContact CG-CG 4.49Å; P246-P339 HydrophobicContact CG-CG 3.63Å; P246-Y353 WeakPolarHBondContact O-CE1 3.42Å; P246-Y353 PolarHBondContact O-OH 3.19Å
247	H	93.3	Very high	93.1	Very high	25 Å²	25	36.2 Å²	36.2	12%	0.116	19%	0.193	C	C	.	.			trans	-65.3	147.1	170.9	-168.4	-53.5	0	0	0	109.6	D249 G250 R252 F254 F351	H247-D249 WeakPolarHBondContact CB-OD1 3.22Å; H247-D249 IonicContact CE1-OD2 2.69Å; H247-D249 IonicContact CG-OD1 3.71Å; H247-D249 PolarHBondContact ND1-N 3.06Å; H247-D249 VanDerWaalsContact ND1-N 3.2Å; H247-D249 IonicContact ND1-OD1 2.73Å; H247-D249 IonicContact ND1-OD2 3.32Å; H247-D249 PolarHBondContact O-N 3.45Å; H247-G250 PolarHBondContact O-N 2.98Å; H247-R252 HydrophobicContact CB-CB 3.92Å; H247-R252 VanDerWaalsContact CB-O 3.23Å; H247-R252 WeakPolarHBondContact CB-O 3.37Å; H247-R252 PolarHBondContact N-O 3.08Å; H247-R252 PolarHBondContact NE2-NH2 3.09Å; H247-R252 VanDerWaalsContact NE2-NH2 3.14Å; H247-F254 HydrophobicContact CB-CD2 4.43Å; H247-F254 HydrophobicContact CB-CE2 3.99Å; H247-F254 AromaticContact CD2-CE2 3.49Å; H247-F254 VanDerWaalsContact CD2-CE2 3.49Å; H247-F254 WeakPolarHBondContact CD2-CE2 3.33Å; H247-F254 AromaticContact CD2-CZ 3.53Å; H247-F254 AromaticContact CG-CE2 3.93Å; H247-F351 AromaticContact CE1-CE2 3.65Å; H247-F351 AromaticContact CE1-CZ 3.4Å; H247-F351 WeakPolarHBondContact CE1-CZ 3.39Å; H247-F351 AromaticContact ND1-CZ 3.94Å; H247-F351 AromaticContact NE2-CE2 3.62Å; H247-F351 AromaticContact NE2-CZ 3.81Å
248	Q	89.2	Confident	93.3	Very high	54 Å²	54	31.3 Å²	31.3	25%	0.252	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-10.1	176	-163.9	178.1	27.4	0	0	114.4	T336 T338 A340 F351	Q248-T336 PolarHBondContact NE2-OG1 3.3Å; Q248-T338 HydrophobicContact CG-CG2 4.04Å; Q248-A340 HydrophobicContact CB-CB 4.23Å; Q248-F351 HydrophobicContact CB-CD1 4.33Å; Q248-F351 HydrophobicContact CB-CE1 3.95Å
249	D	88.4	Confident	93.5	Very high	57 Å²	57	31.2 Å²	31.2	31%	0.305	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-8	179.7	71.4	2.9	0	0	0	113.6	H247 R251 R252	H247-D249 WeakPolarHBondContact CB-OD1 3.22Å; H247-D249 IonicContact CE1-OD2 2.69Å; H247-D249 IonicContact CG-OD1 3.71Å; H247-D249 PolarHBondContact ND1-N 3.06Å; H247-D249 VanDerWaalsContact ND1-N 3.2Å; H247-D249 IonicContact ND1-OD1 2.73Å; H247-D249 IonicContact ND1-OD2 3.32Å; H247-D249 PolarHBondContact O-N 3.45Å; D249-R251 PolarHBondContact O-N 3.44Å; D249-R251 VanDerWaalsContact O-N 3.16Å; D249-R251 PolarHBondContact OD1-N 3.23Å; D249-R252 PolarHBondContact OD1-N 2.94Å; D249-R252 VanDerWaalsContact OD1-N 3.14Å; D249-R252 IonicContact OD2-CZ 3.33Å; D249-R252 IonicContact OD2-NE 2.69Å; D249-R252 PolarHBondContact OD2-NE 2.86Å; D249-R252 IonicContact OD2-NH2 3.53Å; D249-R252 PolarHBondContact OD2-NH2 2.79Å
250	G	87.9	Confident	93.1	Very high	48 Å²	48	35.8 Å²	35.8	50%	0.495	18%	0.183	S	C	.	.	S	Bend	trans	70.8	-4.3	-177.1	0	0	0	0	0	115.9	H247 K279	H247-G250 PolarHBondContact O-N 2.98Å; G250-K279 WeakPolarHBondContact O-CD 3.49Å
251	R	91.7	Very high	92.9	Very high	180 Å²	180	35.4 Å²	35.4	68%	0.679	19%	0.187	S	C	*	.	S	Bend	trans	-103.2	-19	-173.9	-61.5	177.9	-171.3	-165.3	-0.2	113.5	D249 K279	D249-R251 PolarHBondContact O-N 3.44Å; D249-R251 VanDerWaalsContact O-N 3.16Å; D249-R251 PolarHBondContact OD1-N 3.23Å; R251-K279 VanDerWaalsContact O-CB 3.29Å; R251-K279 WeakPolarHBondContact O-CB 3.47Å; R251-K279 PolarHBondContact O-N 2.86Å
252	R	93.9	Very high	92.6	Very high	81 Å²	81	36.2 Å²	36.2	31%	0.306	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	148.4	-177	-73.2	174.2	-73.2	166.4	-0.6	112.5	H247 D249 E276 L277	H247-R252 HydrophobicContact CB-CB 3.92Å; H247-R252 VanDerWaalsContact CB-O 3.23Å; H247-R252 WeakPolarHBondContact CB-O 3.37Å; H247-R252 PolarHBondContact N-O 3.08Å; H247-R252 PolarHBondContact NE2-NH2 3.09Å; H247-R252 VanDerWaalsContact NE2-NH2 3.14Å; D249-R252 PolarHBondContact OD1-N 2.94Å; D249-R252 VanDerWaalsContact OD1-N 3.14Å; D249-R252 IonicContact OD2-CZ 3.33Å; D249-R252 IonicContact OD2-NE 2.69Å; D249-R252 PolarHBondContact OD2-NE 2.86Å; D249-R252 IonicContact OD2-NH2 3.53Å; D249-R252 PolarHBondContact OD2-NH2 2.79Å; R252-E276 VanDerWaalsContact CD-OE1 3.3Å; R252-E276 WeakPolarHBondContact CD-OE1 3.29Å; R252-E276 IonicContact CZ-OE1 3.65Å; R252-E276 IonicContact NE-OE1 2.74Å; R252-E276 IonicContact NH1-OE1 2.91Å; R252-E276 PolarHBondContact NH1-OE1 3.46Å; R252-L277 CarbonylContact C-O 3.56Å; R252-L277 WeakPolarHBondContact CA-O 3.36Å
253	M	95	Very high	92.2	Very high	22 Å²	22	37.1 Å²	37.1	11%	0.108	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	127.4	174.7	-61.1	-60.5	-66.2	0	0	109	L244 P246 L277 Y311	L244-M253 HydrophobicContact CD1-CB 4.1Å; L244-M253 HydrophobicContact CD1-CE 3.7Å; L244-M253 HydrophobicContact CD2-CE 4.33Å; L244-M253 HydrophobicContact CG-CE 3.8Å; P246-M253 HydrophobicContact CB-CE 4.07Å; P246-M253 HydrophobicContact CB-SD 3.77Å; M253-L277 PolarHBondContact N-O 2.82Å; M253-L277 PolarHBondContact O-N 2.81Å; M253-Y311 HydrophobicContact CB-CD1 4.37Å; M253-Y311 HydrophobicContact CB-CD2 4.38Å; M253-Y311 HydrophobicContact CB-CG 4Å; M253-Y311 HydrophobicContact CE-CD2 4.29Å; M253-Y311 HydrophobicContact CE-CE2 4.25Å; M253-Y311 HydrophobicContact CG-CD1 3.75Å; M253-Y311 HydrophobicContact CG-CD2 3.96Å; M253-Y311 HydrophobicContact CG-CE1 4.05Å; M253-Y311 HydrophobicContact CG-CE2 4.24Å; M253-Y311 HydrophobicContact CG-CG 3.72Å
254	F	95.9	Very high	91.5	Very high	9 Å²	9	39.6 Å²	39.6	4%	0.039	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	120.7	168.5	-65.8	-67.6	0	0	0	109.7	L245 H247 V256 I274 L275 E276 F351 I362	L245-F254 HydrophobicContact CB-CB 4.39Å; L245-F254 PolarHBondContact N-O 2.88Å; L245-F254 PolarHBondContact O-N 3.36Å; H247-F254 HydrophobicContact CB-CD2 4.43Å; H247-F254 HydrophobicContact CB-CE2 3.99Å; H247-F254 AromaticContact CD2-CE2 3.49Å; H247-F254 VanDerWaalsContact CD2-CE2 3.49Å; H247-F254 WeakPolarHBondContact CD2-CE2 3.33Å; H247-F254 AromaticContact CD2-CZ 3.53Å; H247-F254 AromaticContact CG-CE2 3.93Å; F254-V256 HydrophobicContact CB-CG2 4.44Å; F254-I274 HydrophobicContact CD1-CG2 3.87Å; F254-L275 WeakPolarHBondContact CA-O 3.41Å; F254-E276 HydrophobicContact CD1-CB 4.25Å; F254-E276 HydrophobicContact CD1-CG 4.36Å; F254-E276 HydrophobicContact CE1-CB 4.1Å; F254-E276 HydrophobicContact CE1-CG 3.88Å; F254-F351 HydrophobicContact CE2-CD2 4.22Å; F254-F351 HydrophobicContact CE2-CE2 4.38Å; F254-I362 HydrophobicContact CB-CD1 4.44Å; F254-I362 HydrophobicContact CD2-CG2 4.3Å; F254-I362 HydrophobicContact CE2-CG2 4.35Å; F254-I362 HydrophobicContact CG-CG2 4.37Å; F254-I362 HydrophobicContact CZ-CG2 4.47Å
255	F	96.6	Very high	90.7	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	117.8	168.2	-166.9	-93.3	0	0	0	108.6	L242 L244 I257 L275 L277 L314 A315 M318 I326	L242-F255 HydrophobicContact CB-CZ 4.47Å; L242-F255 HydrophobicContact CD1-CZ 4.41Å; L242-F255 HydrophobicContact CD2-CE1 4.14Å; L242-F255 HydrophobicContact CD2-CZ 4.18Å; L244-F255 HydrophobicContact CB-CD2 4.38Å; L244-F255 HydrophobicContact CD1-CD2 4.19Å; F255-I257 HydrophobicContact CD1-CD1 4.11Å; F255-I257 HydrophobicContact CD1-CG1 3.88Å; F255-I257 HydrophobicContact CE1-CD1 3.98Å; F255-I257 HydrophobicContact CE1-CG1 3.67Å; F255-L275 HydrophobicContact CB-CB 4.28Å; F255-L275 HydrophobicContact CB-CD1 4.46Å; F255-L275 HydrophobicContact CD1-CD1 4.16Å; F255-L275 PolarHBondContact N-O 2.81Å; F255-L275 PolarHBondContact O-N 2.95Å; F255-L277 HydrophobicContact CB-CD1 3.99Å; F255-L314 HydrophobicContact CB-CD2 4.17Å; F255-L314 HydrophobicContact CD1-CD2 3.73Å; F255-L314 HydrophobicContact CD1-CG 4.4Å; F255-L314 HydrophobicContact CD2-CD2 4.3Å; F255-L314 HydrophobicContact CE1-CD2 4.15Å; F255-L314 HydrophobicContact CE1-CG 4.35Å; F255-L314 HydrophobicContact CG-CD2 3.8Å; F255-L314 HydrophobicContact CZ-CG 4.48Å; F255-A315 HydrophobicContact CE2-CB 4.09Å; F255-M318 HydrophobicContact CE1-CB 4.28Å; F255-M318 HydrophobicContact CE1-CE 4.23Å; F255-M318 HydrophobicContact CE1-CG 3.96Å; F255-M318 HydrophobicContact CZ-CB 3.77Å; F255-M318 HydrophobicContact CZ-CG 3.91Å; F255-I326 HydrophobicContact CE2-CD1 4.04Å; F255-I326 HydrophobicContact CZ-CD1 4.39Å
256	V	96.1	Very high	89.9	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	132.6	-175.1	-173.1	0	0	0	0	111.3	L242 F243 L245 F254 F272 L273 I274 M360 I362	L242-V256 CarbonylContact C-O 3.57Å; L242-V256 WeakPolarHBondContact CA-O 3.16Å; F243-V256 HydrophobicContact CB-CB 4.17Å; F243-V256 HydrophobicContact CD2-CB 4.04Å; F243-V256 HydrophobicContact CD2-CG1 4.2Å; F243-V256 HydrophobicContact CG-CB 4.49Å; F243-V256 PolarHBondContact N-O 2.85Å; F243-V256 PolarHBondContact O-N 2.83Å; L245-V256 HydrophobicContact CD1-CG2 4.37Å; F254-V256 HydrophobicContact CB-CG2 4.44Å; V256-F272 HydrophobicContact CG1-CB 4.16Å; V256-F272 HydrophobicContact CG1-CD1 3.92Å; V256-F272 HydrophobicContact CG1-CG 4.46Å; V256-L273 WeakPolarHBondContact CA-O 3.34Å; V256-I274 HydrophobicContact CB-CG1 4.47Å; V256-I274 HydrophobicContact CG1-CG1 3.94Å; V256-I274 HydrophobicContact CG2-CB 4.39Å; V256-I274 HydrophobicContact CG2-CD1 4.36Å; V256-I274 HydrophobicContact CG2-CG1 3.9Å; V256-I274 HydrophobicContact CG2-CG2 4.14Å; V256-M360 HydrophobicContact CB-CE 4.01Å; V256-M360 HydrophobicContact CG1-CE 3.55Å; V256-M360 HydrophobicContact CG2-CE 4.31Å; V256-I362 HydrophobicContact CG2-CD1 3.63Å
257	I	95.9	Very high	89	Confident	4 Å²	4	50 Å²	50	2%	0.021	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	110.6	-179	-56.8	164.2	0	0	0	106.2	I239 L242 F255 L259 F272 L273 M318	I239-I257 HydrophobicContact CB-CG2 4.33Å; I239-I257 HydrophobicContact CD1-CG2 4.07Å; I239-I257 HydrophobicContact CG1-CG2 3.89Å; I239-I257 HydrophobicContact CG2-CG2 3.63Å; L242-I257 HydrophobicContact CD2-CB 4.39Å; L242-I257 HydrophobicContact CD2-CG1 3.91Å; L242-I257 HydrophobicContact CD2-CG2 4.2Å; F255-I257 HydrophobicContact CD1-CD1 4.11Å; F255-I257 HydrophobicContact CD1-CG1 3.88Å; F255-I257 HydrophobicContact CE1-CD1 3.98Å; F255-I257 HydrophobicContact CE1-CG1 3.67Å; I257-L259 HydrophobicContact CG2-CD2 3.68Å; I257-L259 HydrophobicContact CG2-CG 4.41Å; I257-F272 WeakPolarHBondContact O-CA 3.46Å; I257-L273 HydrophobicContact CB-CB 4.27Å; I257-L273 HydrophobicContact CD1-CD2 3.8Å; I257-L273 HydrophobicContact CD1-CG 4.29Å; I257-L273 PolarHBondContact N-O 2.92Å; I257-L273 PolarHBondContact O-N 2.88Å; I257-M318 HydrophobicContact CD1-CE 3.79Å; I257-M318 HydrophobicContact CG1-CE 4.14Å
258	G	94.7	Very high	88.6	Confident	4 Å²	4	52.2 Å²	52.2	4%	0.041	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	133.9	172.7	0	0	0	0	0	110.7	I239 L240 G241	I239-G258 CarbonylContact C-O 3.51Å; I239-G258 WeakPolarHBondContact CA-O 3.23Å; L240-G258 PolarHBondContact N-O 3.21Å; G241-G258 PolarHBondContact O-N 3.31Å
259	L	92.6	Very high	88.4	Confident	6 Å²	6	54 Å²	54	3%	0.031	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	132.2	-167.9	-59.8	176.2	0	0	0	111.6	I234 S238 I239 I257 I263 N271 L273	I234-L259 HydrophobicContact CD1-CD1 4.06Å; I234-L259 HydrophobicContact CD1-CD2 4.44Å; I234-L259 HydrophobicContact CG2-CD2 3.62Å; S238-L259 WeakPolarHBondContact O-CA 3.25Å; I239-L259 HydrophobicContact CG1-CD2 4.06Å; I257-L259 HydrophobicContact CG2-CD2 3.68Å; I257-L259 HydrophobicContact CG2-CG 4.41Å; L259-I263 HydrophobicContact CD1-CD1 4.18Å; L259-I263 HydrophobicContact CD1-CG1 4.07Å; L259-I263 HydrophobicContact CD1-CG2 4.14Å; L259-N271 PolarHBondContact N-O 2.83Å; L259-L273 HydrophobicContact CD1-CB 3.97Å
260	D	85.1	Confident	88.6	Confident	96 Å²	96	53.7 Å²	53.7	51%	0.513	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	112.6	171.5	-171.4	19.4	0	0	0	109.8	S238 L240	S238-D260 WeakPolarHBondContact CA-O 3.32Å; S238-D260 VanDerWaalsContact CB-O 3.3Å; S238-D260 WeakPolarHBondContact CB-O 3.47Å; S238-D260 PolarHBondContact O-N 2.99Å; L240-D260 HydrophobicContact CD1-CB 3.56Å; L240-D260 HydrophobicContact CD2-CB 3.86Å; L240-D260 HydrophobicContact CG-CB 3.53Å
261	P	86.2	Confident	88.7	Confident	95 Å²	95	55.6 Å²	55.6	62%	0.617	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	cis	-67.2	155.7	0.5	29.5	-36.5	0	0	0	113
262	P	86.3	Confident	88.9	Confident	22 Å²	22	48.5 Å²	48.5	14%	0.143	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	143.8	174.3	28.4	-35.6	0	0	0	112.2	R269 Y270 N271	P262-R269 HydrophobicContact CB-CB 4.16Å; P262-R269 HydrophobicContact CG-CB 4.04Å; P262-R269 HydrophobicContact CG-CG 4.35Å; P262-Y270 VanDerWaalsContact CB-C 3.5Å; P262-Y270 WeakPolarHBondContact CB-O 3.4Å; P262-N271 VanDerWaalsContact CB-OD1 3.3Å; P262-N271 WeakPolarHBondContact CB-OD1 3.35Å
263	I	87.2	Confident	88.9	Confident	18 Å²	18	44.7 Å²	44.7	9%	0.092	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	149.7	165.4	60.5	-179.6	0	0	0	110.1	P210 Y232 I234 L259 Y270	P210-I263 HydrophobicContact CG-CD1 3.78Å; Y232-I263 HydrophobicContact CD1-CB 4.37Å; Y232-I263 HydrophobicContact CD2-CD1 4.01Å; Y232-I263 HydrophobicContact CE2-CD1 4.32Å; Y232-I263 HydrophobicContact CG-CB 4.45Å; Y232-I263 HydrophobicContact CG-CD1 4.23Å; I234-I263 HydrophobicContact CD1-CD1 4.44Å; I234-I263 HydrophobicContact CD1-CG2 3.95Å; I234-I263 HydrophobicContact CG1-CG2 3.78Å; L259-I263 HydrophobicContact CD1-CD1 4.18Å; L259-I263 HydrophobicContact CD1-CG1 4.07Å; L259-I263 HydrophobicContact CD1-CG2 4.14Å; I263-Y270 HydrophobicContact CG1-CD2 4.44Å; I263-Y270 PolarHBondContact N-O 3.32Å; I263-Y270 PolarHBondContact O-N 3.05Å
264	K	80	Confident	88.9	Confident	54 Å²	54	43.7 Å²	43.7	24%	0.235	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	148.2	-175.4	-58.7	-168.4	-178.3	179.9	0	111.4	Y232 T268 R269	Y232-K264 WeakPolarHBondContact CE1-O 3.31Å; K264-T268 CarbonylContact C-O 3.45Å; K264-T268 VanDerWaalsContact CA-O 3.32Å; K264-T268 WeakPolarHBondContact CA-O 3.43Å; K264-R269 HydrophobicContact CD-CG 4.49Å; K264-R269 HydrophobicContact CG-CG 4.28Å
265	Q	80.4	Confident	88.9	Confident	44 Å²	44	43.3 Å²	43.3	21%	0.206	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	93	173.8	-166.2	177.1	-11.8	0	0	107.1	F230 Y232 Q267 T268 Y270	F230-Q265 HydrophobicContact CD1-CG 3.82Å; F230-Q265 HydrophobicContact CD2-CG 4.12Å; F230-Q265 HydrophobicContact CE1-CG 3.78Å; F230-Q265 HydrophobicContact CE2-CG 4.11Å; F230-Q265 HydrophobicContact CG-CG 3.99Å; F230-Q265 HydrophobicContact CZ-CG 3.94Å; Y232-Q265 VanDerWaalsContact OH-CD 3.32Å; Y232-Q265 WeakPolarHBondContact OH-CG 3.26Å; Y232-Q265 PolarHBondContact OH-OE1 2.93Å; Q265-Q267 PolarHBondContact O-N 2.62Å; Q265-T268 PolarHBondContact N-O 2.9Å; Q265-T268 PolarHBondContact O-N 3.32Å; Q265-Y270 HydrophobicContact CB-CE2 3.82Å
266	G	77.2	Confident	88.8	Confident	33 Å²	33	45.2 Å²	45.2	34%	0.34	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.7	-125.8	-160.8	0	0	0	0	0	111.4	T268	G266-T268 VanDerWaalsContact C-N 3.28Å; G266-T268 PolarHBondContact O-N 2.84Å
267	Q	75.1	Confident	88.8	Confident	199 Å²	199	45.3 Å²	45.3	93%	0.93	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-11.4	179.1	-61.7	-177	7.4	0	0	114.6	Q265	Q265-Q267 PolarHBondContact O-N 2.62Å
268	T	84.9	Confident	88.7	Confident	70 Å²	70	47.7 Å²	47.7	43%	0.429	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	125.7	-176.9	-51.7	0	0	0	0	110.7	K264 Q265 G266 Y270	K264-T268 CarbonylContact C-O 3.45Å; K264-T268 VanDerWaalsContact CA-O 3.32Å; K264-T268 WeakPolarHBondContact CA-O 3.43Å; Q265-T268 PolarHBondContact N-O 2.9Å; Q265-T268 PolarHBondContact O-N 3.32Å; G266-T268 VanDerWaalsContact C-N 3.28Å; G266-T268 PolarHBondContact O-N 2.84Å; T268-Y270 HydrophobicContact CG2-CD1 4.34Å; T268-Y270 HydrophobicContact CG2-CD2 4.44Å; T268-Y270 HydrophobicContact CG2-CE1 3.75Å; T268-Y270 HydrophobicContact CG2-CE2 3.9Å
269	R	85.7	Confident	88.6	Confident	92 Å²	92	51.7 Å²	51.7	35%	0.347	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	136.2	170.6	-60.1	-168.6	-176.4	-167.9	4.8	110.7	D155 P262 K264	D155-R269 VanDerWaalsContact CG-NH2 3.32Å; D155-R269 IonicContact OD1-CZ 3.72Å; D155-R269 IonicContact OD1-NH1 2.69Å; D155-R269 IonicContact OD1-NH2 3.08Å; D155-R269 PolarHBondContact OD1-NH2 2.86Å; D155-R269 IonicContact OD2-CZ 3.93Å; D155-R269 IonicContact OD2-NH1 3.24Å; D155-R269 PolarHBondContact OD2-NH1 2.89Å; D155-R269 IonicContact OD2-NH2 3.59Å; D155-R269 PolarHBondContact OD2-NH2 2.93Å; D155-R269 VanDerWaalsContact OD2-NH2 3.15Å; P262-R269 HydrophobicContact CB-CB 4.16Å; P262-R269 HydrophobicContact CG-CB 4.04Å; P262-R269 HydrophobicContact CG-CG 4.35Å; K264-R269 HydrophobicContact CD-CG 4.49Å; K264-R269 HydrophobicContact CG-CG 4.28Å
270	Y	91.4	Very high	88.5	Confident	50 Å²	50	57.6 Å²	57.6	20%	0.196	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	98.1	174.7	-59.6	-73.3	0	0	0	110.9	T209 P210 P262 I263 Q265 T268 F272	T209-Y270 HydrophobicContact CG2-CD1 3.45Å; T209-Y270 VanDerWaalsContact CG2-CD1 3.45Å; T209-Y270 HydrophobicContact CG2-CE1 3.86Å; T209-Y270 HydrophobicContact CG2-CG 4.34Å; P210-Y270 HydrophobicContact CB-CD2 4.15Å; P210-Y270 HydrophobicContact CB-CE2 3.78Å; P210-Y270 HydrophobicContact CG-CD2 3.66Å; P210-Y270 HydrophobicContact CG-CE2 3.84Å; P210-Y270 HydrophobicContact CG-CG 4.11Å; P262-Y270 VanDerWaalsContact CB-C 3.5Å; P262-Y270 WeakPolarHBondContact CB-O 3.4Å; I263-Y270 HydrophobicContact CG1-CD2 4.44Å; I263-Y270 PolarHBondContact N-O 3.32Å; I263-Y270 PolarHBondContact O-N 3.05Å; Q265-Y270 HydrophobicContact CB-CE2 3.82Å; T268-Y270 HydrophobicContact CG2-CD1 4.34Å; T268-Y270 HydrophobicContact CG2-CD2 4.44Å; T268-Y270 HydrophobicContact CG2-CE1 3.75Å; T268-Y270 HydrophobicContact CG2-CE2 3.9Å; Y270-F272 PolarHBondContact O-N 2.9Å
271	N	91.8	Very high	88.8	Confident	88 Å²	88	57.3 Å²	57.3	47%	0.471	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	-8.1	174.9	-52.7	-0.9	0	0	0	112.9	L259 P262	L259-N271 PolarHBondContact N-O 2.83Å; P262-N271 VanDerWaalsContact CB-OD1 3.3Å; P262-N271 WeakPolarHBondContact CB-OD1 3.35Å
272	F	94.3	Very high	89.1	Confident	32 Å²	32	60.2 Å²	60.2	14%	0.14	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	128.9	179.5	-61.8	-86.9	0	0	0	109.8	F243 V256 I257 Y270 M360 P366 H368	F243-F272 HydrophobicContact CE2-CE1 4.35Å; V256-F272 HydrophobicContact CG1-CB 4.16Å; V256-F272 HydrophobicContact CG1-CD1 3.92Å; V256-F272 HydrophobicContact CG1-CG 4.46Å; I257-F272 WeakPolarHBondContact O-CA 3.46Å; Y270-F272 PolarHBondContact O-N 2.9Å; F272-M360 HydrophobicContact CD1-CE 4.25Å; F272-M360 HydrophobicContact CE1-CE 4.28Å; F272-P366 HydrophobicContact CB-CB 3.86Å; F272-P366 HydrophobicContact CB-CG 4.12Å; F272-P366 HydrophobicContact CD2-CB 3.72Å; F272-P366 HydrophobicContact CG-CB 3.92Å; F272-H368 HydrophobicContact CE1-CB 4.08Å; F272-H368 HydrophobicContact CZ-CB 3.73Å
273	L	94.7	Very high	89.4	Confident	1 Å²	1	61 Å²	61	1%	0.005	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	124.9	163.7	166.6	63.2	0	0	0	108	T209 L225 I234 V256 I257 L259 L275	T209-L273 CarbonylContact O-C 3.48Å; T209-L273 WeakPolarHBondContact O-CA 3.44Å; L225-L273 HydrophobicContact CD1-CD2 4.12Å; L225-L273 HydrophobicContact CD2-CD1 3.77Å; L225-L273 HydrophobicContact CD2-CD2 3.64Å; L225-L273 HydrophobicContact CD2-CG 4.37Å; L225-L273 HydrophobicContact CG-CD2 4.46Å; I234-L273 HydrophobicContact CD1-CD2 3.97Å; V256-L273 WeakPolarHBondContact CA-O 3.34Å; I257-L273 HydrophobicContact CB-CB 4.27Å; I257-L273 HydrophobicContact CD1-CD2 3.8Å; I257-L273 HydrophobicContact CD1-CG 4.29Å; I257-L273 PolarHBondContact N-O 2.92Å; I257-L273 PolarHBondContact O-N 2.88Å; L259-L273 HydrophobicContact CD1-CB 3.97Å; L273-L275 HydrophobicContact CD1-CD2 3.85Å; L273-L275 HydrophobicContact CD2-CD2 4.46Å; L273-L275 HydrophobicContact CG-CD2 4.06Å
274	I	95.8	Very high	89.5	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	116.4	179.5	-58	-173.8	0	0	0	109	C207 A208 T209 F254 V256 I362 H363 P366	C207-I274 CarbonylContact C-O 3.58Å; C207-I274 WeakPolarHBondContact CA-O 3.32Å; A208-I274 HydrophobicContact CB-CB 4.32Å; A208-I274 HydrophobicContact CB-CG2 3.93Å; A208-I274 PolarHBondContact N-O 2.82Å; T209-I274 PolarHBondContact N-O 3Å; T209-I274 PolarHBondContact O-N 3.23Å; F254-I274 HydrophobicContact CD1-CG2 3.87Å; V256-I274 HydrophobicContact CB-CG1 4.47Å; V256-I274 HydrophobicContact CG1-CG1 3.94Å; V256-I274 HydrophobicContact CG2-CB 4.39Å; V256-I274 HydrophobicContact CG2-CD1 4.36Å; V256-I274 HydrophobicContact CG2-CG1 3.9Å; V256-I274 HydrophobicContact CG2-CG2 4.14Å; I274-I362 HydrophobicContact CD1-CG1 4.12Å; I274-I362 HydrophobicContact CD1-CG2 4.16Å; I274-H363 HydrophobicContact CD1-CB 4.35Å; I274-P366 HydrophobicContact CD1-CB 3.93Å; I274-P366 HydrophobicContact CD1-CG 3.61Å; I274-P366 HydrophobicContact CG1-CG 4.39Å
275	L	96	Very high	89.9	Confident	1 Å²	1	65.8 Å²	65.8	1%	0.005	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	139	170.5	-44	179.4	0	0	0	108.9	I205 C207 I216 F254 F255 L273 L277 L314	I205-L275 HydrophobicContact CG2-CB 4.27Å; I205-L275 HydrophobicContact CG2-CD1 4.36Å; I205-L275 HydrophobicContact CG2-CD2 4.16Å; I205-L275 HydrophobicContact CG2-CG 4.5Å; C207-L275 WeakPolarHBondContact SG-CD2 3.35Å; I216-L275 HydrophobicContact CD1-CD1 3.79Å; I216-L275 HydrophobicContact CD1-CD2 3.81Å; I216-L275 HydrophobicContact CD1-CG 4.48Å; F254-L275 WeakPolarHBondContact CA-O 3.41Å; F255-L275 HydrophobicContact CB-CB 4.28Å; F255-L275 HydrophobicContact CB-CD1 4.46Å; F255-L275 HydrophobicContact CD1-CD1 4.16Å; F255-L275 PolarHBondContact N-O 2.81Å; F255-L275 PolarHBondContact O-N 2.95Å; L273-L275 HydrophobicContact CD1-CD2 3.85Å; L273-L275 HydrophobicContact CD2-CD2 4.46Å; L273-L275 HydrophobicContact CG-CD2 4.06Å; L275-L277 HydrophobicContact CB-CD2 4.19Å; L275-L277 HydrophobicContact CB-CG 4.28Å; L275-L314 HydrophobicContact CD1-CD2 3.64Å
276	E	94.7	Very high	90.2	Very high	41 Å²	41	68.9 Å²	68.9	19%	0.192	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	104.1	176	-176.5	178.3	158.2	0	0	107.9	L206 R252 F254	L206-E276 HydrophobicContact CD2-CB 4.13Å; L206-E276 HydrophobicContact CD2-CG 4.22Å; L206-E276 HydrophobicContact CG-CB 4.22Å; L206-E276 PolarHBondContact O-N 2.97Å; R252-E276 VanDerWaalsContact CD-OE1 3.3Å; R252-E276 WeakPolarHBondContact CD-OE1 3.29Å; R252-E276 IonicContact CZ-OE1 3.65Å; R252-E276 IonicContact NE-OE1 2.74Å; R252-E276 IonicContact NH1-OE1 2.91Å; R252-E276 PolarHBondContact NH1-OE1 3.46Å; F254-E276 HydrophobicContact CD1-CB 4.25Å; F254-E276 HydrophobicContact CD1-CG 4.36Å; F254-E276 HydrophobicContact CE1-CB 4.1Å; F254-E276 HydrophobicContact CE1-CG 3.88Å
277	L	95	Very high	90.7	Very high	2 Å²	2	67.3 Å²	67.3	1%	0.01	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	128.2	-171	-54.7	176.6	0	0	0	109.4	I205 R252 M253 F255 L275 L310 L314	I205-L277 HydrophobicContact CD1-CD2 4.4Å; I205-L277 HydrophobicContact CG2-CD2 3.81Å; R252-L277 CarbonylContact C-O 3.56Å; R252-L277 WeakPolarHBondContact CA-O 3.36Å; M253-L277 PolarHBondContact N-O 2.82Å; M253-L277 PolarHBondContact O-N 2.81Å; F255-L277 HydrophobicContact CB-CD1 3.99Å; L275-L277 HydrophobicContact CB-CD2 4.19Å; L275-L277 HydrophobicContact CB-CG 4.28Å; L277-L310 HydrophobicContact CD2-CD2 4.13Å; L277-L310 HydrophobicContact CD2-CG 4.44Å; L277-L314 HydrophobicContact CD1-CD2 3.8Å
278	P	94.4	Very high	91.1	Very high	53 Å²	53	58.5 Å²	58.5	34%	0.344	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	145.6	166.5	-20.7	33.8	0	0	0	110.7	E281	P278-E281 HydrophobicContact CB-CB 3.91Å; P278-E281 WeakPolarHBondContact CD-OE2 3.5Å; P278-E281 HydrophobicContact CG-CB 4.31Å; P278-E281 VanDerWaalsContact CG-OE2 3.23Å; P278-E281 WeakPolarHBondContact CG-OE2 3.36Å
279	K	92.1	Very high	91	Very high	88 Å²	88	57.1 Å²	57.1	38%	0.383	28%	0.279	S	S	.	.	S	Bend	trans	-77	-34.2	176.3	-169.8	-175.8	175	-169.6	0	111.8	G250 R251 E281 Y311	G250-K279 WeakPolarHBondContact O-CD 3.49Å; R251-K279 VanDerWaalsContact O-CB 3.29Å; R251-K279 WeakPolarHBondContact O-CB 3.47Å; R251-K279 PolarHBondContact O-N 2.86Å; K279-E281 VanDerWaalsContact C-N 3.31Å; K279-E281 PolarHBondContact O-N 2.93Å; K279-Y311 HydrophobicContact CB-CE1 4.49Å; K279-Y311 HydrophobicContact CG-CE1 3.78Å
280	D	91.2	Very high	90.8	Very high	131 Å²	131	55.8 Å²	55.8	70%	0.701	28%	0.282	S	S	*	.	S	Bend	trans	-88.6	3.8	-173.7	-42.2	-44	0	0	0	112.8
281	E	91.6	Very high	90.4	Very high	90 Å²	90	58.9 Å²	58.9	42%	0.421	30%	0.299	S	S	.	.			trans	-88.5	106.4	175.7	-177.1	171	-176.5	0	0	109.4	P278 K279 S309 L310	P278-E281 HydrophobicContact CB-CB 3.91Å; P278-E281 WeakPolarHBondContact CD-OE2 3.5Å; P278-E281 HydrophobicContact CG-CB 4.31Å; P278-E281 VanDerWaalsContact CG-OE2 3.23Å; P278-E281 WeakPolarHBondContact CG-OE2 3.36Å; K279-E281 VanDerWaalsContact C-N 3.31Å; K279-E281 PolarHBondContact O-N 2.93Å; E281-S309 WeakPolarHBondContact O-CA 3.48Å; E281-L310 HydrophobicContact CG-CB 4.31Å; E281-L310 HydrophobicContact CG-CD2 3.98Å; E281-L310 WeakPolarHBondContact O-CB 3.48Å; E281-L310 PolarHBondContact O-N 3.31Å
282	E	91.4	Very high	90	Very high	155 Å²	155	60 Å²	60	72%	0.724	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.4	148.6	172.7	-62.9	-167.8	153.5	0	0	111.3	G308	E282-G308 WeakPolarHBondContact CA-O 3.41Å
283	V	92.1	Very high	89.6	Confident	38 Å²	38	59.8 Å²	59.8	23%	0.23	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	142.2	177.3	75.8	0	0	0	0	110.2	L285 S307 G308 L310 V313	V283-L285 HydrophobicContact CG1-CD1 4.14Å; V283-L285 HydrophobicContact CG1-CG 4.19Å; V283-L285 HydrophobicContact CG2-CD1 4.38Å; V283-L285 HydrophobicContact CG2-CD2 3.9Å; V283-L285 HydrophobicContact CG2-CG 3.87Å; V283-S307 WeakPolarHBondContact O-CA 3.21Å; V283-G308 PolarHBondContact N-O 2.61Å; V283-G308 PolarHBondContact O-N 3.06Å; V283-L310 HydrophobicContact CB-CD1 4.37Å; V283-L310 HydrophobicContact CG1-CB 4.41Å; V283-L310 HydrophobicContact CG1-CD1 4.03Å; V283-V313 HydrophobicContact CG1-CB 3.92Å; V283-V313 HydrophobicContact CG1-CG1 4.12Å; V283-V313 HydrophobicContact CG1-CG2 3.93Å
284	E	90	Very high	89	Confident	149 Å²	149	59.8 Å²	59.8	70%	0.696	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.2	124.2	165.6	-176.1	168.9	-157	0	0	108.5	L306	E284-L306 WeakPolarHBondContact CA-O 3.46Å
285	L	88.5	Confident	88.4	Confident	24 Å²	24	67.1 Å²	67.1	13%	0.126	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	123.8	-177.2	-65.8	173.8	0	0	0	110.6	L202 V283 L306 V313 I317	L202-L285 HydrophobicContact CD2-CD1 3.5Å; L202-L285 HydrophobicContact CD2-CD2 4.4Å; V283-L285 HydrophobicContact CG1-CD1 4.14Å; V283-L285 HydrophobicContact CG1-CG 4.19Å; V283-L285 HydrophobicContact CG2-CD1 4.38Å; V283-L285 HydrophobicContact CG2-CD2 3.9Å; V283-L285 HydrophobicContact CG2-CG 3.87Å; L285-L306 PolarHBondContact N-O 2.89Å; L285-L306 PolarHBondContact O-N 2.85Å; L285-V313 HydrophobicContact CD1-CG1 3.75Å; L285-I317 HydrophobicContact CD1-CD1 4.24Å
286	E	87.3	Confident	88	Confident	109 Å²	109	74.5 Å²	74.5	51%	0.509	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	117.4	162.6	-164.1	-164.1	163.8	0	0	109.4	R304	E286-R304 CarbonylContact C-O 3.48Å; E286-R304 WeakPolarHBondContact CA-O 3.21Å; E286-R304 HydrophobicContact CG-CG 3.94Å; E286-R304 IonicContact OE1-CZ 2.68Å; E286-R304 IonicContact OE1-NE 2.77Å; E286-R304 PolarHBondContact OE1-NE 2.87Å; E286-R304 IonicContact OE1-NH2 2.68Å; E286-R304 PolarHBondContact OE1-NH2 2.8Å
287	L	87.2	Confident	87.4	Confident	1 Å²	1	77.3 Å²	77.3	1%	0.005	38%	0.384	C	S	.	.			trans	-68.6	139.5	176.3	-65.6	-170.5	0	0	0	111.3	L199 A200 L289 L294 L302 T303 R304 L306 I317	L199-L287 HydrophobicContact CD1-CB 3.96Å; L199-L287 HydrophobicContact CD1-CD1 4.27Å; L199-L287 HydrophobicContact CD1-CD2 4.35Å; L199-L287 HydrophobicContact CD1-CG 4.44Å; L199-L287 HydrophobicContact CG-CD2 4.48Å; L199-L287 CarbonylContact O-C 3.55Å; L199-L287 VanDerWaalsContact O-CA 3.28Å; L199-L287 WeakPolarHBondContact O-CA 3.21Å; L199-L287 WeakPolarHBondContact O-CD2 3.44Å; A200-L287 HydrophobicContact CB-CD2 4.01Å; L287-L289 PolarHBondContact O-N 3.24Å; L287-L294 HydrophobicContact CB-CD1 4.15Å; L287-L294 HydrophobicContact CD1-CD1 4.08Å; L287-L294 HydrophobicContact CD1-CD2 3.98Å; L287-L302 HydrophobicContact CD1-CB 3.84Å; L287-L302 HydrophobicContact CD1-CD1 4.02Å; L287-L302 HydrophobicContact CD1-CG 4.41Å; L287-T303 VanDerWaalsContact CD1-O 3.29Å; L287-T303 WeakPolarHBondContact CD1-O 3.28Å; L287-R304 WeakPolarHBondContact CB-O 3.4Å; L287-R304 PolarHBondContact N-O 2.92Å; L287-L306 HydrophobicContact CD1-CD1 3.96Å; L287-L306 HydrophobicContact CD2-CD1 4.11Å; L287-L306 HydrophobicContact CG-CD1 4.13Å; L287-I317 HydrophobicContact CD2-CD1 4.07Å; L287-I317 HydrophobicContact CD2-CG1 4.4Å
288	G	82.6	Confident	87	Confident	14 Å²	14	78.1 Å²	78.1	14%	0.144	39%	0.387	C	S	.	.	S	Bend	trans	-66.2	-5.9	-172.5	0	0	0	0	0	116.6	K197 L199	K197-G288 WeakPolarHBondContact CD-O 3.45Å; K197-G288 PolarHBondContact NZ-O 2.99Å; L199-G288 PolarHBondContact O-N 3.34Å
289	L	82.3	Confident	86.3	Confident	40 Å²	40	78.6 Å²	78.6	21%	0.209	40%	0.402	C	S	.	.	S	Bend	trans	-114	149.2	-175	-64.3	-179.8	0	0	0	112.7	L199 L287 V293 L294 Y298	L199-L289 HydrophobicContact CD1-CB 4.29Å; L199-L289 HydrophobicContact CD1-CD1 3.91Å; L199-L289 HydrophobicContact CD1-CG 3.9Å; L287-L289 PolarHBondContact O-N 3.24Å; L289-V293 HydrophobicContact CD1-CG1 4.29Å; L289-L294 HydrophobicContact CB-CD2 4.01Å; L289-L294 HydrophobicContact CB-CG 4.02Å; L289-L294 HydrophobicContact CD1-CD2 4.33Å; L289-L294 WeakPolarHBondContact O-CD1 3.49Å; L289-Y298 HydrophobicContact CD1-CE2 4.45Å
290	P	82.4	Confident	85.6	Confident	64 Å²	64	76.6 Å²	76.6	42%	0.416	41%	0.406	S	S	.	.			trans	-58.4	153.2	171.2	-24.5	35.4	0	0	0	114	D292 V293 L294	P290-D292 WeakPolarHBondContact CB-OD1 3.28Å; P290-D292 PolarHBondContact O-N 2.75Å; P290-V293 HydrophobicContact CB-CG2 4.24Å; P290-V293 HydrophobicContact CG-CG2 4.33Å; P290-V293 PolarHBondContact O-N 3.35Å; P290-L294 WeakPolarHBondContact O-CG 3.44Å; P290-L294 PolarHBondContact O-N 2.96Å
291	E	82.9	Confident	85.2	Confident	115 Å²	115	75.8 Å²	75.8	54%	0.537	40%	0.398	S	S	.	.	H	α-helix	trans	-64.9	-36.1	-175.8	-72.9	-168.8	160.6	0	0	113.8	L294 K295 R304	E291-L294 PolarHBondContact O-N 3.4Å; E291-K295 WeakPolarHBondContact O-CB 3.49Å; E291-K295 PolarHBondContact O-N 3.13Å; E291-R304 HydrophobicContact CG-CB 3.49Å; E291-R304 VanDerWaalsContact CG-CB 3.49Å; E291-R304 HydrophobicContact CG-CG 4.46Å; E291-R304 WeakPolarHBondContact OE1-CB 3.15Å
292	D	84	Confident	84.9	Confident	111 Å²	111	71.8 Å²	71.8	59%	0.594	38%	0.38	S	S	*	.	H	α-helix	trans	-58.3	-51.3	171.8	49.6	-67.8	0	0	0	111.2	P290 L294 K295 E296	P290-D292 WeakPolarHBondContact CB-OD1 3.28Å; P290-D292 PolarHBondContact O-N 2.75Å; D292-L294 PolarHBondContact O-N 3.1Å; D292-K295 PolarHBondContact O-N 2.9Å; D292-E296 WeakPolarHBondContact O-CB 3.46Å; D292-E296 PolarHBondContact O-N 2.93Å
293	V	84.5	Confident	84.6	Confident	29 Å²	29	67.8 Å²	67.8	18%	0.176	37%	0.366	C	S	.	.	H	α-helix	trans	-64.5	-37.4	176.4	-177.1	0	0	0	0	112.1	L289 P290 K297	L289-V293 HydrophobicContact CD1-CG1 4.29Å; P290-V293 HydrophobicContact CB-CG2 4.24Å; P290-V293 HydrophobicContact CG-CG2 4.33Å; P290-V293 PolarHBondContact O-N 3.35Å; V293-K297 HydrophobicContact CG1-CD 3.76Å; V293-K297 HydrophobicContact CG1-CG 4.36Å; V293-K297 WeakPolarHBondContact O-CB 3.31Å; V293-K297 WeakPolarHBondContact O-CG 3.45Å; V293-K297 PolarHBondContact O-N 3.23Å
294	L	83.1	Confident	84.3	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-65.2	-44	174.8	-73.1	171.6	0	0	0	111.6	L199 L287 L289 P290 E291 D292 Y298 R304	L199-L294 HydrophobicContact CD1-CD2 3.93Å; L287-L294 HydrophobicContact CB-CD1 4.15Å; L287-L294 HydrophobicContact CD1-CD1 4.08Å; L287-L294 HydrophobicContact CD1-CD2 3.98Å; L289-L294 HydrophobicContact CB-CD2 4.01Å; L289-L294 HydrophobicContact CB-CG 4.02Å; L289-L294 HydrophobicContact CD1-CD2 4.33Å; L289-L294 WeakPolarHBondContact O-CD1 3.49Å; P290-L294 WeakPolarHBondContact O-CG 3.44Å; P290-L294 PolarHBondContact O-N 2.96Å; E291-L294 PolarHBondContact O-N 3.4Å; D292-L294 PolarHBondContact O-N 3.1Å; L294-Y298 HydrophobicContact CD2-CD2 3.91Å; L294-Y298 HydrophobicContact CD2-CE2 4.04Å; L294-Y298 WeakPolarHBondContact O-CB 3.29Å; L294-Y298 PolarHBondContact O-N 2.86Å; L294-R304 HydrophobicContact CD1-CB 4.17Å
295	K	84.2	Confident	84.2	Confident	155 Å²	155	67.3 Å²	67.3	67%	0.674	36%	0.363	S	S	*	.	H	α-helix	trans	-64.4	-41.4	179	-172.6	175.3	-178.2	178.4	0	111.5	E291 D292 G299 G300	E291-K295 WeakPolarHBondContact O-CB 3.49Å; E291-K295 PolarHBondContact O-N 3.13Å; D292-K295 PolarHBondContact O-N 2.9Å; K295-G299 VanDerWaalsContact O-CA 3.23Å; K295-G299 WeakPolarHBondContact O-CA 3.33Å; K295-G299 PolarHBondContact O-N 2.89Å; K295-G300 PolarHBondContact O-N 2.88Å
296	E	85.8	Confident	84.2	Confident	155 Å²	155	66.2 Å²	66.2	72%	0.724	36%	0.358	S	S	*	.	H	α-helix	trans	-64.6	-57	174.4	-172.4	-167.9	-166.2	0	0	111.9	D292	D292-E296 WeakPolarHBondContact O-CB 3.46Å; D292-E296 PolarHBondContact O-N 2.93Å
297	K	83.7	Confident	84.4	Confident	101 Å²	101	65 Å²	65	44%	0.439	36%	0.361	S	S	.	.	H	α-helix	trans	-76.5	-28.4	-169.6	-67.8	-179	-178.6	171.7	0	114.6	V293 R323	V293-K297 HydrophobicContact CG1-CD 3.76Å; V293-K297 HydrophobicContact CG1-CG 4.36Å; V293-K297 WeakPolarHBondContact O-CB 3.31Å; V293-K297 WeakPolarHBondContact O-CG 3.45Å; V293-K297 PolarHBondContact O-N 3.23Å; K297-R323 PolarHBondContact O-NH2 2.86Å
298	Y	85.3	Confident	84.6	Confident	18 Å²	18	66.2 Å²	66.2	7%	0.071	37%	0.374	C	S	.	.	H	α-helix	trans	-119.9	10.4	-175.6	-53.8	-72.7	0	0	0	113.4	L199 L289 L294 G300 Q301 L302 A320 I321	L199-Y298 HydrophobicContact CD2-CE2 4.19Å; L289-Y298 HydrophobicContact CD1-CE2 4.45Å; L294-Y298 HydrophobicContact CD2-CD2 3.91Å; L294-Y298 HydrophobicContact CD2-CE2 4.04Å; L294-Y298 WeakPolarHBondContact O-CB 3.29Å; L294-Y298 PolarHBondContact O-N 2.86Å; Y298-G300 PolarHBondContact O-N 2.67Å; Y298-Q301 WeakPolarHBondContact O-CB 3.41Å; Y298-Q301 VanDerWaalsContact O-CG 3.32Å; Y298-Q301 WeakPolarHBondContact O-CG 3.28Å; Y298-Q301 PolarHBondContact O-N 2.76Å; Y298-L302 HydrophobicContact CD1-CD1 4.47Å; Y298-L302 HydrophobicContact CD2-CD1 4.09Å; Y298-L302 HydrophobicContact CE2-CD1 4.5Å; Y298-L302 HydrophobicContact CG-CD1 4.08Å; Y298-A320 HydrophobicContact CD1-CB 4.22Å; Y298-I321 HydrophobicContact CE1-CG1 3.91Å
299	G	79.7	Confident	85.1	Confident	64 Å²	64	66.7 Å²	66.7	66%	0.66	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	30.7	173.6	0	0	0	0	0	114.1	K295 Q301	K295-G299 VanDerWaalsContact O-CA 3.23Å; K295-G299 WeakPolarHBondContact O-CA 3.33Å; K295-G299 PolarHBondContact O-N 2.89Å; G299-Q301 VanDerWaalsContact C-N 3.31Å; G299-Q301 PolarHBondContact O-N 2.89Å
300	G	78.7	Confident	85.7	Confident	46 Å²	46	65 Å²	65	47%	0.474	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.6	10.9	-176.6	0	0	0	0	0	115.7	K295 Y298 L302	K295-G300 PolarHBondContact O-N 2.88Å; Y298-G300 PolarHBondContact O-N 2.67Å; G300-L302 PolarHBondContact O-N 2.77Å
301	Q	81.6	Confident	86.2	Confident	113 Å²	113	63.1 Å²	63.1	53%	0.528	35%	0.351	S	S	.	.	S	Bend	trans	-69.8	-19.6	176.2	-65.7	-178.5	26.8	0	0	113.6	Y298 G299 A320	Y298-Q301 WeakPolarHBondContact O-CB 3.41Å; Y298-Q301 VanDerWaalsContact O-CG 3.32Å; Y298-Q301 WeakPolarHBondContact O-CG 3.28Å; Y298-Q301 PolarHBondContact O-N 2.76Å; G299-Q301 VanDerWaalsContact C-N 3.31Å; G299-Q301 PolarHBondContact O-N 2.89Å; Q301-A320 HydrophobicContact CB-CB 4.17Å
302	L	86.1	Confident	86.7	Confident	7 Å²	7	62.2 Å²	62.2	4%	0.037	35%	0.347	C	S	.	.			trans	-121.8	132.6	178.5	-57.9	179.8	0	0	0	109.8	L287 Y298 G300 L306 I317 A320	L287-L302 HydrophobicContact CD1-CB 3.84Å; L287-L302 HydrophobicContact CD1-CD1 4.02Å; L287-L302 HydrophobicContact CD1-CG 4.41Å; Y298-L302 HydrophobicContact CD1-CD1 4.47Å; Y298-L302 HydrophobicContact CD2-CD1 4.09Å; Y298-L302 HydrophobicContact CE2-CD1 4.5Å; Y298-L302 HydrophobicContact CG-CD1 4.08Å; G300-L302 PolarHBondContact O-N 2.77Å; L302-L306 HydrophobicContact CD2-CD1 4.31Å; L302-I317 HydrophobicContact CD2-CG1 4.36Å; L302-A320 HydrophobicContact CD1-CB 3.83Å; L302-A320 HydrophobicContact CD2-CB 3.83Å; L302-A320 HydrophobicContact CG-CB 3.69Å
303	T	84.9	Confident	87.1	Confident	71 Å²	71	57 Å²	57	44%	0.436	32%	0.319	S	S	.	.			trans	-93.4	158.7	165.9	44.7	0	0	0	0	109.4	L287 C305 L306	L287-T303 VanDerWaalsContact CD1-O 3.29Å; L287-T303 WeakPolarHBondContact CD1-O 3.28Å; T303-C305 WeakPolarHBondContact CB-O 3.21Å; T303-C305 PolarHBondContact OG1-O 2.72Å; T303-L306 VanDerWaalsContact OG1-CD2 3.31Å; T303-L306 WeakPolarHBondContact OG1-CD2 3.19Å
304	R	86.2	Confident	87.6	Confident	108 Å²	108	55.9 Å²	55.9	41%	0.408	31%	0.312	S	S	.	.	S	Bend	trans	-63	-47.4	179.1	173.2	176.5	175	-171.9	-2.7	111.9	E286 L287 E291 L294	E286-R304 CarbonylContact C-O 3.48Å; E286-R304 WeakPolarHBondContact CA-O 3.21Å; E286-R304 HydrophobicContact CG-CG 3.94Å; E286-R304 IonicContact OE1-CZ 2.68Å; E286-R304 IonicContact OE1-NE 2.77Å; E286-R304 PolarHBondContact OE1-NE 2.87Å; E286-R304 IonicContact OE1-NH2 2.68Å; E286-R304 PolarHBondContact OE1-NH2 2.8Å; L287-R304 WeakPolarHBondContact CB-O 3.4Å; L287-R304 PolarHBondContact N-O 2.92Å; E291-R304 HydrophobicContact CG-CB 3.49Å; E291-R304 VanDerWaalsContact CG-CB 3.49Å; E291-R304 HydrophobicContact CG-CG 4.46Å; E291-R304 WeakPolarHBondContact OE1-CB 3.15Å; L294-R304 HydrophobicContact CD1-CB 4.17Å
305	C	87.4	Confident	88.1	Confident	69 Å²	69	56.4 Å²	56.4	47%	0.466	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	136.3	168.7	-56.8	0	0	0	0	109.9	T303	T303-C305 WeakPolarHBondContact CB-O 3.21Å; T303-C305 PolarHBondContact OG1-O 2.72Å
306	L	89	Confident	88.5	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.005	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	120.5	173.5	-70.2	172.2	0	0	0	109.3	E284 L285 L287 L302 T303 V313 R316 I317	E284-L306 WeakPolarHBondContact CA-O 3.46Å; L285-L306 PolarHBondContact N-O 2.89Å; L285-L306 PolarHBondContact O-N 2.85Å; L287-L306 HydrophobicContact CD1-CD1 3.96Å; L287-L306 HydrophobicContact CD2-CD1 4.11Å; L287-L306 HydrophobicContact CG-CD1 4.13Å; L302-L306 HydrophobicContact CD2-CD1 4.31Å; T303-L306 VanDerWaalsContact OG1-CD2 3.31Å; T303-L306 WeakPolarHBondContact OG1-CD2 3.19Å; L306-V313 HydrophobicContact CB-CG1 3.92Å; L306-V313 HydrophobicContact CD1-CG1 4.34Å; L306-R316 VanDerWaalsContact CD2-CZ 3.44Å; L306-R316 VanDerWaalsContact CD2-NH2 3.28Å; L306-I317 HydrophobicContact CD1-CD1 3.99Å; L306-I317 HydrophobicContact CD1-CG1 3.7Å
307	S	90.3	Very high	88.8	Confident	84 Å²	84	46.9 Å²	46.9	59%	0.587	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.1	156.8	174.2	54.4	0	0	0	0	111.8	V283	V283-S307 WeakPolarHBondContact O-CA 3.21Å
308	G	92.1	Very high	89.3	Confident	26 Å²	26	42.1 Å²	42.1	27%	0.268	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	133.6	-172	178.1	0	0	0	0	0	112.4	E282 V283 L310	E282-G308 WeakPolarHBondContact CA-O 3.41Å; V283-G308 PolarHBondContact N-O 2.61Å; V283-G308 PolarHBondContact O-N 3.06Å; G308-L310 PolarHBondContact O-N 2.86Å
309	S	93.6	Very high	89.6	Confident	24 Å²	24	46.5 Å²	46.5	17%	0.168	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	136.4	177.8	-47.8	0	0	0	0	111.8	E281 Y311 E312 V313	E281-S309 WeakPolarHBondContact O-CA 3.48Å; S309-Y311 VanDerWaalsContact CB-CE1 3.46Å; S309-Y311 PolarHBondContact O-N 2.8Å; S309-Y311 VanDerWaalsContact O-N 3.12Å; S309-E312 WeakPolarHBondContact O-CA 3.48Å; S309-E312 PolarHBondContact O-N 2.84Å; S309-V313 PolarHBondContact O-N 2.87Å
310	L	93.6	Very high	90.2	Very high	5 Å²	5	43.6 Å²	43.6	3%	0.026	24%	0.238	C	C	.	.	H	α-helix	trans	-50.8	-40.8	-175.5	174	60.7	0	0	0	113.2	L202 I205 L277 E281 V283 G308 E312 L314	L202-L310 HydrophobicContact CD2-CD1 4.01Å; I205-L310 HydrophobicContact CD1-CD1 4.31Å; I205-L310 HydrophobicContact CD1-CD2 3.85Å; L277-L310 HydrophobicContact CD2-CD2 4.13Å; L277-L310 HydrophobicContact CD2-CG 4.44Å; E281-L310 HydrophobicContact CG-CB 4.31Å; E281-L310 HydrophobicContact CG-CD2 3.98Å; E281-L310 WeakPolarHBondContact O-CB 3.48Å; E281-L310 PolarHBondContact O-N 3.31Å; V283-L310 HydrophobicContact CB-CD1 4.37Å; V283-L310 HydrophobicContact CG1-CB 4.41Å; V283-L310 HydrophobicContact CG1-CD1 4.03Å; G308-L310 PolarHBondContact O-N 2.86Å; L310-E312 VanDerWaalsContact C-N 3.32Å; L310-E312 PolarHBondContact O-N 2.86Å; L310-L314 VanDerWaalsContact O-CB 3.29Å; L310-L314 WeakPolarHBondContact O-CB 3.26Å; L310-L314 PolarHBondContact O-N 3.42Å
311	Y	94	Very high	90.8	Very high	23 Å²	23	41.9 Å²	41.9	9%	0.09	22%	0.218	C	C	.	.	H	α-helix	trans	-67.7	-29.2	178.2	76.4	-92.9	0	0	0	113.3	L244 M253 K279 S309 A315	L244-Y311 HydrophobicContact CD1-CD2 3.9Å; L244-Y311 HydrophobicContact CD2-CD2 3.99Å; L244-Y311 HydrophobicContact CD2-CE2 4.35Å; M253-Y311 HydrophobicContact CB-CD1 4.37Å; M253-Y311 HydrophobicContact CB-CD2 4.38Å; M253-Y311 HydrophobicContact CB-CG 4Å; M253-Y311 HydrophobicContact CE-CD2 4.29Å; M253-Y311 HydrophobicContact CE-CE2 4.25Å; M253-Y311 HydrophobicContact CG-CD1 3.75Å; M253-Y311 HydrophobicContact CG-CD2 3.96Å; M253-Y311 HydrophobicContact CG-CE1 4.05Å; M253-Y311 HydrophobicContact CG-CE2 4.24Å; M253-Y311 HydrophobicContact CG-CG 3.72Å; K279-Y311 HydrophobicContact CB-CE1 4.49Å; K279-Y311 HydrophobicContact CG-CE1 3.78Å; S309-Y311 VanDerWaalsContact CB-CE1 3.46Å; S309-Y311 PolarHBondContact O-N 2.8Å; S309-Y311 VanDerWaalsContact O-N 3.12Å; Y311-A315 WeakPolarHBondContact O-CB 3.32Å; Y311-A315 PolarHBondContact O-N 2.84Å; Y311-A315 VanDerWaalsContact O-N 3.08Å
312	E	93.2	Very high	91.3	Very high	96 Å²	96	37.1 Å²	37.1	45%	0.449	20%	0.196	S	C	.	.	H	α-helix	trans	-81.6	-41.5	177.4	-59.5	-159.5	173.5	0	0	111.8	S309 L310 A315 R316	S309-E312 WeakPolarHBondContact O-CA 3.48Å; S309-E312 PolarHBondContact O-N 2.84Å; L310-E312 VanDerWaalsContact C-N 3.32Å; L310-E312 PolarHBondContact O-N 2.86Å; E312-A315 PolarHBondContact O-N 2.8Å; E312-R316 WeakPolarHBondContact O-CG 3.34Å; E312-R316 PolarHBondContact O-N 3.34Å
313	V	93.2	Very high	91.5	Very high	2 Å²	2	46 Å²	46	1%	0.012	23%	0.229	C	C	.	.	H	α-helix	trans	-62.7	-47.3	175.8	-179.8	0	0	0	0	110.1	V283 L285 L306 S309 A315 R316 I317	V283-V313 HydrophobicContact CG1-CB 3.92Å; V283-V313 HydrophobicContact CG1-CG1 4.12Å; V283-V313 HydrophobicContact CG1-CG2 3.93Å; L285-V313 HydrophobicContact CD1-CG1 3.75Å; L306-V313 HydrophobicContact CB-CG1 3.92Å; L306-V313 HydrophobicContact CD1-CG1 4.34Å; S309-V313 PolarHBondContact O-N 2.87Å; V313-A315 PolarHBondContact O-N 3.41Å; V313-R316 PolarHBondContact O-N 3.48Å; V313-I317 HydrophobicContact CG1-CD1 3.93Å; V313-I317 WeakPolarHBondContact O-CG1 3.46Å; V313-I317 PolarHBondContact O-N 2.97Å
314	L	93.8	Very high	91.7	Very high	5 Å²	5	46.4 Å²	46.4	3%	0.026	23%	0.225	C	C	.	.	H	α-helix	trans	-57.9	-46.5	171.6	175	67.5	0	0	0	111.7	L202 I218 F255 L275 L277 L310 R316 I317 M318	L202-L314 HydrophobicContact CD1-CB 4.48Å; L202-L314 HydrophobicContact CD1-CD1 3.68Å; I218-L314 HydrophobicContact CD1-CD1 4.35Å; F255-L314 HydrophobicContact CB-CD2 4.17Å; F255-L314 HydrophobicContact CD1-CD2 3.73Å; F255-L314 HydrophobicContact CD1-CG 4.4Å; F255-L314 HydrophobicContact CD2-CD2 4.3Å; F255-L314 HydrophobicContact CE1-CD2 4.15Å; F255-L314 HydrophobicContact CE1-CG 4.35Å; F255-L314 HydrophobicContact CG-CD2 3.8Å; F255-L314 HydrophobicContact CZ-CG 4.48Å; L275-L314 HydrophobicContact CD1-CD2 3.64Å; L277-L314 HydrophobicContact CD1-CD2 3.8Å; L310-L314 VanDerWaalsContact O-CB 3.29Å; L310-L314 WeakPolarHBondContact O-CB 3.26Å; L310-L314 PolarHBondContact O-N 3.42Å; L314-R316 VanDerWaalsContact C-N 3.33Å; L314-R316 PolarHBondContact O-N 3.2Å; L314-I317 PolarHBondContact O-N 2.96Å; L314-M318 HydrophobicContact CD1-CG 3.54Å; L314-M318 HydrophobicContact CD1-SD 4.42Å; L314-M318 HydrophobicContact CG-CG 4.04Å; L314-M318 VanDerWaalsContact O-CB 3.28Å; L314-M318 WeakPolarHBondContact O-CB 3.32Å; L314-M318 VanDerWaalsContact O-CG 3.28Å; L314-M318 WeakPolarHBondContact O-CG 3.25Å; L314-M318 PolarHBondContact O-N 3.48Å
315	A	93.9	Very high	92	Very high	12 Å²	12	49.9 Å²	49.9	10%	0.099	24%	0.238	C	C	.	.	H	α-helix	trans	-60.3	-41.1	179.5	0	0	0	0	0	112.4	F255 Y311 E312 V313 K319 I326	F255-A315 HydrophobicContact CE2-CB 4.09Å; Y311-A315 WeakPolarHBondContact O-CB 3.32Å; Y311-A315 PolarHBondContact O-N 2.84Å; Y311-A315 VanDerWaalsContact O-N 3.08Å; E312-A315 PolarHBondContact O-N 2.8Å; V313-A315 PolarHBondContact O-N 3.41Å; A315-K319 WeakPolarHBondContact O-CB 3.5Å; A315-K319 PolarHBondContact O-N 3.44Å; A315-I326 HydrophobicContact CB-CD1 3.61Å; A315-I326 WeakPolarHBondContact O-CD1 3.5Å
316	R	92	Very high	92.3	Very high	109 Å²	109	48.2 Å²	48.2	41%	0.411	22%	0.224	S	C	.	.	H	α-helix	trans	-62.5	-50.3	175.9	-73.1	173.6	67.8	-175.6	-0.7	111.4	L306 E312 V313 L314 K319 A320	L306-R316 VanDerWaalsContact CD2-CZ 3.44Å; L306-R316 VanDerWaalsContact CD2-NH2 3.28Å; E312-R316 WeakPolarHBondContact O-CG 3.34Å; E312-R316 PolarHBondContact O-N 3.34Å; V313-R316 PolarHBondContact O-N 3.48Å; L314-R316 VanDerWaalsContact C-N 3.33Å; L314-R316 PolarHBondContact O-N 3.2Å; R316-K319 PolarHBondContact O-N 3.05Å; R316-A320 PolarHBondContact O-N 3.17Å
317	I	92.5	Very high	92.6	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-59.8	-51.8	179	-65.6	167.7	0	0	0	110.7	A200 I218 L285 L287 L302 L306 V313 L314 K319 A320 I321	A200-I317 HydrophobicContact CB-CD1 4.2Å; I218-I317 HydrophobicContact CD1-CG2 3.81Å; I218-I317 HydrophobicContact CG2-CG2 4.05Å; L285-I317 HydrophobicContact CD1-CD1 4.24Å; L287-I317 HydrophobicContact CD2-CD1 4.07Å; L287-I317 HydrophobicContact CD2-CG1 4.4Å; L302-I317 HydrophobicContact CD2-CG1 4.36Å; L306-I317 HydrophobicContact CD1-CD1 3.99Å; L306-I317 HydrophobicContact CD1-CG1 3.7Å; V313-I317 HydrophobicContact CG1-CD1 3.93Å; V313-I317 WeakPolarHBondContact O-CG1 3.46Å; V313-I317 PolarHBondContact O-N 2.97Å; L314-I317 PolarHBondContact O-N 2.96Å; I317-K319 PolarHBondContact O-N 2.72Å; I317-A320 PolarHBondContact O-N 3.2Å; I317-I321 HydrophobicContact CG2-CD1 3.57Å; I317-I321 HydrophobicContact CG2-CG1 4.48Å; I317-I321 WeakPolarHBondContact O-CG1 3.44Å; I317-I321 PolarHBondContact O-N 3.49Å
318	M	93.3	Very high	92.7	Very high	2 Å²	2	52.9 Å²	52.9	1%	0.01	24%	0.236	C	C	.	.	H	α-helix	trans	-63.6	-39.1	-178.2	-73.3	-64.7	-72.8	0	0	113.1	L223 I239 L242 F255 I257 L314 A320 V322	L223-M318 HydrophobicContact CD1-CE 3.73Å; L223-M318 HydrophobicContact CD1-SD 3.97Å; L223-M318 HydrophobicContact CD2-SD 4.16Å; I239-M318 HydrophobicContact CD1-CE 4.11Å; L242-M318 HydrophobicContact CD1-CB 3.95Å; L242-M318 HydrophobicContact CD2-CE 3.77Å; F255-M318 HydrophobicContact CE1-CB 4.28Å; F255-M318 HydrophobicContact CE1-CE 4.23Å; F255-M318 HydrophobicContact CE1-CG 3.96Å; F255-M318 HydrophobicContact CZ-CB 3.77Å; F255-M318 HydrophobicContact CZ-CG 3.91Å; I257-M318 HydrophobicContact CD1-CE 3.79Å; I257-M318 HydrophobicContact CG1-CE 4.14Å; L314-M318 HydrophobicContact CD1-CG 3.54Å; L314-M318 HydrophobicContact CD1-SD 4.42Å; L314-M318 HydrophobicContact CG-CG 4.04Å; L314-M318 VanDerWaalsContact O-CB 3.28Å; L314-M318 WeakPolarHBondContact O-CB 3.32Å; L314-M318 VanDerWaalsContact O-CG 3.28Å; L314-M318 WeakPolarHBondContact O-CG 3.25Å; L314-M318 PolarHBondContact O-N 3.48Å; M318-A320 PolarHBondContact O-N 2.92Å; M318-V322 HydrophobicContact CE-CG2 4Å; M318-V322 VanDerWaalsContact O-CB 3.27Å; M318-V322 WeakPolarHBondContact O-CB 3.42Å; M318-V322 VanDerWaalsContact O-CG2 3.26Å; M318-V322 WeakPolarHBondContact O-CG2 3.32Å; M318-V322 PolarHBondContact O-N 2.96Å
319	K	93.6	Very high	92.7	Very high	110 Å²	110	52.8 Å²	52.8	48%	0.478	23%	0.231	S	C	.	.	H	α-helix	trans	-61.1	-43	175.5	-180	-176.1	173.4	-171	0	111.8	A315 R316 I317 R323 I326	A315-K319 WeakPolarHBondContact O-CB 3.5Å; A315-K319 PolarHBondContact O-N 3.44Å; R316-K319 PolarHBondContact O-N 3.05Å; I317-K319 PolarHBondContact O-N 2.72Å; K319-R323 WeakPolarHBondContact O-CA 3.38Å; K319-R323 PolarHBondContact O-N 3Å; K319-R323 VanDerWaalsContact O-N 3.11Å; K319-I326 HydrophobicContact CB-CD1 4.02Å; K319-I326 HydrophobicContact CB-CG1 4.45Å
320	A	91.6	Very high	92.3	Very high	2 Å²	2	52.8 Å²	52.8	2%	0.017	24%	0.235	C	C	.	.	H	α-helix	trans	-71.4	-40.8	-178.1	0	0	0	0	0	112.9	Y298 Q301 L302 R316 I317 M318 R323	Y298-A320 HydrophobicContact CD1-CB 4.22Å; Q301-A320 HydrophobicContact CB-CB 4.17Å; L302-A320 HydrophobicContact CD1-CB 3.83Å; L302-A320 HydrophobicContact CD2-CB 3.83Å; L302-A320 HydrophobicContact CG-CB 3.69Å; R316-A320 PolarHBondContact O-N 3.17Å; I317-A320 PolarHBondContact O-N 3.2Å; M318-A320 PolarHBondContact O-N 2.92Å; A320-R323 WeakPolarHBondContact O-CG 3.38Å
321	I	91.7	Very high	92	Very high	11 Å²	11	62.4 Å²	62.4	6%	0.056	27%	0.271	C	S	.	.	H	α-helix	trans	-76.8	-50.3	-178.2	-59.6	168.6	0	0	0	111.5	L199 I218 I236 Y298 I317 R323	L199-I321 HydrophobicContact CD2-CD1 3.65Å; L199-I321 HydrophobicContact CD2-CG1 4.1Å; I218-I321 HydrophobicContact CG2-CD1 3.24Å; I236-I321 HydrophobicContact CD1-CG2 3.64Å; I236-I321 HydrophobicContact CG1-CG2 3.81Å; I236-I321 HydrophobicContact CG2-CG2 4.25Å; Y298-I321 HydrophobicContact CE1-CG1 3.91Å; I317-I321 HydrophobicContact CG2-CD1 3.57Å; I317-I321 HydrophobicContact CG2-CG1 4.48Å; I317-I321 WeakPolarHBondContact O-CG1 3.44Å; I317-I321 PolarHBondContact O-N 3.49Å; I321-R323 PolarHBondContact O-N 2.94Å
322	V	91.9	Very high	91.9	Very high	12 Å²	12	61.8 Å²	61.8	7%	0.073	27%	0.269	C	S	.	.	H	α-helix	trans	-72.8	-17.3	-178.5	-172.3	0	0	0	0	111.4	I236 I239 L242 M318 K324	I236-V322 HydrophobicContact CD1-CG2 4.13Å; I236-V322 HydrophobicContact CG2-CB 4.45Å; I236-V322 HydrophobicContact CG2-CG2 4.28Å; I239-V322 HydrophobicContact CB-CG1 3.99Å; I239-V322 HydrophobicContact CD1-CG2 3.86Å; I239-V322 HydrophobicContact CG2-CG1 3.77Å; I239-V322 HydrophobicContact CG2-CG2 4.41Å; L242-V322 HydrophobicContact CD1-CB 4.24Å; L242-V322 HydrophobicContact CD1-CG2 4.3Å; M318-V322 HydrophobicContact CE-CG2 4Å; M318-V322 VanDerWaalsContact O-CB 3.27Å; M318-V322 WeakPolarHBondContact O-CB 3.42Å; M318-V322 VanDerWaalsContact O-CG2 3.26Å; M318-V322 WeakPolarHBondContact O-CG2 3.32Å; M318-V322 PolarHBondContact O-N 2.96Å; V322-K324 HydrophobicContact CG1-CB 4.03Å; V322-K324 HydrophobicContact CG1-CD 3.96Å; V322-K324 HydrophobicContact CG1-CG 4.06Å; V322-K324 PolarHBondContact O-N 2.9Å; V322-K324 VanDerWaalsContact O-N 3.08Å
323	R	90.3	Very high	91.8	Very high	194 Å²	194	60.8 Å²	60.8	73%	0.732	27%	0.269	S	S	*	.			trans	54.5	25.3	-177.6	-61.3	178	172.7	-179.7	-4.5	113.3	K297 K319 A320 I321	K297-R323 PolarHBondContact O-NH2 2.86Å; K319-R323 WeakPolarHBondContact O-CA 3.38Å; K319-R323 PolarHBondContact O-N 3Å; K319-R323 VanDerWaalsContact O-N 3.11Å; A320-R323 WeakPolarHBondContact O-CG 3.38Å; I321-R323 PolarHBondContact O-N 2.94Å
324	K	89.5	Confident	91.6	Very high	80 Å²	80	60.7 Å²	60.7	35%	0.348	27%	0.269	S	S	.	.			trans	-116.3	143.7	178.1	-70.8	-178.9	-177.4	179.7	0	110.6	I239 L240 V322	I239-K324 PolarHBondContact O-NZ 2.69Å; L240-K324 WeakPolarHBondContact O-CD 3.3Å; L240-K324 PolarHBondContact O-NZ 2.93Å; V322-K324 HydrophobicContact CG1-CB 4.03Å; V322-K324 HydrophobicContact CG1-CD 3.96Å; V322-K324 HydrophobicContact CG1-CG 4.06Å; V322-K324 PolarHBondContact O-N 2.9Å; V322-K324 VanDerWaalsContact O-N 3.08Å
325	R	92	Very high	91.3	Very high	180 Å²	180	64.2 Å²	64.2	68%	0.679	29%	0.288	S	S	*	.			trans	-64.6	138.7	174.8	68	-176.8	-176.6	157.4	4.6	111.1
326	I	94.3	Very high	90.9	Very high	34 Å²	34	66.4 Å²	66.4	17%	0.174	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	131.9	170.5	-63.5	170.9	0	0	0	108.4	L242 L244 F255 A315 K319	L242-I326 HydrophobicContact CB-CB 4.41Å; L242-I326 HydrophobicContact CB-CG1 3.81Å; L242-I326 HydrophobicContact CD1-CD1 4.45Å; L242-I326 HydrophobicContact CD1-CG1 3.84Å; L242-I326 HydrophobicContact CG-CG1 4.49Å; L244-I326 HydrophobicContact CB-CG2 3.65Å; F255-I326 HydrophobicContact CE2-CD1 4.04Å; F255-I326 HydrophobicContact CZ-CD1 4.39Å; A315-I326 HydrophobicContact CB-CD1 3.61Å; A315-I326 WeakPolarHBondContact O-CD1 3.5Å; K319-I326 HydrophobicContact CB-CD1 4.02Å; K319-I326 HydrophobicContact CB-CG1 4.45Å
327	R	93.7	Very high	90.7	Very high	71 Å²	71	63.9 Å²	63.9	27%	0.268	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	107.7	175.9	-72.1	174.2	-75.8	-160.1	-7.1	110.3	L242 F243 L244 M355 H368	L242-R327 PolarHBondContact O-N 3.22Å; L242-R327 PolarHBondContact O-NE 2.88Å; F243-R327 VanDerWaalsContact CA-O 3.23Å; F243-R327 WeakPolarHBondContact CA-O 3.1Å; F243-R327 HydrophobicContact CD1-CB 3.71Å; F243-R327 HydrophobicContact CE1-CB 4.33Å; F243-R327 VanDerWaalsContact CE2-NH2 3.27Å; F243-R327 HydrophobicContact CG-CB 4.31Å; L244-R327 PolarHBondContact N-O 2.86Å; R327-M355 HydrophobicContact CB-CE 3.99Å; R327-H368 PolarHBondContact NH1-CE1 3.41Å; R327-H368 VanDerWaalsContact NH1-CE1 3.26Å; R327-H368 PolarHBondContact NH1-NE2 3.18Å; R327-H368 VanDerWaalsContact NH1-NE2 3.15Å
328	I	93.7	Very high	90.6	Very high	112 Å²	112	65 Å²	65	57%	0.574	32%	0.315	S	S	*	.			trans	-86.2	164.1	164.1	59.6	173.1	0	0	0	110.1	L244 M355	L244-I328 HydrophobicContact CB-CG2 4.37Å; I328-M355 VanDerWaalsContact C-CE 3.43Å; I328-M355 WeakPolarHBondContact O-CE 3.5Å
329	P	90.9	Very high	90.6	Very high	24 Å²	24	66.2 Å²	66.2	16%	0.156	32%	0.322	C	S	.	.			trans	-56.2	159	173.2	-23.3	34.7	0	0	0	112.9	L245 P246 P339 Y353 M355	L245-P329 HydrophobicContact CD2-CG 3.92Å; P246-P329 HydrophobicContact CG-CG 4.49Å; P329-P339 HydrophobicContact CB-CB 3.62Å; P329-P339 HydrophobicContact CB-CG 4.03Å; P329-P339 HydrophobicContact CG-CB 4.01Å; P329-P339 HydrophobicContact CG-CG 3.87Å; P329-Y353 HydrophobicContact CG-CD1 4.4Å; P329-M355 HydrophobicContact CB-SD 4.38Å
330	G	85.3	Confident	90.6	Very high	25 Å²	25	61 Å²	61	26%	0.258	30%	0.299	S	S	.	.			trans	-78.2	-155	177.7	0	0	0	0	0	112.9	F332	G330-F332 PolarHBondContact O-N 2.79Å
331	R	88	Confident	90.7	Very high	207 Å²	207	60.9 Å²	60.9	78%	0.781	30%	0.299	S	S	*	.	S	Bend	trans	-71.5	-8.5	172.2	-65.1	178.2	175.9	176.1	-3.8	114	T333	R331-T333 PolarHBondContact O-N 2.75Å
332	F	91.6	Very high	90.8	Very high	9 Å²	9	62.8 Å²	62.8	4%	0.039	31%	0.313	C	S	.	.			trans	-61.7	129.5	-177.8	-179.2	-94.8	0	0	0	111.6	G330 P339 I341 P354 K413 Y417	G330-F332 PolarHBondContact O-N 2.79Å; F332-P339 WeakPolarHBondContact O-CB 3.49Å; F332-I341 HydrophobicContact CE1-CD1 3.87Å; F332-I341 HydrophobicContact CE1-CG1 3.69Å; F332-I341 HydrophobicContact CZ-CD1 3.65Å; F332-I341 HydrophobicContact CZ-CG1 3.87Å; F332-P354 HydrophobicContact CB-CB 3.95Å; F332-P354 HydrophobicContact CB-CG 4.32Å; F332-P354 HydrophobicContact CD1-CB 4.14Å; F332-P354 HydrophobicContact CD1-CG 3.56Å; F332-P354 HydrophobicContact CD2-CB 4.28Å; F332-P354 HydrophobicContact CD2-CG 4.07Å; F332-P354 HydrophobicContact CE1-CG 3.87Å; F332-P354 HydrophobicContact CE2-CG 4.34Å; F332-P354 HydrophobicContact CG-CB 3.83Å; F332-P354 HydrophobicContact CG-CG 3.68Å; F332-P354 HydrophobicContact CZ-CG 4.25Å; F332-K413 HydrophobicContact CE2-CB 4.07Å; F332-K413 HydrophobicContact CZ-CB 4.44Å; F332-Y417 HydrophobicContact CB-CD2 3.89Å; F332-Y417 HydrophobicContact CB-CE2 3.94Å; F332-Y417 HydrophobicContact CB-CG 4.45Å; F332-Y417 HydrophobicContact CD2-CD2 4Å; F332-Y417 AromaticContact CD2-CG 3.85Å; F332-Y417 HydrophobicContact CD2-CG 3.85Å; F332-Y417 HydrophobicContact CG-CD2 4.41Å
333	T	91.6	Very high	90.9	Very high	76 Å²	76	62.4 Å²	62.4	47%	0.466	31%	0.311	S	S	.	.			trans	-135.9	114.7	172.3	-57.1	0	0	0	0	108.4	R331 K413	R331-T333 PolarHBondContact O-N 2.75Å; T333-K413 WeakPolarHBondContact O-CD 3.25Å
334	G	89	Confident	91.1	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.282	C	S	.	.			trans	-65.5	176.4	-178.2	0	0	0	0	0	113.8	T336 G337 T338 E410 K413	G334-T336 PolarHBondContact O-N 3.45Å; G334-G337 PolarHBondContact O-N 2.87Å; G334-G337 VanDerWaalsContact O-N 3.09Å; G334-T338 PolarHBondContact N-O 3.26Å; G334-E410 WeakPolarHBondContact CA-OE2 3.33Å; G334-K413 PolarHBondContact O-NZ 3.28Å
335	N	87.9	Confident	91.3	Very high	79 Å²	79	50.8 Å²	50.8	42%	0.422	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-40.1	172.3	-172.7	59.4	0	0	0	111.3	G337 E409 E410	N335-G337 PolarHBondContact O-N 2.87Å; N335-E409 HydrophobicContact CB-CB 4.13Å; N335-E409 WeakPolarHBondContact ND2-CB 3.37Å; N335-E410 WeakPolarHBondContact CA-OE1 3.23Å; N335-E410 HydrophobicContact CB-CG 4.25Å; N335-E410 WeakPolarHBondContact CB-OE1 3.38Å; N335-E410 PolarHBondContact N-OE1 2.75Å; N335-E410 PolarHBondContact N-OE2 3.42Å
336	T	84.6	Confident	91.2	Very high	58 Å²	58	49.4 Å²	49.4	36%	0.356	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	3.5	175.5	57.5	0	0	0	0	115.3	Q248 G334 T338 E410	Q248-T336 PolarHBondContact NE2-OG1 3.3Å; G334-T336 PolarHBondContact O-N 3.45Å; T336-T338 PolarHBondContact O-N 3.15Å; T336-E410 PolarHBondContact N-OE1 3.21Å; T336-E410 VanDerWaalsContact N-OE1 3.11Å; T336-E410 PolarHBondContact OG1-OE1 3.12Å
337	G	87.8	Confident	90.8	Very high	55 Å²	55	53.6 Å²	53.6	57%	0.567	30%	0.3	S	S	*	.	S	Bend	trans	75.5	6.8	179.5	0	0	0	0	0	114.5	G334 N335	G334-G337 PolarHBondContact O-N 2.87Å; G334-G337 VanDerWaalsContact O-N 3.09Å; N335-G337 PolarHBondContact O-N 2.87Å
338	T	90.4	Very high	90.8	Very high	25 Å²	25	51.6 Å²	51.6	15%	0.153	30%	0.298	C	S	.	.	S	Bend	trans	-115.9	158.8	179.2	83.2	0	0	0	0	110.7	Q248 G334 T336 A340	Q248-T338 HydrophobicContact CG-CG2 4.04Å; G334-T338 PolarHBondContact N-O 3.26Å; T336-T338 PolarHBondContact O-N 3.15Å; T338-A340 PolarHBondContact O-N 2.87Å; T338-A340 PolarHBondContact OG1-N 2.86Å; T338-A340 PolarHBondContact OG1-O 2.94Å
339	P	93.3	Very high	90.7	Very high	26 Å²	26	50.7 Å²	50.7	17%	0.169	30%	0.302	C	S	.	.	S	Bend	trans	-77.9	8.3	174.3	34.3	-37.3	0	0	0	113.5	P246 P329 F332	P246-P339 HydrophobicContact CG-CG 3.63Å; P329-P339 HydrophobicContact CB-CB 3.62Å; P329-P339 HydrophobicContact CB-CG 4.03Å; P329-P339 HydrophobicContact CG-CB 4.01Å; P329-P339 HydrophobicContact CG-CG 3.87Å; F332-P339 WeakPolarHBondContact O-CB 3.49Å
340	A	93.8	Very high	90.9	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	30%	0.298	C	S	.	.			trans	-109.8	122.5	-176.6	0	0	0	0	0	110.6	Q248 T338 F351 Y353	Q248-A340 HydrophobicContact CB-CB 4.23Å; T338-A340 PolarHBondContact O-N 2.87Å; T338-A340 PolarHBondContact OG1-N 2.86Å; T338-A340 PolarHBondContact OG1-O 2.94Å; A340-F351 HydrophobicContact CB-CB 4.35Å; A340-F351 HydrophobicContact CB-CD1 4.43Å; A340-Y353 HydrophobicContact CB-CD1 4.11Å; A340-Y353 HydrophobicContact CB-CE1 3.58Å
341	I	93.9	Very high	91.3	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	120.1	171.5	-56.7	176.3	0	0	0	107.8	F332 F351 L352 P354 I406 E410 L414	F332-I341 HydrophobicContact CE1-CD1 3.87Å; F332-I341 HydrophobicContact CE1-CG1 3.69Å; F332-I341 HydrophobicContact CZ-CD1 3.65Å; F332-I341 HydrophobicContact CZ-CG1 3.87Å; I341-F351 CarbonylContact O-C 3.5Å; I341-F351 WeakPolarHBondContact O-CA 3.31Å; I341-L352 HydrophobicContact CB-CB 4.32Å; I341-L352 PolarHBondContact N-O 3.15Å; I341-L352 PolarHBondContact O-N 2.93Å; I341-P354 HydrophobicContact CD1-CG 4.05Å; I341-I406 HydrophobicContact CG2-CB 4.5Å; I341-I406 HydrophobicContact CG2-CG1 4.3Å; I341-I406 HydrophobicContact CG2-CG2 3.48Å; I341-I406 VanDerWaalsContact CG2-CG2 3.48Å; I341-E410 HydrophobicContact CG2-CB 4.42Å; I341-E410 HydrophobicContact CG2-CG 4.34Å; I341-L414 HydrophobicContact CD1-CB 4.31Å; I341-L414 HydrophobicContact CD1-CD1 3.95Å; I341-L414 HydrophobicContact CD1-CD2 4.08Å; I341-L414 HydrophobicContact CD1-CG 4.34Å
342	S	93.7	Very high	91.7	Very high	51 Å²	51	40.3 Å²	40.3	36%	0.357	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	128	171.1	-173.8	0	0	0	0	109.8
343	C	93.4	Very high	91.9	Very high	5 Å²	5	39.9 Å²	39.9	3%	0.034	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	173.4	178.9	71.5	0	0	0	0	112.2	S349 G350 F361 I406	C343-S349 CarbonylContact O-C 3.55Å; C343-S349 WeakPolarHBondContact O-CA 3.33Å; C343-G350 PolarHBondContact N-O 3.07Å; C343-G350 PolarHBondContact O-N 3.27Å; C343-G350 VanDerWaalsContact O-O 3.05Å; C343-F361 VanDerWaalsContact SG-CE2 3.59Å; C343-I406 HydrophobicContact CB-CD1 4.45Å; C343-I406 HydrophobicContact CB-CG1 3.6Å
344	A	93.8	Very high	92	Very high	15 Å²	15	36.3 Å²	36.3	12%	0.124	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	146.3	165.2	0	0	0	0	0	110.9	A348 F403 T404	A344-A348 WeakPolarHBondContact CA-O 3.4Å; A344-F403 CarbonylContact O-C 3.57Å; A344-F403 WeakPolarHBondContact O-CA 3.01Å; A344-T404 PolarHBondContact N-O 3.36Å; A344-T404 PolarHBondContact O-N 3.23Å
345	Y	93.6	Very high	92.2	Very high	15 Å²	15	36.6 Å²	36.6	6%	0.059	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	130	165	179.9	-105.7	0	0	0	109	S347 A348 F361 P365 L367 Y401 T402 F403	Y345-S347 PolarHBondContact O-N 3.3Å; Y345-A348 PolarHBondContact N-O 3.39Å; Y345-A348 PolarHBondContact O-N 3.42Å; Y345-A348 VanDerWaalsContact O-N 3.14Å; Y345-F361 HydrophobicContact CD1-CD1 4.42Å; Y345-F361 HydrophobicContact CD1-CE1 4.31Å; Y345-F361 HydrophobicContact CG-CD1 4.42Å; Y345-F361 HydrophobicContact CG-CE1 4.32Å; Y345-P365 HydrophobicContact CD1-CG 4.07Å; Y345-P365 HydrophobicContact CE1-CG 3.84Å; Y345-L367 HydrophobicContact CD1-CD1 3.87Å; Y345-L367 HydrophobicContact CD2-CD1 4.42Å; Y345-L367 HydrophobicContact CE1-CD1 3.4Å; Y345-L367 VanDerWaalsContact CE1-CD1 3.4Å; Y345-L367 HydrophobicContact CE1-CG 4.36Å; Y345-L367 HydrophobicContact CE2-CD1 4.03Å; Y345-L367 HydrophobicContact CG-CD1 4.37Å; Y345-Y401 HydrophobicContact CE2-CD1 4.1Å; Y345-Y401 AromaticContact CZ-CD1 3.92Å; Y345-Y401 WeakPolarHBondContact OH-CD1 3.22Å; Y345-T402 VanDerWaalsContact CD2-O 3.25Å; Y345-T402 WeakPolarHBondContact CD2-O 3.46Å; Y345-F403 AromaticContact CD2-CD1 3.87Å; Y345-F403 HydrophobicContact CD2-CD1 3.87Å; Y345-F403 AromaticContact CD2-CE1 3.77Å; Y345-F403 HydrophobicContact CD2-CE1 3.77Å; Y345-F403 HydrophobicContact CD2-CZ 4.42Å; Y345-F403 HydrophobicContact CG-CD1 4.24Å; Y345-F403 HydrophobicContact CG-CE1 4.1Å
346	K	90	Very high	92.4	Very high	150 Å²	150	37.5 Å²	37.5	65%	0.652	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.1	-95.4	-168.5	-66.6	169.5	174.5	164	0	112.1
347	S	87.3	Confident	92.6	Very high	123 Å²	123	41.9 Å²	41.9	86%	0.86	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-135	25.5	-177.6	73.2	0	0	0	0	112.6	Y345	Y345-S347 PolarHBondContact O-N 3.3Å
348	A	92.6	Very high	92.9	Very high	28 Å²	28	39.3 Å²	39.3	23%	0.231	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	132.2	-178.7	0	0	0	0	0	110.8	A344 Y345 K364	A344-A348 WeakPolarHBondContact CA-O 3.4Å; Y345-A348 PolarHBondContact N-O 3.39Å; Y345-A348 PolarHBondContact O-N 3.42Å; Y345-A348 VanDerWaalsContact O-N 3.14Å; A348-K364 HydrophobicContact CB-CB 4.25Å; A348-K364 WeakPolarHBondContact CB-O 3.32Å
349	S	92.9	Very high	93	Very high	94 Å²	94	38.1 Å²	38.1	66%	0.657	21%	0.214	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-70.6	149.6	171.2	-49.4	0	0	0	0	111.2	C343	C343-S349 CarbonylContact O-C 3.55Å; C343-S349 WeakPolarHBondContact O-CA 3.33Å
350	G	94	Very high	93.1	Very high	6 Å²	6	36.9 Å²	36.9	6%	0.062	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.4	-161	-178.9	0	0	0	0	0	112	C343 I362	C343-G350 PolarHBondContact N-O 3.07Å; C343-G350 PolarHBondContact O-N 3.27Å; C343-G350 VanDerWaalsContact O-O 3.05Å; G350-I362 CarbonylContact C-O 3.59Å; G350-I362 WeakPolarHBondContact CA-O 3.37Å
351	F	95	Very high	93.2	Very high	32 Å²	32	37 Å²	37	14%	0.14	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	126.7	-176.6	-54.8	-68.8	0	0	0	110.1	H247 Q248 F254 A340 I341 Y353 F361 I362	H247-F351 AromaticContact CE1-CE2 3.65Å; H247-F351 AromaticContact CE1-CZ 3.4Å; H247-F351 WeakPolarHBondContact CE1-CZ 3.39Å; H247-F351 AromaticContact ND1-CZ 3.94Å; H247-F351 AromaticContact NE2-CE2 3.62Å; H247-F351 AromaticContact NE2-CZ 3.81Å; Q248-F351 HydrophobicContact CB-CD1 4.33Å; Q248-F351 HydrophobicContact CB-CE1 3.95Å; F254-F351 HydrophobicContact CE2-CD2 4.22Å; F254-F351 HydrophobicContact CE2-CE2 4.38Å; A340-F351 HydrophobicContact CB-CB 4.35Å; A340-F351 HydrophobicContact CB-CD1 4.43Å; I341-F351 CarbonylContact O-C 3.5Å; I341-F351 WeakPolarHBondContact O-CA 3.31Å; F351-Y353 HydrophobicContact CB-CD2 4.35Å; F351-Y353 HydrophobicContact CB-CE2 3.59Å; F351-F361 WeakPolarHBondContact O-CA 3.45Å; F351-F361 WeakPolarHBondContact O-CD2 3.37Å; F351-I362 PolarHBondContact N-O 2.92Å; F351-I362 PolarHBondContact O-N 2.84Å
352	L	95.6	Very high	93.1	Very high	0 Å²	0	37 Å²	37	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	123	169.5	177.3	67.2	0	0	0	108.9	I341 F359 F361 F391 F403	I341-L352 HydrophobicContact CB-CB 4.32Å; I341-L352 PolarHBondContact N-O 3.15Å; I341-L352 PolarHBondContact O-N 2.93Å; L352-F359 HydrophobicContact CD1-CB 3.99Å; L352-F359 HydrophobicContact CD1-CD1 4.33Å; L352-F359 HydrophobicContact CD1-CG 4.48Å; L352-F361 HydrophobicContact CB-CD2 4.48Å; L352-F361 HydrophobicContact CD1-CB 4.42Å; L352-F391 HydrophobicContact CD2-CD1 3.93Å; L352-F391 HydrophobicContact CD2-CE1 4.26Å; L352-F403 HydrophobicContact CD1-CD1 4.38Å; L352-F403 HydrophobicContact CD1-CD2 4.45Å; L352-F403 HydrophobicContact CD1-CE1 4.13Å; L352-F403 HydrophobicContact CD1-CE2 4.19Å; L352-F403 HydrophobicContact CD1-CZ 4.02Å; L352-F403 HydrophobicContact CD2-CD2 4.23Å; L352-F403 HydrophobicContact CD2-CG 4.2Å
353	Y	95.6	Very high	92.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	115.9	176	-60.5	-95	0	0	0	109.5	L245 P246 P329 A340 F351 M355 M360 I362	L245-Y353 HydrophobicContact CB-CD1 4.36Å; L245-Y353 HydrophobicContact CB-CE1 4Å; L245-Y353 HydrophobicContact CB-CE2 4.43Å; L245-Y353 HydrophobicContact CD1-CD2 4.3Å; L245-Y353 HydrophobicContact CD1-CE2 4.45Å; L245-Y353 HydrophobicContact CD2-CD1 4.21Å; L245-Y353 HydrophobicContact CD2-CG 4.25Å; P246-Y353 WeakPolarHBondContact O-CE1 3.42Å; P246-Y353 PolarHBondContact O-OH 3.19Å; P329-Y353 HydrophobicContact CG-CD1 4.4Å; A340-Y353 HydrophobicContact CB-CD1 4.11Å; A340-Y353 HydrophobicContact CB-CE1 3.58Å; F351-Y353 HydrophobicContact CB-CD2 4.35Å; F351-Y353 HydrophobicContact CB-CE2 3.59Å; Y353-M355 PolarHBondContact O-N 3.01Å; Y353-M360 PolarHBondContact N-O 2.82Å; Y353-M360 PolarHBondContact O-N 2.91Å; Y353-I362 HydrophobicContact CE2-CB 4.34Å; Y353-I362 HydrophobicContact CE2-CD1 4.15Å
354	P	94.8	Very high	92	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	112	167	-18.8	34.4	0	0	0	110.7	F332 I341 F359 L414 Y417	F332-P354 HydrophobicContact CB-CB 3.95Å; F332-P354 HydrophobicContact CB-CG 4.32Å; F332-P354 HydrophobicContact CD1-CB 4.14Å; F332-P354 HydrophobicContact CD1-CG 3.56Å; F332-P354 HydrophobicContact CD2-CB 4.28Å; F332-P354 HydrophobicContact CD2-CG 4.07Å; F332-P354 HydrophobicContact CE1-CG 3.87Å; F332-P354 HydrophobicContact CE2-CG 4.34Å; F332-P354 HydrophobicContact CG-CB 3.83Å; F332-P354 HydrophobicContact CG-CG 3.68Å; F332-P354 HydrophobicContact CZ-CG 4.25Å; I341-P354 HydrophobicContact CD1-CG 4.05Å; P354-F359 HydrophobicContact CB-CD1 4.35Å; P354-F359 HydrophobicContact CB-CE1 4.19Å; P354-L414 HydrophobicContact CG-CD1 4.22Å; P354-Y417 HydrophobicContact CB-CD1 3.76Å; P354-Y417 HydrophobicContact CB-CE1 3.41Å; P354-Y417 VanDerWaalsContact CB-CE1 3.41Å; P354-Y417 HydrophobicContact CB-CE2 4.43Å; P354-Y417 HydrophobicContact CB-CG 4.42Å
355	M	92.8	Very high	91.8	Very high	6 Å²	6	42.6 Å²	42.6	3%	0.03	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	151.6	-174.2	-52.1	-66	-68.3	0	0	110.7	F243 L245 R327 I328 P329 Y353 K357 G358 M360 F371 Y417	F243-M355 HydrophobicContact CD1-CE 4.2Å; L245-M355 HydrophobicContact CD2-CE 3.61Å; L245-M355 HydrophobicContact CD2-SD 3.59Å; L245-M355 VanDerWaalsContact CD2-SD 3.59Å; R327-M355 HydrophobicContact CB-CE 3.99Å; I328-M355 VanDerWaalsContact C-CE 3.43Å; I328-M355 WeakPolarHBondContact O-CE 3.5Å; P329-M355 HydrophobicContact CB-SD 4.38Å; Y353-M355 PolarHBondContact O-N 3.01Å; M355-K357 PolarHBondContact O-N 3.43Å; M355-G358 CarbonylContact C-O 3.51Å; M355-G358 WeakPolarHBondContact CA-O 3.23Å; M355-G358 VanDerWaalsContact CB-O 3.25Å; M355-G358 WeakPolarHBondContact CB-O 3.23Å; M355-G358 PolarHBondContact N-O 2.81Å; M355-G358 PolarHBondContact O-N 2.85Å; M355-M360 HydrophobicContact CG-CB 3.88Å; M355-M360 HydrophobicContact SD-CB 4.44Å; M355-F371 VanDerWaalsContact O-CE2 3.29Å; M355-F371 WeakPolarHBondContact O-CE2 3.44Å; M355-F371 WeakPolarHBondContact O-CZ 3.46Å; M355-Y417 VanDerWaalsContact C-OH 3.29Å; M355-Y417 PolarHBondContact O-OH 2.99Å
356	E	91.4	Very high	91.7	Very high	99 Å²	99	43 Å²	43	46%	0.463	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-19.7	-174.8	-169.7	51.8	-142.4	0	0	116.1	K421	E356-K421 IonicContact OE1-NZ 3.94Å; E356-K421 PolarHBondContact OE1-NZ 3.22Å; E356-K421 IonicContact OE2-NZ 2.88Å; E356-K421 PolarHBondContact OE2-NZ 3.4Å
357	K	89.5	Confident	91.8	Very high	150 Å²	150	37.1 Å²	37.1	65%	0.652	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-134.7	23.3	173.3	-66	-157.9	171	-158.2	0	114.4	M355 F371	M355-K357 PolarHBondContact O-N 3.43Å; K357-F371 VanDerWaalsContact C-CD2 3.45Å; K357-F371 PolarHBondContact O-N 2.69Å
358	G	92.8	Very high	92.1	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	174.4	-176.6	-179.5	0	0	0	0	0	115.2	M355 I369 F371	M355-G358 CarbonylContact C-O 3.51Å; M355-G358 WeakPolarHBondContact CA-O 3.23Å; M355-G358 VanDerWaalsContact CB-O 3.25Å; M355-G358 WeakPolarHBondContact CB-O 3.23Å; M355-G358 PolarHBondContact N-O 2.81Å; M355-G358 PolarHBondContact O-N 2.85Å; G358-I369 CarbonylContact C-O 3.53Å; G358-I369 WeakPolarHBondContact CA-O 3.05Å; G358-F371 VanDerWaalsContact CA-CD1 3.49Å; G358-F371 VanDerWaalsContact N-CZ 3.35Å; G358-F371 WeakPolarHBondContact O-CZ 3.41Å
359	F	94.2	Very high	92.1	Very high	1 Å²	1	32.6 Å²	32.6	0%	0.004	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	139.8	165.7	-64.2	-69.6	0	0	0	109.7	L352 P354 H368 I369 F371 F391 V393 L414 Y417 V418 L423	L352-F359 HydrophobicContact CD1-CB 3.99Å; L352-F359 HydrophobicContact CD1-CD1 4.33Å; L352-F359 HydrophobicContact CD1-CG 4.48Å; P354-F359 HydrophobicContact CB-CD1 4.35Å; P354-F359 HydrophobicContact CB-CE1 4.19Å; F359-H368 CarbonylContact O-C 3.53Å; F359-H368 WeakPolarHBondContact O-CA 3.36Å; F359-I369 PolarHBondContact N-O 3.37Å; F359-I369 PolarHBondContact O-N 3.07Å; F359-F371 HydrophobicContact CD2-CD1 4.42Å; F359-F371 AromaticContact CD2-CE1 3.92Å; F359-F371 HydrophobicContact CD2-CE1 3.92Å; F359-F371 HydrophobicContact CE1-CE1 4.35Å; F359-F371 HydrophobicContact CE2-CD1 4.25Å; F359-F371 AromaticContact CE2-CE1 3.71Å; F359-F371 HydrophobicContact CE2-CE1 3.71Å; F359-F371 HydrophobicContact CG-CE1 4.34Å; F359-F371 AromaticContact CZ-CE1 3.93Å; F359-F371 HydrophobicContact CZ-CE1 3.93Å; F359-F391 HydrophobicContact CE1-CE1 4.11Å; F359-F391 HydrophobicContact CE1-CZ 4.26Å; F359-F391 HydrophobicContact CE2-CE1 4.21Å; F359-F391 HydrophobicContact CE2-CZ 4.1Å; F359-F391 AromaticContact CZ-CE1 3.94Å; F359-F391 HydrophobicContact CZ-CE1 3.94Å; F359-F391 AromaticContact CZ-CZ 3.73Å; F359-F391 HydrophobicContact CZ-CZ 3.73Å; F359-V393 HydrophobicContact CD2-CG1 4.45Å; F359-V393 HydrophobicContact CD2-CG2 4.09Å; F359-V393 HydrophobicContact CE2-CG2 4.12Å; F359-L414 HydrophobicContact CE1-CD1 4.37Å; F359-Y417 HydrophobicContact CE1-CE1 4.42Å; F359-V418 HydrophobicContact CZ-CG2 4.26Å; F359-L423 HydrophobicContact CE2-CD1 3.8Å; F359-L423 HydrophobicContact CZ-CD1 3.9Å
360	M	94.4	Very high	92	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	122.6	175.8	-173.7	73.9	170.2	0	0	108.9	F243 L245 V256 F272 Y353 M355 I362 L367 H368	F243-M360 HydrophobicContact CD1-CE 4.24Å; F243-M360 HydrophobicContact CD1-SD 4.2Å; F243-M360 HydrophobicContact CD2-CE 3.79Å; F243-M360 HydrophobicContact CE1-CE 4.16Å; F243-M360 HydrophobicContact CE1-CG 4.48Å; F243-M360 HydrophobicContact CE1-SD 3.75Å; F243-M360 HydrophobicContact CE2-CE 3.71Å; F243-M360 HydrophobicContact CE2-SD 4.19Å; F243-M360 HydrophobicContact CG-CE 4.05Å; F243-M360 HydrophobicContact CZ-CE 3.88Å; F243-M360 HydrophobicContact CZ-SD 3.72Å; L245-M360 HydrophobicContact CD1-CG 3.92Å; V256-M360 HydrophobicContact CB-CE 4.01Å; V256-M360 HydrophobicContact CG1-CE 3.55Å; V256-M360 HydrophobicContact CG2-CE 4.31Å; F272-M360 HydrophobicContact CD1-CE 4.25Å; F272-M360 HydrophobicContact CE1-CE 4.28Å; Y353-M360 PolarHBondContact N-O 2.82Å; Y353-M360 PolarHBondContact O-N 2.91Å; M355-M360 HydrophobicContact CG-CB 3.88Å; M355-M360 HydrophobicContact SD-CB 4.44Å; M360-I362 HydrophobicContact CE-CD1 4.42Å; M360-I362 HydrophobicContact CG-CD1 4.39Å; M360-I362 HydrophobicContact CG-CG1 4.48Å; M360-L367 CarbonylContact C-O 3.5Å; M360-L367 WeakPolarHBondContact CA-O 3.37Å; M360-L367 VanDerWaalsContact SD-O 3.36Å; M360-H368 HydrophobicContact SD-CB 3.67Å
361	F	95.5	Very high	92	Very high	1 Å²	1	34.4 Å²	34.4	0%	0.004	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	136.1	175.7	173.8	-92.1	0	0	0	111.2	C343 Y345 F351 L352 P365 P366 L367 F403	C343-F361 VanDerWaalsContact SG-CE2 3.59Å; Y345-F361 HydrophobicContact CD1-CD1 4.42Å; Y345-F361 HydrophobicContact CD1-CE1 4.31Å; Y345-F361 HydrophobicContact CG-CD1 4.42Å; Y345-F361 HydrophobicContact CG-CE1 4.32Å; F351-F361 WeakPolarHBondContact O-CA 3.45Å; F351-F361 WeakPolarHBondContact O-CD2 3.37Å; L352-F361 HydrophobicContact CB-CD2 4.48Å; L352-F361 HydrophobicContact CD1-CB 4.42Å; F361-P365 WeakPolarHBondContact CD1-O 3.37Å; F361-P366 WeakPolarHBondContact O-CA 3.44Å; F361-L367 HydrophobicContact CB-CB 4.35Å; F361-L367 PolarHBondContact N-O 2.76Å; F361-L367 PolarHBondContact O-N 3.07Å; F361-F403 HydrophobicContact CB-CE1 3.61Å; F361-F403 HydrophobicContact CB-CZ 4.27Å; F361-F403 AromaticContact CD2-CD1 3.97Å; F361-F403 HydrophobicContact CD2-CD1 3.97Å; F361-F403 AromaticContact CD2-CE1 3.89Å; F361-F403 HydrophobicContact CD2-CE1 3.89Å; F361-F403 HydrophobicContact CG-CD1 4.3Å; F361-F403 AromaticContact CG-CE1 3.75Å; F361-F403 HydrophobicContact CG-CE1 3.75Å
362	I	92.9	Very high	91.8	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	136.3	-174.6	-73.1	175.2	0	0	0	108.7	L245 F254 V256 I274 G350 F351 Y353 M360	L245-I362 HydrophobicContact CD1-CD1 3.33Å; F254-I362 HydrophobicContact CB-CD1 4.44Å; F254-I362 HydrophobicContact CD2-CG2 4.3Å; F254-I362 HydrophobicContact CE2-CG2 4.35Å; F254-I362 HydrophobicContact CG-CG2 4.37Å; F254-I362 HydrophobicContact CZ-CG2 4.47Å; V256-I362 HydrophobicContact CG2-CD1 3.63Å; I274-I362 HydrophobicContact CD1-CG1 4.12Å; I274-I362 HydrophobicContact CD1-CG2 4.16Å; G350-I362 CarbonylContact C-O 3.59Å; G350-I362 WeakPolarHBondContact CA-O 3.37Å; F351-I362 PolarHBondContact N-O 2.92Å; F351-I362 PolarHBondContact O-N 2.84Å; Y353-I362 HydrophobicContact CE2-CB 4.34Å; Y353-I362 HydrophobicContact CE2-CD1 4.15Å; M360-I362 HydrophobicContact CE-CD1 4.42Å; M360-I362 HydrophobicContact CG-CD1 4.39Å; M360-I362 HydrophobicContact CG-CG1 4.48Å
363	H	76.5	Confident	91.6	Very high	53 Å²	53	41.1 Å²	41.1	25%	0.245	19%	0.193	C	C	.	.	S	Bend	cis	-124.9	-7.7	17.1	68.2	-56.5	0	0	0	114.7	T209 I274 P366	T209-H363 PolarHBondContact OG1-O 2.95Å; I274-H363 HydrophobicContact CD1-CB 4.35Å; H363-P366 VanDerWaalsContact O-CD 3.29Å; H363-P366 WeakPolarHBondContact O-CD 3.37Å; H363-P366 WeakPolarHBondContact O-CG 3.33Å
364	K	86.7	Confident	91.5	Very high	82 Å²	82	41.6 Å²	41.6	36%	0.357	20%	0.196	S	C	.	.	S	Bend	trans	-144.5	114	-169.4	-78.7	176.5	-175.3	141.6	0	114.2	A348	A348-K364 HydrophobicContact CB-CB 4.25Å; A348-K364 WeakPolarHBondContact CB-O 3.32Å
365	P	89.1	Confident	91.4	Very high	54 Å²	54	43.7 Å²	43.7	35%	0.351	21%	0.213	S	C	.	.	S	Bend	cis	-60.7	150.2	-26.5	29.9	-36.6	0	0	0	110.5	Y345 F361	Y345-P365 HydrophobicContact CD1-CG 4.07Å; Y345-P365 HydrophobicContact CE1-CG 3.84Å; F361-P365 WeakPolarHBondContact CD1-O 3.37Å
366	P	92.3	Very high	91.4	Very high	22 Å²	22	44.5 Å²	44.5	14%	0.143	22%	0.219	C	C	.	.			trans	-63.3	140.9	166	-17.9	31.9	0	0	0	110.7	T209 F272 I274 F361 H363	T209-P366 HydrophobicContact CG2-CG 4.15Å; F272-P366 HydrophobicContact CB-CB 3.86Å; F272-P366 HydrophobicContact CB-CG 4.12Å; F272-P366 HydrophobicContact CD2-CB 3.72Å; F272-P366 HydrophobicContact CG-CB 3.92Å; I274-P366 HydrophobicContact CD1-CB 3.93Å; I274-P366 HydrophobicContact CD1-CG 3.61Å; I274-P366 HydrophobicContact CG1-CG 4.39Å; F361-P366 WeakPolarHBondContact O-CA 3.44Å; H363-P366 VanDerWaalsContact O-CD 3.29Å; H363-P366 WeakPolarHBondContact O-CD 3.37Å; H363-P366 WeakPolarHBondContact O-CG 3.33Å
367	L	92.1	Very high	91.6	Very high	28 Å²	28	39.8 Å²	39.8	15%	0.147	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	145.1	176.4	-68	176.5	0	0	0	111.5	Y345 M360 F361 Y401	Y345-L367 HydrophobicContact CD1-CD1 3.87Å; Y345-L367 HydrophobicContact CD2-CD1 4.42Å; Y345-L367 HydrophobicContact CE1-CD1 3.4Å; Y345-L367 VanDerWaalsContact CE1-CD1 3.4Å; Y345-L367 HydrophobicContact CE1-CG 4.36Å; Y345-L367 HydrophobicContact CE2-CD1 4.03Å; Y345-L367 HydrophobicContact CG-CD1 4.37Å; M360-L367 CarbonylContact C-O 3.5Å; M360-L367 WeakPolarHBondContact CA-O 3.37Å; M360-L367 VanDerWaalsContact SD-O 3.36Å; F361-L367 HydrophobicContact CB-CB 4.35Å; F361-L367 PolarHBondContact N-O 2.76Å; F361-L367 PolarHBondContact O-N 3.07Å; L367-Y401 HydrophobicContact CD1-CD1 3.54Å; L367-Y401 HydrophobicContact CD1-CE1 3.8Å; L367-Y401 HydrophobicContact CD2-CE1 3.97Å
368	H	93.2	Very high	91.7	Very high	47 Å²	47	34.1 Å²	34.1	22%	0.218	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	106.5	172	175	-103.1	0	0	0	109.3	F243 F272 R327 F359 M360 R370	F243-H368 AromaticContact CE1-CD2 3.38Å; F243-H368 WeakPolarHBondContact CE1-CD2 3.2Å; F243-H368 AromaticContact CE1-NE2 3.64Å; F243-H368 HydrophobicContact CZ-CB 4.37Å; F243-H368 AromaticContact CZ-CD2 3.34Å; F243-H368 WeakPolarHBondContact CZ-CD2 3.37Å; F243-H368 AromaticContact CZ-CG 3.81Å; F243-H368 AromaticContact CZ-NE2 3.69Å; F272-H368 HydrophobicContact CE1-CB 4.08Å; F272-H368 HydrophobicContact CZ-CB 3.73Å; R327-H368 PolarHBondContact NH1-CE1 3.41Å; R327-H368 VanDerWaalsContact NH1-CE1 3.26Å; R327-H368 PolarHBondContact NH1-NE2 3.18Å; R327-H368 VanDerWaalsContact NH1-NE2 3.15Å; F359-H368 CarbonylContact O-C 3.53Å; F359-H368 WeakPolarHBondContact O-CA 3.36Å; M360-H368 HydrophobicContact SD-CB 3.67Å; H368-R370 VanDerWaalsContact CE1-CG 3.49Å; H368-R370 WeakPolarHBondContact CE1-CG 3.37Å
369	I	92.8	Very high	91.6	Very high	8 Å²	8	35.2 Å²	35.2	4%	0.041	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	117.2	-179.3	-56.7	163.5	0	0	0	107.5	G358 F359 V374 V393 V395 Y401 F403	G358-I369 CarbonylContact C-O 3.53Å; G358-I369 WeakPolarHBondContact CA-O 3.05Å; F359-I369 PolarHBondContact N-O 3.37Å; F359-I369 PolarHBondContact O-N 3.07Å; I369-V374 HydrophobicContact CG2-CG2 3.82Å; I369-V393 HydrophobicContact CD1-CB 4.38Å; I369-V393 HydrophobicContact CD1-CG1 4.34Å; I369-V393 HydrophobicContact CG2-CG1 4.06Å; I369-V395 HydrophobicContact CG2-CG1 3.73Å; I369-Y401 HydrophobicContact CD1-CD1 4.11Å; I369-Y401 HydrophobicContact CD1-CD2 3.71Å; I369-Y401 HydrophobicContact CD1-CE2 4.29Å; I369-Y401 HydrophobicContact CD1-CG 3.61Å; I369-Y401 HydrophobicContact CG1-CD2 4.27Å; I369-Y401 HydrophobicContact CG1-CE2 4.36Å; I369-Y401 HydrophobicContact CG1-CG 4.45Å; I369-F403 HydrophobicContact CD1-CE2 4.28Å; I369-F403 HydrophobicContact CD1-CZ 4.15Å
370	R	91.7	Very high	91.1	Very high	104 Å²	104	37.3 Å²	37.3	39%	0.392	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	143.6	179.2	-54.5	172.7	-61.7	164.8	-5.2	109.5	H368 E372 D373 V374	H368-R370 VanDerWaalsContact CE1-CG 3.49Å; H368-R370 WeakPolarHBondContact CE1-CG 3.37Å; R370-E372 HydrophobicContact CB-CG 3.82Å; R370-E372 WeakPolarHBondContact CD-OE1 3.22Å; R370-E372 IonicContact CZ-OE1 3.53Å; R370-E372 IonicContact NE-OE1 2.77Å; R370-E372 PolarHBondContact NE-OE1 2.85Å; R370-E372 IonicContact NH1-OE1 3.94Å; R370-E372 PolarHBondContact NH1-OE1 2.84Å; R370-E372 PolarHBondContact O-N 3.24Å; R370-E372 VanDerWaalsContact O-N 3.15Å; R370-D373 WeakPolarHBondContact CB-OD2 3.37Å; R370-D373 IonicContact CZ-OD1 2.7Å; R370-D373 IonicContact CZ-OD2 2.7Å; R370-D373 IonicContact NE-OD1 3.97Å; R370-D373 IonicContact NE-OD2 2.7Å; R370-D373 PolarHBondContact NE-OD2 3.11Å; R370-D373 VanDerWaalsContact NH2-CG 3.32Å; R370-D373 IonicContact NH2-OD1 3.6Å; R370-D373 PolarHBondContact NH2-OD1 2.99Å; R370-D373 IonicContact NH2-OD2 3.3Å; R370-D373 PolarHBondContact NH2-OD2 3.08Å; R370-D373 VanDerWaalsContact NH2-OD2 3.12Å; R370-D373 WeakPolarHBondContact O-CB 3.26Å; R370-D373 PolarHBondContact O-N 3.49Å; R370-V374 PolarHBondContact O-N 2.65Å
371	F	92.5	Very high	90	Very high	34 Å²	34	46.4 Å²	46.4	15%	0.149	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-26.5	177.2	-62.9	-27.9	0	0	0	113	M355 K357 G358 F359 D373 V374 Y417 K421 L423	M355-F371 VanDerWaalsContact O-CE2 3.29Å; M355-F371 WeakPolarHBondContact O-CE2 3.44Å; M355-F371 WeakPolarHBondContact O-CZ 3.46Å; K357-F371 VanDerWaalsContact C-CD2 3.45Å; K357-F371 PolarHBondContact O-N 2.69Å; G358-F371 VanDerWaalsContact CA-CD1 3.49Å; G358-F371 VanDerWaalsContact N-CZ 3.35Å; G358-F371 WeakPolarHBondContact O-CZ 3.41Å; F359-F371 HydrophobicContact CD2-CD1 4.42Å; F359-F371 AromaticContact CD2-CE1 3.92Å; F359-F371 HydrophobicContact CD2-CE1 3.92Å; F359-F371 HydrophobicContact CE1-CE1 4.35Å; F359-F371 HydrophobicContact CE2-CD1 4.25Å; F359-F371 AromaticContact CE2-CE1 3.71Å; F359-F371 HydrophobicContact CE2-CE1 3.71Å; F359-F371 HydrophobicContact CG-CE1 4.34Å; F359-F371 AromaticContact CZ-CE1 3.93Å; F359-F371 HydrophobicContact CZ-CE1 3.93Å; F371-D373 VanDerWaalsContact C-N 3.26Å; F371-D373 PolarHBondContact O-N 3.23Å; F371-V374 PolarHBondContact O-N 2.81Å; F371-Y417 HydrophobicContact CZ-CE1 4.03Å; F371-K421 HydrophobicContact CD2-CB 4.48Å; F371-K421 HydrophobicContact CE2-CB 4.08Å; F371-K421 HydrophobicContact CE2-CD 4.35Å; F371-K421 HydrophobicContact CE2-CG 3.84Å; F371-K421 HydrophobicContact CZ-CB 4.49Å; F371-K421 HydrophobicContact CZ-CG 4.21Å; F371-L423 HydrophobicContact CB-CD2 4.07Å; F371-L423 HydrophobicContact CD1-CD1 3.96Å; F371-L423 HydrophobicContact CD1-CD2 4.05Å; F371-L423 HydrophobicContact CE1-CD1 3.99Å; F371-L423 HydrophobicContact CG-CD2 4.1Å
372	E	92	Very high	88.4	Confident	123 Å²	123	47.7 Å²	47.7	58%	0.575	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-22.7	173.9	67	-159.5	168.8	0	0	113.7	R370 K396	R370-E372 HydrophobicContact CB-CG 3.82Å; R370-E372 WeakPolarHBondContact CD-OE1 3.22Å; R370-E372 IonicContact CZ-OE1 3.53Å; R370-E372 IonicContact NE-OE1 2.77Å; R370-E372 PolarHBondContact NE-OE1 2.85Å; R370-E372 IonicContact NH1-OE1 3.94Å; R370-E372 PolarHBondContact NH1-OE1 2.84Å; R370-E372 PolarHBondContact O-N 3.24Å; R370-E372 VanDerWaalsContact O-N 3.15Å; E372-K396 PolarHBondContact O-NZ 3.05Å
373	D	91	Very high	86.6	Confident	51 Å²	51	53.4 Å²	53.4	27%	0.273	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-19	175.4	-58.2	-44.9	0	0	0	112.9	R370 F371 V395 K396	R370-D373 WeakPolarHBondContact CB-OD2 3.37Å; R370-D373 IonicContact CZ-OD1 2.7Å; R370-D373 IonicContact CZ-OD2 2.7Å; R370-D373 IonicContact NE-OD1 3.97Å; R370-D373 IonicContact NE-OD2 2.7Å; R370-D373 PolarHBondContact NE-OD2 3.11Å; R370-D373 VanDerWaalsContact NH2-CG 3.32Å; R370-D373 IonicContact NH2-OD1 3.6Å; R370-D373 PolarHBondContact NH2-OD1 2.99Å; R370-D373 IonicContact NH2-OD2 3.3Å; R370-D373 PolarHBondContact NH2-OD2 3.08Å; R370-D373 VanDerWaalsContact NH2-OD2 3.12Å; R370-D373 WeakPolarHBondContact O-CB 3.26Å; R370-D373 PolarHBondContact O-N 3.49Å; F371-D373 VanDerWaalsContact C-N 3.26Å; F371-D373 PolarHBondContact O-N 3.23Å; D373-V395 HydrophobicContact CB-CG1 4.28Å; D373-V395 CarbonylContact O-C 3.5Å; D373-V395 VanDerWaalsContact O-CA 3.23Å; D373-V395 WeakPolarHBondContact O-CA 3.1Å; D373-V395 VanDerWaalsContact O-CB 3.31Å; D373-V395 WeakPolarHBondContact O-CB 3.2Å; D373-K396 WeakPolarHBondContact O-CG 3.27Å; D373-K396 PolarHBondContact O-N 2.8Å
374	V	92.8	Very high	85.8	Confident	10 Å²	10	57.7 Å²	57.7	6%	0.061	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	132.5	-177.5	178.7	0	0	0	0	110.6	I369 R370 F371 V377 V393 K396 L423	I369-V374 HydrophobicContact CG2-CG2 3.82Å; R370-V374 PolarHBondContact O-N 2.65Å; F371-V374 PolarHBondContact O-N 2.81Å; V374-V377 HydrophobicContact CG1-CG1 4.1Å; V374-V393 HydrophobicContact CG1-CG1 4.12Å; V374-V393 HydrophobicContact CG2-CG1 3.71Å; V374-K396 VanDerWaalsContact O-CE 3.23Å; V374-K396 WeakPolarHBondContact O-CE 3.41Å; V374-L423 HydrophobicContact CB-CD2 4.43Å; V374-L423 HydrophobicContact CG1-CD2 4.38Å
375	A	93.2	Very high	84.4	Confident	44 Å²	44	61.3 Å²	61.3	36%	0.364	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	-45	170.5	0	0	0	0	0	111.1	T394 K396	A375-T394 PolarHBondContact N-O 3.31Å; A375-K396 HydrophobicContact CB-CG 3.92Å
376	S	93.2	Very high	83.2	Confident	23 Å²	23	62.4 Å²	62.4	16%	0.161	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	166.7	176.5	57.8	0	0	0	0	112.1	T394 H424	S376-T394 PolarHBondContact N-O 2.95Å; S376-T394 PolarHBondContact O-N 3.39Å; S376-H424 CarbonylContact C-O 3.57Å; S376-H424 WeakPolarHBondContact CA-O 3.41Å; S376-H424 WeakPolarHBondContact CB-O 3.49Å
377	V	94.8	Very high	82.6	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	152.6	165.9	-54.8	0	0	0	0	111	V374 F379 F391 E392 V393 V418 L423 H424 I425 V426	V374-V377 HydrophobicContact CG1-CG1 4.1Å; V377-F379 HydrophobicContact CG2-CE2 4.1Å; V377-F391 HydrophobicContact CB-CE2 3.85Å; V377-F391 HydrophobicContact CB-CZ 4.18Å; V377-F391 HydrophobicContact CG1-CE2 4.26Å; V377-F391 HydrophobicContact CG1-CZ 4.07Å; V377-F391 HydrophobicContact CG2-CE2 4.12Å; V377-E392 CarbonylContact C-O 3.45Å; V377-E392 WeakPolarHBondContact CA-O 3.1Å; V377-V393 HydrophobicContact CG1-CB 4.42Å; V377-V393 HydrophobicContact CG1-CG1 4.22Å; V377-V393 HydrophobicContact CG1-CG2 4.06Å; V377-V418 HydrophobicContact CG2-CG1 3.52Å; V377-L423 HydrophobicContact CG1-CD1 4.41Å; V377-H424 PolarHBondContact N-O 3.34Å; V377-I425 HydrophobicContact CG2-CG1 4.06Å; V377-I425 WeakPolarHBondContact O-CA 3.35Å; V377-V426 PolarHBondContact O-N 3.43Å
378	H	91.9	Very high	82.4	Confident	31 Å²	31	71.3 Å²	71.3	14%	0.144	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	144.5	178.5	179.6	57.9	0	0	0	110.1	E392 V426	H378-E392 HydrophobicContact CB-CB 4.32Å; H378-E392 PolarHBondContact N-O 2.71Å; H378-E392 PolarHBondContact O-N 3.18Å; H378-V426 PolarHBondContact ND1-O 2.82Å
379	F	91	Very high	82.3	Confident	23 Å²	23	69.3 Å²	69.3	10%	0.101	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	96.4	177.5	-69.8	-100.5	0	0	0	107.8	V377 F389 F391 L414 Y415 V418 I425	V377-F379 HydrophobicContact CG2-CE2 4.1Å; F379-F389 HydrophobicContact CD1-CD2 4.12Å; F379-F389 AromaticContact CD1-CE2 3.64Å; F379-F389 HydrophobicContact CD1-CE2 3.64Å; F379-F389 HydrophobicContact CE1-CE2 4.09Å; F379-F391 HydrophobicContact CD1-CD2 4Å; F379-F391 HydrophobicContact CD2-CD2 4.42Å; F379-F391 HydrophobicContact CD2-CE2 4.49Å; F379-F391 AromaticContact CE1-CD2 3.77Å; F379-F391 HydrophobicContact CE1-CD2 3.77Å; F379-F391 HydrophobicContact CE1-CE2 4.01Å; F379-F391 HydrophobicContact CE2-CD2 4.2Å; F379-F391 AromaticContact CE2-CE2 3.89Å; F379-F391 HydrophobicContact CE2-CE2 3.89Å; F379-F391 HydrophobicContact CG-CD2 4.33Å; F379-F391 AromaticContact CZ-CD2 3.87Å; F379-F391 HydrophobicContact CZ-CD2 3.87Å; F379-F391 AromaticContact CZ-CE2 3.63Å; F379-F391 HydrophobicContact CZ-CE2 3.63Å; F379-L414 HydrophobicContact CE1-CB 4.3Å; F379-L414 HydrophobicContact CE1-CD2 4.04Å; F379-L414 HydrophobicContact CE1-CG 3.94Å; F379-L414 HydrophobicContact CZ-CG 4.21Å; F379-Y415 HydrophobicContact CD2-CD2 4.13Å; F379-Y415 AromaticContact CE2-CD2 3.88Å; F379-Y415 HydrophobicContact CE2-CD2 3.88Å; F379-Y415 HydrophobicContact CZ-CD2 4.1Å; F379-V418 HydrophobicContact CE2-CG1 4.27Å; F379-V418 HydrophobicContact CE2-CG2 4.5Å; F379-V418 HydrophobicContact CZ-CB 4.32Å; F379-V418 HydrophobicContact CZ-CG2 4.02Å; F379-I425 HydrophobicContact CD2-CG2 4.09Å; F379-I425 HydrophobicContact CE2-CD1 4.28Å; F379-I425 HydrophobicContact CE2-CG2 4.31Å
380	D	83.8	Confident	82.2	Confident	45 Å²	45	70.6 Å²	70.6	24%	0.241	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	133.9	178.3	-170	15.1	0	0	0	110.3	F389 D390 K430	D380-F389 WeakPolarHBondContact O-CB 3.36Å; D380-D390 HydrophobicContact CB-CB 4.48Å; D380-D390 PolarHBondContact N-O 2.93Å; D380-D390 PolarHBondContact O-N 2.64Å; D380-K430 VanDerWaalsContact OD1-CE 3.23Å; D380-K430 WeakPolarHBondContact OD1-CE 3.47Å; D380-K430 IonicContact OD1-NZ 2.74Å; D380-K430 PolarHBondContact OD1-NZ 2.9Å; D380-K430 WeakPolarHBondContact OD2-CE 3.35Å; D380-K430 IonicContact OD2-NZ 2.72Å; D380-K430 PolarHBondContact OD2-NZ 3.46Å
381	R	71.6	Confident	82.4	Confident	190 Å²	190	65.7 Å²	65.7	72%	0.717	33%	0.332	S	S	*	.			trans	-94.2	113.3	175.2	-67.6	-179.3	178.5	175.7	0.1	107.9	D383	R381-D383 PolarHBondContact O-N 3.03Å
382	S	62.1	Low	82.5	Confident	29 Å²	29	66.4 Å²	66.4	20%	0.203	34%	0.336	C	S	.	.			trans	-63.3	128.6	171.5	47.4	0	0	0	0	110	V384 T386 S388	S382-V384 PolarHBondContact O-N 3.29Å; S382-V384 VanDerWaalsContact O-N 3.17Å; S382-T386 WeakPolarHBondContact CB-OG1 3.47Å; S382-T386 PolarHBondContact OG-OG1 3.3Å; S382-S388 PolarHBondContact OG-O 3.21Å; S382-S388 PolarHBondContact OG-OG 3.47Å
383	D	54.9	Low	82.6	Confident	120 Å²	120	60.6 Å²	60.6	64%	0.642	31%	0.309	S	S	*	.			trans	-63.2	115.5	-162.7	-66.6	-75.3	0	0	0	114.3	R381 I385 K430	R381-D383 PolarHBondContact O-N 3.03Å; D383-I385 PolarHBondContact O-N 3.45Å; D383-K430 IonicContact OD2-NZ 3.88Å
384	V	58.5	Low	82.8	Confident	144 Å²	144	60 Å²	60	87%	0.873	31%	0.307	S	S	*	.	S	Bend	trans	59.2	-41.8	158.7	-171.9	0	0	0	0	118.6	S382	S382-V384 PolarHBondContact O-N 3.29Å; S382-V384 VanDerWaalsContact O-N 3.17Å
385	I	59.2	Low	82.7	Confident	158 Å²	158	60 Å²	60	81%	0.81	31%	0.308	S	S	*	.	S	Bend	trans	-94.2	-29	-167.2	-60.9	175.6	0	0	0	112.8	D383	D383-I385 PolarHBondContact O-N 3.45Å
386	T	61.8	Low	82.6	Confident	77 Å²	77	64.9 Å²	64.9	47%	0.472	32%	0.321	S	S	.	.	S	Bend	trans	-97.6	137	-174.4	45.2	0	0	0	0	111.8	S382 S388	S382-T386 WeakPolarHBondContact CB-OG1 3.47Å; S382-T386 PolarHBondContact OG-OG1 3.3Å; T386-S388 WeakPolarHBondContact CB-OG 3.44Å; T386-S388 PolarHBondContact O-N 2.9Å
387	R	81.2	Confident	82.3	Confident	209 Å²	209	68 Å²	68	79%	0.789	34%	0.343	S	S	*	.	S	Bend	trans	-78.5	36.4	177.5	-63.3	-171	-179.3	-170	1.3	112.8	K408	R387-K408 WeakPolarHBondContact O-CB 3.44Å; R387-K408 PolarHBondContact O-N 3.48Å
388	S	88.1	Confident	81.9	Confident	28 Å²	28	71.4 Å²	71.4	20%	0.196	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	171.7	-172.3	53.9	0	0	0	0	112.7	S382 T386 I406	S382-S388 PolarHBondContact OG-O 3.21Å; S382-S388 PolarHBondContact OG-OG 3.47Å; T386-S388 WeakPolarHBondContact CB-OG 3.44Å; T386-S388 PolarHBondContact O-N 2.9Å; S388-I406 CarbonylContact C-O 3.6Å; S388-I406 WeakPolarHBondContact CA-O 3.41Å; S388-I406 VanDerWaalsContact CB-O 3.27Å; S388-I406 WeakPolarHBondContact CB-O 3.42Å
389	F	90.1	Very high	81.7	Confident	4 Å²	4	74.8 Å²	74.8	2%	0.018	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	164.9	164.6	75.3	-82	0	0	0	109.6	F379 D380 F391 I406 E407 N411 L414	F379-F389 HydrophobicContact CD1-CD2 4.12Å; F379-F389 AromaticContact CD1-CE2 3.64Å; F379-F389 HydrophobicContact CD1-CE2 3.64Å; F379-F389 HydrophobicContact CE1-CE2 4.09Å; D380-F389 WeakPolarHBondContact O-CB 3.36Å; F389-F391 HydrophobicContact CE2-CB 4.08Å; F389-I406 HydrophobicContact CD1-CB 4.05Å; F389-I406 HydrophobicContact CD1-CG2 4.14Å; F389-I406 WeakPolarHBondContact CD1-O 3.45Å; F389-I406 HydrophobicContact CE1-CB 3.7Å; F389-I406 HydrophobicContact CE1-CG2 3.34Å; F389-I406 HydrophobicContact CE2-CB 4.42Å; F389-I406 HydrophobicContact CE2-CD1 4.04Å; F389-I406 HydrophobicContact CE2-CG2 4.49Å; F389-I406 HydrophobicContact CZ-CB 3.9Å; F389-I406 HydrophobicContact CZ-CD1 4.06Å; F389-I406 HydrophobicContact CZ-CG2 3.56Å; F389-I406 PolarHBondContact N-O 3.15Å; F389-I406 PolarHBondContact O-N 3.32Å; F389-E407 WeakPolarHBondContact CE1-O 3.26Å; F389-N411 HydrophobicContact CD1-CB 3.74Å; F389-N411 WeakPolarHBondContact CD1-ND2 3.49Å; F389-N411 WeakPolarHBondContact CD2-ND2 3.3Å; F389-N411 VanDerWaalsContact CE1-CA 3.42Å; F389-N411 HydrophobicContact CE1-CB 3.45Å; F389-N411 VanDerWaalsContact CE1-CB 3.45Å; F389-N411 VanDerWaalsContact CE2-ND2 3.31Å; F389-N411 WeakPolarHBondContact CE2-ND2 3.21Å; F389-N411 HydrophobicContact CG-CB 4.41Å; F389-N411 VanDerWaalsContact CG-ND2 3.3Å; F389-N411 WeakPolarHBondContact CG-ND2 3.34Å; F389-N411 HydrophobicContact CZ-CB 3.92Å; F389-N411 WeakPolarHBondContact CZ-ND2 3.37Å; F389-L414 HydrophobicContact CE2-CD2 4.27Å; F389-L414 HydrophobicContact CZ-CD2 4.08Å
390	D	92	Very high	81.8	Confident	36 Å²	36	76.3 Å²	76.3	19%	0.193	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	137.2	176.9	-68.2	-4.3	0	0	0	109.3	D380 T402 F403 T404 S405	D380-D390 HydrophobicContact CB-CB 4.48Å; D380-D390 PolarHBondContact N-O 2.93Å; D380-D390 PolarHBondContact O-N 2.64Å; D390-T402 HydrophobicContact CB-CG2 4.36Å; D390-F403 CarbonylContact C-O 3.43Å; D390-F403 WeakPolarHBondContact CA-O 3.4Å; D390-T404 HydrophobicContact CB-CG2 4.33Å; D390-T404 WeakPolarHBondContact OD1-CA 3.41Å; D390-T404 VanDerWaalsContact OD1-CB 3.24Å; D390-T404 WeakPolarHBondContact OD1-CB 3.38Å; D390-T404 WeakPolarHBondContact OD2-CG2 3.2Å; D390-S405 PolarHBondContact OD1-N 2.69Å
391	F	94.2	Very high	82.2	Confident	0 Å²	0	76 Å²	76	0%	0	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	114.3	-178.4	177.6	-119.7	0	0	0	109.6	L352 F359 V377 F379 F389 V393 F403 I406 L414 V418	L352-F391 HydrophobicContact CD2-CD1 3.93Å; L352-F391 HydrophobicContact CD2-CE1 4.26Å; F359-F391 HydrophobicContact CE1-CE1 4.11Å; F359-F391 HydrophobicContact CE1-CZ 4.26Å; F359-F391 HydrophobicContact CE2-CE1 4.21Å; F359-F391 HydrophobicContact CE2-CZ 4.1Å; F359-F391 AromaticContact CZ-CE1 3.94Å; F359-F391 HydrophobicContact CZ-CE1 3.94Å; F359-F391 AromaticContact CZ-CZ 3.73Å; F359-F391 HydrophobicContact CZ-CZ 3.73Å; V377-F391 HydrophobicContact CB-CE2 3.85Å; V377-F391 HydrophobicContact CB-CZ 4.18Å; V377-F391 HydrophobicContact CG1-CE2 4.26Å; V377-F391 HydrophobicContact CG1-CZ 4.07Å; V377-F391 HydrophobicContact CG2-CE2 4.12Å; F379-F391 HydrophobicContact CD1-CD2 4Å; F379-F391 HydrophobicContact CD2-CD2 4.42Å; F379-F391 HydrophobicContact CD2-CE2 4.49Å; F379-F391 AromaticContact CE1-CD2 3.77Å; F379-F391 HydrophobicContact CE1-CD2 3.77Å; F379-F391 HydrophobicContact CE1-CE2 4.01Å; F379-F391 HydrophobicContact CE2-CD2 4.2Å; F379-F391 AromaticContact CE2-CE2 3.89Å; F379-F391 HydrophobicContact CE2-CE2 3.89Å; F379-F391 HydrophobicContact CG-CD2 4.33Å; F379-F391 AromaticContact CZ-CD2 3.87Å; F379-F391 HydrophobicContact CZ-CD2 3.87Å; F379-F391 AromaticContact CZ-CE2 3.63Å; F379-F391 HydrophobicContact CZ-CE2 3.63Å; F389-F391 HydrophobicContact CE2-CB 4.08Å; F391-V393 HydrophobicContact CD1-CG2 4.05Å; F391-V393 HydrophobicContact CE1-CG2 3.43Å; F391-V393 VanDerWaalsContact CE1-CG2 3.43Å; F391-V393 HydrophobicContact CZ-CG2 3.75Å; F391-F403 AromaticContact CD1-CD2 3.99Å; F391-F403 HydrophobicContact CD1-CD2 3.99Å; F391-F403 PolarHBondContact N-O 2.94Å; F391-F403 PolarHBondContact O-N 2.75Å; F391-I406 HydrophobicContact CB-CD1 3.5Å; F391-L414 HydrophobicContact CB-CD2 4.29Å; F391-L414 HydrophobicContact CD1-CD2 3.96Å; F391-L414 HydrophobicContact CD2-CD2 3.98Å; F391-L414 HydrophobicContact CE1-CD2 4.24Å; F391-L414 HydrophobicContact CE2-CD2 4.26Å; F391-L414 HydrophobicContact CG-CD2 3.82Å; F391-L414 HydrophobicContact CZ-CD2 4.38Å; F391-V418 HydrophobicContact CE2-CG2 4.2Å; F391-V418 HydrophobicContact CZ-CG2 4.1Å
392	E	94.9	Very high	83.3	Confident	50 Å²	50	69.5 Å²	69.5	23%	0.234	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	131.9	179.5	-175.7	170.4	-143.6	0	0	111.3	V377 H378 S400 Y401 T402	V377-E392 CarbonylContact C-O 3.45Å; V377-E392 WeakPolarHBondContact CA-O 3.1Å; H378-E392 HydrophobicContact CB-CB 4.32Å; H378-E392 PolarHBondContact N-O 2.71Å; H378-E392 PolarHBondContact O-N 3.18Å; E392-S400 WeakPolarHBondContact OE1-CB 3.21Å; E392-S400 PolarHBondContact OE1-OG 3.4Å; E392-Y401 WeakPolarHBondContact CA-O 3.36Å; E392-T402 HydrophobicContact CB-CG2 4.3Å
393	V	94.8	Very high	84.9	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	113	174.3	-177.3	0	0	0	0	109.2	F359 I369 V374 V377 F391 S400 Y401 F403	F359-V393 HydrophobicContact CD2-CG1 4.45Å; F359-V393 HydrophobicContact CD2-CG2 4.09Å; F359-V393 HydrophobicContact CE2-CG2 4.12Å; I369-V393 HydrophobicContact CD1-CB 4.38Å; I369-V393 HydrophobicContact CD1-CG1 4.34Å; I369-V393 HydrophobicContact CG2-CG1 4.06Å; V374-V393 HydrophobicContact CG1-CG1 4.12Å; V374-V393 HydrophobicContact CG2-CG1 3.71Å; V377-V393 HydrophobicContact CG1-CB 4.42Å; V377-V393 HydrophobicContact CG1-CG1 4.22Å; V377-V393 HydrophobicContact CG1-CG2 4.06Å; F391-V393 HydrophobicContact CD1-CG2 4.05Å; F391-V393 HydrophobicContact CE1-CG2 3.43Å; F391-V393 VanDerWaalsContact CE1-CG2 3.43Å; F391-V393 HydrophobicContact CZ-CG2 3.75Å; V393-S400 CarbonylContact O-C 3.6Å; V393-S400 WeakPolarHBondContact O-CA 3.44Å; V393-Y401 PolarHBondContact N-O 2.91Å; V393-Y401 PolarHBondContact O-N 3.08Å; V393-F403 HydrophobicContact CG2-CE2 4.18Å
394	T	94.3	Very high	86.7	Confident	39 Å²	39	64.2 Å²	64.2	24%	0.239	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	126.5	177.7	-63.8	0	0	0	0	109.7	A375 S376	A375-T394 PolarHBondContact N-O 3.31Å; S376-T394 PolarHBondContact N-O 2.95Å; S376-T394 PolarHBondContact O-N 3.39Å
395	V	92.1	Very high	88.2	Confident	11 Å²	11	60.9 Å²	60.9	7%	0.067	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	157.5	178.7	-65.9	0	0	0	0	112	I369 D373 S397 G398 M399 Y401	I369-V395 HydrophobicContact CG2-CG1 3.73Å; D373-V395 HydrophobicContact CB-CG1 4.28Å; D373-V395 CarbonylContact O-C 3.5Å; D373-V395 VanDerWaalsContact O-CA 3.23Å; D373-V395 WeakPolarHBondContact O-CA 3.1Å; D373-V395 VanDerWaalsContact O-CB 3.31Å; D373-V395 WeakPolarHBondContact O-CB 3.2Å; V395-S397 WeakPolarHBondContact CG2-OG 3.43Å; V395-S397 PolarHBondContact O-N 3.25Å; V395-G398 PolarHBondContact O-N 3.49Å; V395-M399 HydrophobicContact CG2-CB 3.77Å; V395-M399 WeakPolarHBondContact CG2-O 3.39Å; V395-M399 PolarHBondContact N-O 2.87Å; V395-Y401 HydrophobicContact CG1-CD2 4.34Å; V395-Y401 HydrophobicContact CG1-CE2 4.08Å; V395-Y401 HydrophobicContact CG2-CE2 3.88Å
396	K	90.3	Very high	89.7	Confident	146 Å²	146	53.4 Å²	53.4	64%	0.635	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-15.3	-175.9	-68.8	168.2	-178.8	166.6	0	114.8	E372 D373 V374 A375 G398	E372-K396 PolarHBondContact O-NZ 3.05Å; D373-K396 WeakPolarHBondContact O-CG 3.27Å; D373-K396 PolarHBondContact O-N 2.8Å; V374-K396 VanDerWaalsContact O-CE 3.23Å; V374-K396 WeakPolarHBondContact O-CE 3.41Å; A375-K396 HydrophobicContact CB-CG 3.92Å; K396-G398 VanDerWaalsContact C-N 3.27Å
397	S	87.4	Confident	91.1	Very high	89 Å²	89	54.4 Å²	54.4	62%	0.622	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	0.3	171.6	60.2	0	0	0	0	114.3	V395 M399	V395-S397 WeakPolarHBondContact CG2-OG 3.43Å; V395-S397 PolarHBondContact O-N 3.25Å; S397-M399 VanDerWaalsContact C-N 3.32Å
398	G	85.2	Confident	91.4	Very high	70 Å²	70	51 Å²	51	72%	0.722	29%	0.291	S	S	*	.	S	Bend	trans	81.9	5.4	-178	0	0	0	0	0	114.7	V395 K396	V395-G398 PolarHBondContact O-N 3.49Å; K396-G398 VanDerWaalsContact C-N 3.27Å
399	M	88.5	Confident	91.5	Very high	103 Å²	103	54.1 Å²	54.1	51%	0.507	30%	0.302	S	S	.	.			trans	-83.5	146.8	169.5	-59.2	172.8	66.6	0	0	110.2	V395 S397 Y401	V395-M399 HydrophobicContact CG2-CB 3.77Å; V395-M399 WeakPolarHBondContact CG2-O 3.39Å; V395-M399 PolarHBondContact N-O 2.87Å; S397-M399 VanDerWaalsContact C-N 3.32Å; M399-Y401 HydrophobicContact CB-CE2 4.34Å; M399-Y401 WeakPolarHBondContact CE-OH 3.24Å
400	S	91.9	Very high	91.5	Very high	55 Å²	55	54 Å²	54	39%	0.385	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	157	168.9	74.4	0	0	0	0	112.6	E392 V393	E392-S400 WeakPolarHBondContact OE1-CB 3.21Å; E392-S400 PolarHBondContact OE1-OG 3.4Å; V393-S400 CarbonylContact O-C 3.6Å; V393-S400 WeakPolarHBondContact O-CA 3.44Å
401	Y	93.7	Very high	91.4	Very high	37 Å²	37	54 Å²	54	15%	0.145	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	93	-175.3	-64.8	-90.1	0	0	0	109.7	Y345 L367 I369 E392 V393 V395 M399	Y345-Y401 HydrophobicContact CE2-CD1 4.1Å; Y345-Y401 AromaticContact CZ-CD1 3.92Å; Y345-Y401 WeakPolarHBondContact OH-CD1 3.22Å; L367-Y401 HydrophobicContact CD1-CD1 3.54Å; L367-Y401 HydrophobicContact CD1-CE1 3.8Å; L367-Y401 HydrophobicContact CD2-CE1 3.97Å; I369-Y401 HydrophobicContact CD1-CD1 4.11Å; I369-Y401 HydrophobicContact CD1-CD2 3.71Å; I369-Y401 HydrophobicContact CD1-CE2 4.29Å; I369-Y401 HydrophobicContact CD1-CG 3.61Å; I369-Y401 HydrophobicContact CG1-CD2 4.27Å; I369-Y401 HydrophobicContact CG1-CE2 4.36Å; I369-Y401 HydrophobicContact CG1-CG 4.45Å; E392-Y401 WeakPolarHBondContact CA-O 3.36Å; V393-Y401 PolarHBondContact N-O 2.91Å; V393-Y401 PolarHBondContact O-N 3.08Å; V395-Y401 HydrophobicContact CG1-CD2 4.34Å; V395-Y401 HydrophobicContact CG1-CE2 4.08Å; V395-Y401 HydrophobicContact CG2-CE2 3.88Å; M399-Y401 HydrophobicContact CB-CE2 4.34Å; M399-Y401 WeakPolarHBondContact CE-OH 3.24Å
402	T	94.7	Very high	91.2	Very high	55 Å²	55	57.3 Å²	57.3	34%	0.337	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	115.4	177.7	-30.6	0	0	0	0	111.1	Y345 D390 E392 T404	Y345-T402 VanDerWaalsContact CD2-O 3.25Å; Y345-T402 WeakPolarHBondContact CD2-O 3.46Å; D390-T402 HydrophobicContact CB-CG2 4.36Å; E392-T402 HydrophobicContact CB-CG2 4.3Å; T402-T404 HydrophobicContact CG2-CG2 4.01Å
403	F	94.8	Very high	91.1	Very high	1 Å²	1	58.4 Å²	58.4	0%	0.004	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	115.9	169.5	-57.8	-79.7	0	0	0	108.2	A344 Y345 L352 F361 I369 D390 F391 V393 I406	A344-F403 CarbonylContact O-C 3.57Å; A344-F403 WeakPolarHBondContact O-CA 3.01Å; Y345-F403 AromaticContact CD2-CD1 3.87Å; Y345-F403 HydrophobicContact CD2-CD1 3.87Å; Y345-F403 AromaticContact CD2-CE1 3.77Å; Y345-F403 HydrophobicContact CD2-CE1 3.77Å; Y345-F403 HydrophobicContact CD2-CZ 4.42Å; Y345-F403 HydrophobicContact CG-CD1 4.24Å; Y345-F403 HydrophobicContact CG-CE1 4.1Å; L352-F403 HydrophobicContact CD1-CD1 4.38Å; L352-F403 HydrophobicContact CD1-CD2 4.45Å; L352-F403 HydrophobicContact CD1-CE1 4.13Å; L352-F403 HydrophobicContact CD1-CE2 4.19Å; L352-F403 HydrophobicContact CD1-CZ 4.02Å; L352-F403 HydrophobicContact CD2-CD2 4.23Å; L352-F403 HydrophobicContact CD2-CG 4.2Å; F361-F403 HydrophobicContact CB-CE1 3.61Å; F361-F403 HydrophobicContact CB-CZ 4.27Å; F361-F403 AromaticContact CD2-CD1 3.97Å; F361-F403 HydrophobicContact CD2-CD1 3.97Å; F361-F403 AromaticContact CD2-CE1 3.89Å; F361-F403 HydrophobicContact CD2-CE1 3.89Å; F361-F403 HydrophobicContact CG-CD1 4.3Å; F361-F403 AromaticContact CG-CE1 3.75Å; F361-F403 HydrophobicContact CG-CE1 3.75Å; I369-F403 HydrophobicContact CD1-CE2 4.28Å; I369-F403 HydrophobicContact CD1-CZ 4.15Å; D390-F403 CarbonylContact C-O 3.43Å; D390-F403 WeakPolarHBondContact CA-O 3.4Å; F391-F403 AromaticContact CD1-CD2 3.99Å; F391-F403 HydrophobicContact CD1-CD2 3.99Å; F391-F403 PolarHBondContact N-O 2.94Å; F391-F403 PolarHBondContact O-N 2.75Å; V393-F403 HydrophobicContact CG2-CE2 4.18Å; F403-I406 HydrophobicContact CB-CD1 4.26Å
404	T	93.2	Very high	91	Very high	36 Å²	36	58.4 Å²	58.4	22%	0.221	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	165.6	-170.8	68.1	0	0	0	0	112.5	A344 D390 T402 I406	A344-T404 PolarHBondContact N-O 3.36Å; A344-T404 PolarHBondContact O-N 3.23Å; D390-T404 HydrophobicContact CB-CG2 4.33Å; D390-T404 WeakPolarHBondContact OD1-CA 3.41Å; D390-T404 VanDerWaalsContact OD1-CB 3.24Å; D390-T404 WeakPolarHBondContact OD1-CB 3.38Å; D390-T404 WeakPolarHBondContact OD2-CG2 3.2Å; T402-T404 HydrophobicContact CG2-CG2 4.01Å; T404-I406 VanDerWaalsContact C-N 3.32Å; T404-I406 PolarHBondContact O-N 2.73Å
405	S	89.2	Confident	90.9	Very high	75 Å²	75	61.1 Å²	61.1	52%	0.524	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	60.7	35.6	173.5	-48.5	0	0	0	0	114.2	D390	D390-S405 PolarHBondContact OD1-N 2.69Å
406	I	92.3	Very high	90.9	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	134.1	172.9	-58.1	164.2	0	0	0	108.7	I341 C343 S388 F389 F391 F403 T404 E410	I341-I406 HydrophobicContact CG2-CB 4.5Å; I341-I406 HydrophobicContact CG2-CG1 4.3Å; I341-I406 HydrophobicContact CG2-CG2 3.48Å; I341-I406 VanDerWaalsContact CG2-CG2 3.48Å; C343-I406 HydrophobicContact CB-CD1 4.45Å; C343-I406 HydrophobicContact CB-CG1 3.6Å; S388-I406 CarbonylContact C-O 3.6Å; S388-I406 WeakPolarHBondContact CA-O 3.41Å; S388-I406 VanDerWaalsContact CB-O 3.27Å; S388-I406 WeakPolarHBondContact CB-O 3.42Å; F389-I406 HydrophobicContact CD1-CB 4.05Å; F389-I406 HydrophobicContact CD1-CG2 4.14Å; F389-I406 WeakPolarHBondContact CD1-O 3.45Å; F389-I406 HydrophobicContact CE1-CB 3.7Å; F389-I406 HydrophobicContact CE1-CG2 3.34Å; F389-I406 HydrophobicContact CE2-CB 4.42Å; F389-I406 HydrophobicContact CE2-CD1 4.04Å; F389-I406 HydrophobicContact CE2-CG2 4.49Å; F389-I406 HydrophobicContact CZ-CB 3.9Å; F389-I406 HydrophobicContact CZ-CD1 4.06Å; F389-I406 HydrophobicContact CZ-CG2 3.56Å; F389-I406 PolarHBondContact N-O 3.15Å; F389-I406 PolarHBondContact O-N 3.32Å; F391-I406 HydrophobicContact CB-CD1 3.5Å; F403-I406 HydrophobicContact CB-CD1 4.26Å; T404-I406 VanDerWaalsContact C-N 3.32Å; T404-I406 PolarHBondContact O-N 2.73Å; I406-E410 HydrophobicContact CG2-CB 3.89Å
407	E	90.7	Very high	91	Very high	98 Å²	98	60.8 Å²	60.8	46%	0.458	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	136.9	178	-64.2	-175.8	159.3	0	0	112	F389 E409 E410	F389-E407 WeakPolarHBondContact CE1-O 3.26Å; E407-E409 PolarHBondContact O-N 2.74Å; E407-E409 VanDerWaalsContact O-N 3.09Å; E407-E410 HydrophobicContact CB-CG 4.5Å; E407-E410 WeakPolarHBondContact O-CB 3.48Å; E407-E410 PolarHBondContact O-N 2.66Å
408	K	87.8	Confident	91.2	Very high	139 Å²	139	56.5 Å²	56.5	60%	0.604	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-55.2	-32.3	-176.3	-177	-179.3	177.5	-175.9	0	112.8	R387 E410 N411	R387-K408 WeakPolarHBondContact O-CB 3.44Å; R387-K408 PolarHBondContact O-N 3.48Å; K408-E410 VanDerWaalsContact C-N 3.3Å; K408-E410 PolarHBondContact O-N 3.36Å; K408-N411 WeakPolarHBondContact O-CB 3.43Å; K408-N411 PolarHBondContact O-N 2.85Å; K408-N411 VanDerWaalsContact O-N 3.16Å
409	E	88.9	Confident	91.6	Very high	92 Å²	92	56.7 Å²	56.7	43%	0.43	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-68.3	-26	-179.3	-65.4	68.5	-158	0	0	112.7	N335 E407 N411	N335-E409 HydrophobicContact CB-CB 4.13Å; N335-E409 WeakPolarHBondContact ND2-CB 3.37Å; E407-E409 PolarHBondContact O-N 2.74Å; E407-E409 VanDerWaalsContact O-N 3.09Å; E409-N411 VanDerWaalsContact C-N 3.31Å
410	E	90.6	Very high	91.7	Very high	3 Å²	3	56.4 Å²	56.4	1%	0.014	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-77.1	-16.1	173.7	-65.2	-69.7	171.8	0	0	112.4	G334 N335 T336 I341 I406 E407 K408 A412 K413 L414	G334-E410 WeakPolarHBondContact CA-OE2 3.33Å; N335-E410 WeakPolarHBondContact CA-OE1 3.23Å; N335-E410 HydrophobicContact CB-CG 4.25Å; N335-E410 WeakPolarHBondContact CB-OE1 3.38Å; N335-E410 PolarHBondContact N-OE1 2.75Å; N335-E410 PolarHBondContact N-OE2 3.42Å; T336-E410 PolarHBondContact N-OE1 3.21Å; T336-E410 VanDerWaalsContact N-OE1 3.11Å; T336-E410 PolarHBondContact OG1-OE1 3.12Å; I341-E410 HydrophobicContact CG2-CB 4.42Å; I341-E410 HydrophobicContact CG2-CG 4.34Å; I406-E410 HydrophobicContact CG2-CB 3.89Å; E407-E410 HydrophobicContact CB-CG 4.5Å; E407-E410 WeakPolarHBondContact O-CB 3.48Å; E407-E410 PolarHBondContact O-N 2.66Å; K408-E410 VanDerWaalsContact C-N 3.3Å; K408-E410 PolarHBondContact O-N 3.36Å; E410-A412 PolarHBondContact O-N 3.12Å; E410-K413 PolarHBondContact O-N 2.73Å; E410-L414 WeakPolarHBondContact O-CB 3.48Å; E410-L414 PolarHBondContact O-N 2.98Å
411	N	89.8	Confident	91.8	Very high	36 Å²	36	55.5 Å²	55.5	19%	0.193	28%	0.28	C	S	.	.	H	α-helix	trans	-59.1	-48.5	-173.1	-171.4	-100.3	0	0	0	112.9	F389 K408 E409 K413 L414 Y415	F389-N411 HydrophobicContact CD1-CB 3.74Å; F389-N411 WeakPolarHBondContact CD1-ND2 3.49Å; F389-N411 WeakPolarHBondContact CD2-ND2 3.3Å; F389-N411 VanDerWaalsContact CE1-CA 3.42Å; F389-N411 HydrophobicContact CE1-CB 3.45Å; F389-N411 VanDerWaalsContact CE1-CB 3.45Å; F389-N411 VanDerWaalsContact CE2-ND2 3.31Å; F389-N411 WeakPolarHBondContact CE2-ND2 3.21Å; F389-N411 HydrophobicContact CG-CB 4.41Å; F389-N411 VanDerWaalsContact CG-ND2 3.3Å; F389-N411 WeakPolarHBondContact CG-ND2 3.34Å; F389-N411 HydrophobicContact CZ-CB 3.92Å; F389-N411 WeakPolarHBondContact CZ-ND2 3.37Å; K408-N411 WeakPolarHBondContact O-CB 3.43Å; K408-N411 PolarHBondContact O-N 2.85Å; K408-N411 VanDerWaalsContact O-N 3.16Å; E409-N411 VanDerWaalsContact C-N 3.31Å; N411-K413 PolarHBondContact O-N 3.24Å; N411-L414 PolarHBondContact O-N 3.46Å; N411-Y415 VanDerWaalsContact O-CB 3.26Å; N411-Y415 WeakPolarHBondContact O-CB 3.34Å; N411-Y415 PolarHBondContact O-N 3.38Å
412	A	90.3	Very high	91.6	Very high	68 Å²	68	64.7 Å²	64.7	56%	0.562	32%	0.315	S	S	*	.	H	α-helix	trans	-62.5	-44.2	-177.1	0	0	0	0	0	111.9	E410 Y415 E416	E410-A412 PolarHBondContact O-N 3.12Å; A412-Y415 PolarHBondContact O-N 3.21Å; A412-E416 WeakPolarHBondContact O-CB 3.06Å; A412-E416 PolarHBondContact O-N 3.4Å
413	K	92.3	Very high	91.5	Very high	73 Å²	73	63 Å²	63	32%	0.317	30%	0.303	S	S	.	.	H	α-helix	trans	-70	-40.1	-179.5	-57.3	-161.6	-172.7	-171.2	0	112.2	F332 T333 G334 E410 N411 Y417	F332-K413 HydrophobicContact CE2-CB 4.07Å; F332-K413 HydrophobicContact CZ-CB 4.44Å; T333-K413 WeakPolarHBondContact O-CD 3.25Å; G334-K413 PolarHBondContact O-NZ 3.28Å; E410-K413 PolarHBondContact O-N 2.73Å; N411-K413 PolarHBondContact O-N 3.24Å; K413-Y417 WeakPolarHBondContact O-CB 3.4Å; K413-Y417 PolarHBondContact O-N 2.91Å
414	L	92.6	Very high	91.3	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-66.7	-39.3	175.6	-177.1	59.2	0	0	0	111.2	I341 P354 F359 F379 F389 F391 E410 N411 Y417 V418	I341-L414 HydrophobicContact CD1-CB 4.31Å; I341-L414 HydrophobicContact CD1-CD1 3.95Å; I341-L414 HydrophobicContact CD1-CD2 4.08Å; I341-L414 HydrophobicContact CD1-CG 4.34Å; P354-L414 HydrophobicContact CG-CD1 4.22Å; F359-L414 HydrophobicContact CE1-CD1 4.37Å; F379-L414 HydrophobicContact CE1-CB 4.3Å; F379-L414 HydrophobicContact CE1-CD2 4.04Å; F379-L414 HydrophobicContact CE1-CG 3.94Å; F379-L414 HydrophobicContact CZ-CG 4.21Å; F389-L414 HydrophobicContact CE2-CD2 4.27Å; F389-L414 HydrophobicContact CZ-CD2 4.08Å; F391-L414 HydrophobicContact CB-CD2 4.29Å; F391-L414 HydrophobicContact CD1-CD2 3.96Å; F391-L414 HydrophobicContact CD2-CD2 3.98Å; F391-L414 HydrophobicContact CE1-CD2 4.24Å; F391-L414 HydrophobicContact CE2-CD2 4.26Å; F391-L414 HydrophobicContact CG-CD2 3.82Å; F391-L414 HydrophobicContact CZ-CD2 4.38Å; E410-L414 WeakPolarHBondContact O-CB 3.48Å; E410-L414 PolarHBondContact O-N 2.98Å; N411-L414 PolarHBondContact O-N 3.46Å; L414-Y417 PolarHBondContact O-N 2.99Å; L414-V418 HydrophobicContact CD1-CG2 4.33Å; L414-V418 WeakPolarHBondContact O-CB 3.49Å; L414-V418 WeakPolarHBondContact O-CG2 3.23Å; L414-V418 PolarHBondContact O-N 3Å
415	Y	92	Very high	91.2	Very high	97 Å²	97	68.4 Å²	68.4	38%	0.38	33%	0.326	S	S	.	.	H	α-helix	trans	-63.6	-45.9	174.9	-172.9	-92.8	0	0	0	112	F379 N411 A412 Y417 V418 N419 I425	F379-Y415 HydrophobicContact CD2-CD2 4.13Å; F379-Y415 AromaticContact CE2-CD2 3.88Å; F379-Y415 HydrophobicContact CE2-CD2 3.88Å; F379-Y415 HydrophobicContact CZ-CD2 4.1Å; N411-Y415 VanDerWaalsContact O-CB 3.26Å; N411-Y415 WeakPolarHBondContact O-CB 3.34Å; N411-Y415 PolarHBondContact O-N 3.38Å; A412-Y415 PolarHBondContact O-N 3.21Å; Y415-Y417 PolarHBondContact O-N 3.12Å; Y415-V418 PolarHBondContact O-N 3Å; Y415-N419 WeakPolarHBondContact CD1-ND2 3.41Å; Y415-N419 WeakPolarHBondContact CE1-ND2 3.3Å; Y415-N419 PolarHBondContact O-N 3.31Å; Y415-N419 VanDerWaalsContact O-N 3.13Å; Y415-N419 PolarHBondContact O-ND2 3.07Å; Y415-I425 HydrophobicContact CD2-CD1 3.9Å; Y415-I425 HydrophobicContact CE2-CD1 3.51Å; Y415-I425 HydrophobicContact CE2-CG2 4.31Å
416	E	92.1	Very high	91	Very high	142 Å²	142	67.1 Å²	67.1	66%	0.664	32%	0.315	S	S	*	.	H	α-helix	trans	-57	-49.1	174.1	-176.7	177.4	-164.5	0	0	111.6	A412 V418 N419 E420	A412-E416 WeakPolarHBondContact O-CB 3.06Å; A412-E416 PolarHBondContact O-N 3.4Å; E416-V418 PolarHBondContact O-N 3.02Å; E416-N419 PolarHBondContact O-N 3.41Å; E416-E420 PolarHBondContact O-N 2.91Å
417	Y	92.9	Very high	90.1	Very high	7 Å²	7	72.7 Å²	72.7	3%	0.027	35%	0.345	C	S	.	.	H	α-helix	trans	-61.3	-42.4	178.7	-180	-95.9	0	0	0	113.6	F332 P354 M355 F359 F371 K413 L414 Y415 N419 E420 K421	F332-Y417 HydrophobicContact CB-CD2 3.89Å; F332-Y417 HydrophobicContact CB-CE2 3.94Å; F332-Y417 HydrophobicContact CB-CG 4.45Å; F332-Y417 HydrophobicContact CD2-CD2 4Å; F332-Y417 AromaticContact CD2-CG 3.85Å; F332-Y417 HydrophobicContact CD2-CG 3.85Å; F332-Y417 HydrophobicContact CG-CD2 4.41Å; P354-Y417 HydrophobicContact CB-CD1 3.76Å; P354-Y417 HydrophobicContact CB-CE1 3.41Å; P354-Y417 VanDerWaalsContact CB-CE1 3.41Å; P354-Y417 HydrophobicContact CB-CE2 4.43Å; P354-Y417 HydrophobicContact CB-CG 4.42Å; M355-Y417 VanDerWaalsContact C-OH 3.29Å; M355-Y417 PolarHBondContact O-OH 2.99Å; F359-Y417 HydrophobicContact CE1-CE1 4.42Å; F371-Y417 HydrophobicContact CZ-CE1 4.03Å; K413-Y417 WeakPolarHBondContact O-CB 3.4Å; K413-Y417 PolarHBondContact O-N 2.91Å; L414-Y417 PolarHBondContact O-N 2.99Å; Y415-Y417 PolarHBondContact O-N 3.12Å; Y417-N419 VanDerWaalsContact C-N 3.27Å; Y417-N419 PolarHBondContact O-N 2.85Å; Y417-E420 WeakPolarHBondContact O-CB 3.3Å; Y417-E420 PolarHBondContact O-N 3.3Å; Y417-K421 HydrophobicContact CD1-CG 4.39Å; Y417-K421 HydrophobicContact CE1-CG 3.85Å; Y417-K421 HydrophobicContact CE2-CD 4.44Å; Y417-K421 HydrophobicContact CE2-CG 4.09Å; Y417-K421 WeakPolarHBondContact O-CG 3.41Å; Y417-K421 PolarHBondContact O-N 3.12Å; Y417-K421 WeakPolarHBondContact OH-CE 3.15Å
418	V	92.6	Very high	88.4	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-60.9	-38.1	176.5	163.1	0	0	0	0	111.2	F359 V377 F379 F391 L414 Y415 E416 R422 L423 I425	F359-V418 HydrophobicContact CZ-CG2 4.26Å; V377-V418 HydrophobicContact CG2-CG1 3.52Å; F379-V418 HydrophobicContact CE2-CG1 4.27Å; F379-V418 HydrophobicContact CE2-CG2 4.5Å; F379-V418 HydrophobicContact CZ-CB 4.32Å; F379-V418 HydrophobicContact CZ-CG2 4.02Å; F391-V418 HydrophobicContact CE2-CG2 4.2Å; F391-V418 HydrophobicContact CZ-CG2 4.1Å; L414-V418 HydrophobicContact CD1-CG2 4.33Å; L414-V418 WeakPolarHBondContact O-CB 3.49Å; L414-V418 WeakPolarHBondContact O-CG2 3.23Å; L414-V418 PolarHBondContact O-N 3Å; Y415-V418 PolarHBondContact O-N 3Å; E416-V418 PolarHBondContact O-N 3.02Å; V418-R422 PolarHBondContact O-N 2.96Å; V418-L423 HydrophobicContact CG1-CB 3.95Å; V418-L423 HydrophobicContact CG2-CD1 4.46Å; V418-L423 PolarHBondContact O-N 2.9Å; V418-L423 VanDerWaalsContact O-N 3.1Å; V418-I425 HydrophobicContact CG1-CD1 3.63Å; V418-I425 HydrophobicContact CG1-CG1 3.6Å
419	N	91.9	Very high	86.5	Confident	74 Å²	74	75 Å²	75	40%	0.396	36%	0.361	S	S	.	.	H	α-helix	trans	-70.9	-41.4	173.7	-74.4	-72.1	0	0	0	112.5	Y415 E416 Y417 K421 R422 I425	Y415-N419 WeakPolarHBondContact CD1-ND2 3.41Å; Y415-N419 WeakPolarHBondContact CE1-ND2 3.3Å; Y415-N419 PolarHBondContact O-N 3.31Å; Y415-N419 VanDerWaalsContact O-N 3.13Å; Y415-N419 PolarHBondContact O-ND2 3.07Å; E416-N419 PolarHBondContact O-N 3.41Å; Y417-N419 VanDerWaalsContact C-N 3.27Å; Y417-N419 PolarHBondContact O-N 2.85Å; N419-K421 VanDerWaalsContact C-N 3.27Å; N419-K421 PolarHBondContact O-N 3.49Å; N419-R422 WeakPolarHBondContact O-CA 3.44Å; N419-R422 PolarHBondContact O-N 3.43Å; N419-I425 WeakPolarHBondContact ND2-CD1 3.26Å
420	E	92.7	Very high	84.3	Confident	96 Å²	96	75.2 Å²	75.2	45%	0.449	36%	0.36	S	S	.	.	H	α-helix	trans	-55	-44.3	173.7	-168	-144	139	0	0	110.9	E416 Y417 R422	E416-E420 PolarHBondContact O-N 2.91Å; Y417-E420 WeakPolarHBondContact O-CB 3.3Å; Y417-E420 PolarHBondContact O-N 3.3Å; E420-R422 PolarHBondContact O-N 2.86Å
421	K	92.3	Very high	81.6	Confident	36 Å²	36	80.9 Å²	80.9	16%	0.157	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	4.4	177.8	-57.3	-48.2	-176.8	-166.1	0	114.3	E356 F371 Y417 N419 L423	E356-K421 IonicContact OE1-NZ 3.94Å; E356-K421 PolarHBondContact OE1-NZ 3.22Å; E356-K421 IonicContact OE2-NZ 2.88Å; E356-K421 PolarHBondContact OE2-NZ 3.4Å; F371-K421 HydrophobicContact CD2-CB 4.48Å; F371-K421 HydrophobicContact CE2-CB 4.08Å; F371-K421 HydrophobicContact CE2-CD 4.35Å; F371-K421 HydrophobicContact CE2-CG 3.84Å; F371-K421 HydrophobicContact CZ-CB 4.49Å; F371-K421 HydrophobicContact CZ-CG 4.21Å; Y417-K421 HydrophobicContact CD1-CG 4.39Å; Y417-K421 HydrophobicContact CE1-CG 3.85Å; Y417-K421 HydrophobicContact CE2-CD 4.44Å; Y417-K421 HydrophobicContact CE2-CG 4.09Å; Y417-K421 WeakPolarHBondContact O-CG 3.41Å; Y417-K421 PolarHBondContact O-N 3.12Å; Y417-K421 WeakPolarHBondContact OH-CE 3.15Å; N419-K421 VanDerWaalsContact C-N 3.27Å; N419-K421 PolarHBondContact O-N 3.49Å; K421-L423 VanDerWaalsContact C-N 3.25Å; K421-L423 HydrophobicContact CB-CG 4.37Å; K421-L423 PolarHBondContact O-N 3.34Å
422	R	90.8	Very high	79.1	Confident	231 Å²	231	85.2 Å²	85.2	87%	0.872	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	35.3	175.7	-53.5	-177.7	-178.2	-172.6	-1.7	114.1	V418 N419 E420	V418-R422 PolarHBondContact O-N 2.96Å; N419-R422 WeakPolarHBondContact O-CA 3.44Å; N419-R422 PolarHBondContact O-N 3.43Å; E420-R422 PolarHBondContact O-N 2.86Å
423	L	91.6	Very high	76.3	Confident	19 Å²	19	87.6 Å²	87.6	10%	0.099	44%	0.437	C	S	.	.			trans	-76.1	141.2	174	-62.1	178.9	0	0	0	109.9	F359 F371 V374 V377 V418 K421 I425	F359-L423 HydrophobicContact CE2-CD1 3.8Å; F359-L423 HydrophobicContact CZ-CD1 3.9Å; F371-L423 HydrophobicContact CB-CD2 4.07Å; F371-L423 HydrophobicContact CD1-CD1 3.96Å; F371-L423 HydrophobicContact CD1-CD2 4.05Å; F371-L423 HydrophobicContact CE1-CD1 3.99Å; F371-L423 HydrophobicContact CG-CD2 4.1Å; V374-L423 HydrophobicContact CB-CD2 4.43Å; V374-L423 HydrophobicContact CG1-CD2 4.38Å; V377-L423 HydrophobicContact CG1-CD1 4.41Å; V418-L423 HydrophobicContact CG1-CB 3.95Å; V418-L423 HydrophobicContact CG2-CD1 4.46Å; V418-L423 PolarHBondContact O-N 2.9Å; V418-L423 VanDerWaalsContact O-N 3.1Å; K421-L423 VanDerWaalsContact C-N 3.25Å; K421-L423 HydrophobicContact CB-CG 4.37Å; K421-L423 PolarHBondContact O-N 3.34Å; L423-I425 PolarHBondContact O-N 2.86Å
424	H	90.7	Very high	73.5	Confident	122 Å²	122	90.5 Å²	90.5	57%	0.565	46%	0.456	S	S	*	.			trans	-73.4	112.5	-178.9	178.6	46.5	0	0	0	111.1	S376 V377	S376-H424 CarbonylContact C-O 3.57Å; S376-H424 WeakPolarHBondContact CA-O 3.41Å; S376-H424 WeakPolarHBondContact CB-O 3.49Å; V377-H424 PolarHBondContact N-O 3.34Å
425	I	90.9	Very high	70.7	Confident	28 Å²	28	97.1 Å²	97.1	14%	0.144	50%	0.496	C	S	.	.	B	Isolated β-bridge	trans	-89.1	129.4	176.6	-49.6	-176.8	0	0	0	109.6	V377 F379 Y415 V418 N419 L423	V377-I425 HydrophobicContact CG2-CG1 4.06Å; V377-I425 WeakPolarHBondContact O-CA 3.35Å; F379-I425 HydrophobicContact CD2-CG2 4.09Å; F379-I425 HydrophobicContact CE2-CD1 4.28Å; F379-I425 HydrophobicContact CE2-CG2 4.31Å; Y415-I425 HydrophobicContact CD2-CD1 3.9Å; Y415-I425 HydrophobicContact CE2-CD1 3.51Å; Y415-I425 HydrophobicContact CE2-CG2 4.31Å; V418-I425 HydrophobicContact CG1-CD1 3.63Å; V418-I425 HydrophobicContact CG1-CG1 3.6Å; N419-I425 WeakPolarHBondContact ND2-CD1 3.26Å; L423-I425 PolarHBondContact O-N 2.86Å
426	V	86.4	Confident	67.8	Low	48 Å²	48	96.8 Å²	96.8	29%	0.291	51%	0.508	S	S	.	.			trans	-110.5	114.6	175	-178.9	0	0	0	0	109.5	V377 H378 V428	V377-V426 PolarHBondContact O-N 3.43Å; H378-V426 PolarHBondContact ND1-O 2.82Å; V426-V428 HydrophobicContact CG1-CG2 3.76Å; V426-V428 PolarHBondContact O-N 2.9Å
427	N	72.9	Confident	64.9	Low	117 Å²	117	96.5 Å²	96.5	63%	0.626	51%	0.511	S	S	*	.			trans	-94.7	78.5	176.1	-72.3	-18.3	0	0	0	110.4	K429	N427-K429 PolarHBondContact O-N 3.01Å
428	V	54.8	Low	62.2	Low	86 Å²	86	102.9 Å²	102.9	52%	0.521	55%	0.546	S	S	.	.			trans	-68.6	112.1	169.7	-172	0	0	0	0	108.5	V426 K430	V426-V428 HydrophobicContact CG1-CG2 3.76Å; V426-V428 PolarHBondContact O-N 2.9Å; V428-K430 PolarHBondContact O-N 2.83Å
429	K	48	Very low	59.6	Low	199 Å²	199	109.8 Å²	109.8	87%	0.865	58%	0.582	S	S	*	*			trans	-64.4	114	157	-70.9	-176.9	179	-179.2	0	106.3	N427	N427-K429 PolarHBondContact O-N 3.01Å
430	K	43.1	Very low	56.9	Low	98 Å²	98	115.5 Å²	115.5	43%	0.426	60%	0.604	S	S	.	*			trans	-51.4	128.3	166.3	-78.8	170	173.8	156.1	0	107.7	D380 D383 V428 V432	D380-K430 VanDerWaalsContact OD1-CE 3.23Å; D380-K430 WeakPolarHBondContact OD1-CE 3.47Å; D380-K430 IonicContact OD1-NZ 2.74Å; D380-K430 PolarHBondContact OD1-NZ 2.9Å; D380-K430 WeakPolarHBondContact OD2-CE 3.35Å; D380-K430 IonicContact OD2-NZ 2.72Å; D380-K430 PolarHBondContact OD2-NZ 3.46Å; D383-K430 IonicContact OD2-NZ 3.88Å; V428-K430 PolarHBondContact O-N 2.83Å; K430-V432 PolarHBondContact O-N 2.94Å; K430-V432 VanDerWaalsContact O-N 3.08Å
431	P	32.1	Very low	54.3	Low	122 Å²	122	120.6 Å²	120.6	79%	0.792	63%	0.628	S	S	*	*			trans	-63.9	114.5	169.7	26.7	-31.6	0	0	0	107.2	S433	P431-S433 PolarHBondContact O-N 2.87Å
432	V	37.8	Very low	51.6	Low	126 Å²	126	122.1 Å²	122.1	76%	0.764	65%	0.653	S	S	*	*			trans	-63	121	171.4	178.9	0	0	0	0	106.3	K430 D434	K430-V432 PolarHBondContact O-N 2.94Å; K430-V432 VanDerWaalsContact O-N 3.08Å; V432-D434 HydrophobicContact CG1-CB 4.47Å; V432-D434 PolarHBondContact O-N 3.26Å
433	S	32.3	Very low	48.9	Very low	118 Å²	118	119 Å²	119	83%	0.825	65%	0.654	S	S	*	*			trans	-82	68.9	-177.5	61.2	0	0	0	0	110.6	P431	P431-S433 PolarHBondContact O-N 2.87Å
434	D	32.9	Very low	46.3	Very low	135 Å²	135	122.8 Å²	122.8	72%	0.722	68%	0.682	S	S	*	*			trans	-146.3	139.4	170.5	-105	-40.5	0	0	0	111.1	V432	V432-D434 HydrophobicContact CG1-CB 4.47Å; V432-D434 PolarHBondContact O-N 3.26Å
435	V	34.1	Very low	43.6	Very low	138 Å²	138	124.5 Å²	124.5	84%	0.836	70%	0.695	S	S	*	*			trans	67.3	144.7	176	-161	0	0	0	0	116.8
436	S	32.1	Very low	41	Very low	90 Å²	90	126.6 Å²	126.6	63%	0.629	72%	0.724	S	S	*	*			trans	-79.1	155.2	-179.3	50.2	0	0	0	0	114
437	N	30.4	Very low	38.9	Very low	137 Å²	137	133.8 Å²	133.8	73%	0.733	75%	0.754	S	S	*	*			trans	63.2	131.6	162.2	-70.9	31.5	0	0	0	115.6
438	D	36.5	Very low	37.4	Very low	140 Å²	140	137.1 Å²	137.1	75%	0.749	76%	0.758	S	S	*	*			cis	-140.9	168.3	17.6	-86.1	-50.5	0	0	0	113.6
439	L	36.7	Very low	37.6	Very low	145 Å²	145	137.9 Å²	137.9	76%	0.759	76%	0.759	S	S	*	*			trans	-98.8	154.4	162.2	-74.6	83.3	0	0	0	109.8
440	F	35.7	Very low	37.7	Very low	194 Å²	194	135.4 Å²	135.4	85%	0.851	75%	0.751	S	S	*	*			trans	64.8	104.9	172.3	-60.8	-82.9	0	0	0	116.5
441	E	37.9	Very low	38.5	Very low	204 Å²	204	138.4 Å²	138.4	95%	0.953	76%	0.76	S	S	*	*			trans	-132.9	122.3	130.6	-129.8	171.6	-147.1	0	0	108.3
442	G	37	Very low	39.9	Very low	68 Å²	68	135.3 Å²	135.3	70%	0.701	75%	0.745	S	S	*	*			trans	-117.9	146.5	173.5	0	0	0	0	0	108.6
443	N	33.4	Very low	41.2	Very low	166 Å²	166	133 Å²	133	89%	0.888	73%	0.726	S	S	*	*			trans	-60.3	154.7	-172.8	-81.4	8	0	0	0	114.5
444	S	36	Very low	42.9	Very low	98 Å²	98	132.9 Å²	132.9	69%	0.685	71%	0.713	S	S	*	*			trans	86.4	110.9	155.5	-96.5	0	0	0	0	119.3
445	D	34.3	Very low	44.6	Very low	158 Å²	158	130.8 Å²	130.8	85%	0.845	70%	0.701	S	S	*	*			trans	72.2	84.9	132.1	-49.7	-42.5	0	0	0	119
446	G	36	Very low	46.2	Very low	72 Å²	72	130.9 Å²	130.9	74%	0.742	69%	0.69	S	S	*	*			trans	-175.2	99.8	163.9	0	0	0	0	0	113.5
447	E	43.6	Very low	47.8	Very low	199 Å²	199	130.6 Å²	130.6	93%	0.93	68%	0.681	S	S	*	*			trans	48.4	118	164.8	-59.1	-171.9	160.2	0	0	119.1
448	R	41.9	Very low	49.3	Very low	187 Å²	187	129.1 Å²	129.1	71%	0.706	67%	0.67	S	S	*	*			trans	-93.6	105.2	-174.8	-169.6	-178.9	-167.3	147.1	4.5	111.2	H450 E453	R448-H450 PolarHBondContact O-N 2.63Å; R448-E453 IonicContact CZ-OE1 2.74Å; R448-E453 VanDerWaalsContact CZ-OE1 3.24Å; R448-E453 IonicContact CZ-OE2 3.66Å; R448-E453 VanDerWaalsContact NE-CD 3.31Å; R448-E453 IonicContact NE-OE1 3.12Å; R448-E453 PolarHBondContact NE-OE1 3.15Å; R448-E453 IonicContact NE-OE2 2.66Å; R448-E453 PolarHBondContact NE-OE2 3.28Å; R448-E453 VanDerWaalsContact NE-OE2 3.08Å; R448-E453 IonicContact NH2-OE1 3.75Å; R448-E453 PolarHBondContact NH2-OE1 3.5Å; R448-E453 IonicContact NH2-OE2 3.15Å
449	D	57.3	Low	50.4	Low	102 Å²	102	124.8 Å²	124.8	55%	0.545	65%	0.654	S	S	.	*			trans	-70.6	110.7	175.4	-176.5	3.1	0	0	0	111.5	Y451 A452	D449-Y451 PolarHBondContact O-N 2.97Å; D449-Y451 WeakPolarHBondContact OD1-CB 3.27Å; D449-Y451 PolarHBondContact OD1-N 2.75Å; D449-A452 HydrophobicContact CB-CB 4.38Å; D449-A452 PolarHBondContact O-N 3.03Å
450	H	51.6	Low	51.6	Low	147 Å²	147	125.5 Å²	125.5	68%	0.681	65%	0.646	S	S	*	*	H	α-helix	trans	-61.7	-27.3	177.6	-102.9	-78.2	0	0	0	113.7	R448 Q454	R448-H450 PolarHBondContact O-N 2.63Å; H450-Q454 PolarHBondContact O-N 3.17Å
451	Y	58.4	Low	52.6	Low	160 Å²	160	123.7 Å²	123.7	63%	0.627	64%	0.64	S	S	*	*	H	α-helix	trans	-72.9	-36.4	-178.2	-168.6	-116.7	0	0	0	111.7	D449 Q454 L455	D449-Y451 PolarHBondContact O-N 2.97Å; D449-Y451 WeakPolarHBondContact OD1-CB 3.27Å; D449-Y451 PolarHBondContact OD1-N 2.75Å; Y451-Q454 PolarHBondContact O-N 2.91Å; Y451-L455 HydrophobicContact CD1-CD1 4.21Å; Y451-L455 HydrophobicContact CD2-CD1 4.38Å; Y451-L455 HydrophobicContact CE1-CD1 3.83Å; Y451-L455 HydrophobicContact CE2-CD1 4.01Å; Y451-L455 HydrophobicContact CG-CD1 4.47Å; Y451-L455 PolarHBondContact O-N 3.07Å
452	A	61.9	Low	53.5	Low	58 Å²	58	121.5 Å²	121.5	48%	0.479	63%	0.632	S	S	.	*	H	α-helix	trans	-68.8	-34.3	178	0	0	0	0	0	113.2	D449 K456	D449-A452 HydrophobicContact CB-CB 4.38Å; D449-A452 PolarHBondContact O-N 3.03Å; A452-K456 WeakPolarHBondContact O-CB 3.44Å; A452-K456 PolarHBondContact O-N 3.3Å
453	E	65.4	Low	54	Low	76 Å²	76	126.5 Å²	126.5	36%	0.355	64%	0.637	S	S	.	*	H	α-helix	trans	-70.6	-31.6	172.8	-69.7	-167.9	144	0	0	112.1	R448 K456 N457	R448-E453 IonicContact CZ-OE1 2.74Å; R448-E453 VanDerWaalsContact CZ-OE1 3.24Å; R448-E453 IonicContact CZ-OE2 3.66Å; R448-E453 VanDerWaalsContact NE-CD 3.31Å; R448-E453 IonicContact NE-OE1 3.12Å; R448-E453 PolarHBondContact NE-OE1 3.15Å; R448-E453 IonicContact NE-OE2 2.66Å; R448-E453 PolarHBondContact NE-OE2 3.28Å; R448-E453 VanDerWaalsContact NE-OE2 3.08Å; R448-E453 IonicContact NH2-OE1 3.75Å; R448-E453 PolarHBondContact NH2-OE1 3.5Å; R448-E453 IonicContact NH2-OE2 3.15Å; E453-K456 PolarHBondContact O-N 2.9Å; E453-N457 PolarHBondContact O-N 2.95Å; E453-N457 VanDerWaalsContact O-N 3.14Å
454	Q	67.3	Low	54.3	Low	117 Å²	117	125.4 Å²	125.4	55%	0.547	63%	0.632	S	S	.	*	H	α-helix	trans	-69.1	-51	-178.3	-166.1	164.7	0	0	0	112.4	H450 Y451 K456 N457 E458	H450-Q454 PolarHBondContact O-N 3.17Å; Y451-Q454 PolarHBondContact O-N 2.91Å; Q454-K456 PolarHBondContact O-N 3.36Å; Q454-N457 PolarHBondContact O-N 3.06Å; Q454-N457 VanDerWaalsContact O-N 3.14Å; Q454-E458 PolarHBondContact O-N 2.78Å
455	L	68.3	Low	54.4	Low	90 Å²	90	128.5 Å²	128.5	47%	0.471	64%	0.641	S	S	.	*	H	α-helix	trans	-58.4	-34.5	173.6	-90.7	85.5	0	0	0	112.4	Y451 N457 A459	Y451-L455 HydrophobicContact CD1-CD1 4.21Å; Y451-L455 HydrophobicContact CD2-CD1 4.38Å; Y451-L455 HydrophobicContact CE1-CD1 3.83Å; Y451-L455 HydrophobicContact CE2-CD1 4.01Å; Y451-L455 HydrophobicContact CG-CD1 4.47Å; Y451-L455 PolarHBondContact O-N 3.07Å; L455-N457 VanDerWaalsContact C-N 3.29Å; L455-N457 PolarHBondContact O-N 2.8Å; L455-A459 WeakPolarHBondContact O-CB 3.41Å; L455-A459 PolarHBondContact O-N 2.9Å
456	K	69	Low	54.6	Low	141 Å²	141	126.4 Å²	126.4	61%	0.613	64%	0.638	S	S	*	*	H	α-helix	trans	-75.6	-17.5	-177.5	-153.9	167.8	-166.9	169.3	0	113	A452 E453 Q454 R460	A452-K456 WeakPolarHBondContact O-CB 3.44Å; A452-K456 PolarHBondContact O-N 3.3Å; E453-K456 PolarHBondContact O-N 2.9Å; Q454-K456 PolarHBondContact O-N 3.36Å; K456-R460 WeakPolarHBondContact O-CD 3.26Å; K456-R460 WeakPolarHBondContact O-CG 3.31Å
457	N	65.6	Low	54.8	Low	83 Å²	83	127.6 Å²	127.6	44%	0.444	64%	0.635	S	S	.	*	H	α-helix	trans	-88.7	-44.2	168.8	-73.2	-11	0	0	0	111.5	E453 Q454 L455 A459 R460 E461	E453-N457 PolarHBondContact O-N 2.95Å; E453-N457 VanDerWaalsContact O-N 3.14Å; Q454-N457 PolarHBondContact O-N 3.06Å; Q454-N457 VanDerWaalsContact O-N 3.14Å; L455-N457 VanDerWaalsContact C-N 3.29Å; L455-N457 PolarHBondContact O-N 2.8Å; N457-A459 VanDerWaalsContact C-N 3.26Å; N457-A459 PolarHBondContact O-N 2.84Å; N457-R460 CarbonylContact O-C 3.51Å; N457-R460 WeakPolarHBondContact O-CA 3.45Å; N457-R460 WeakPolarHBondContact O-CB 3.26Å; N457-R460 PolarHBondContact O-N 3.23Å; N457-E461 PolarHBondContact O-N 3.29Å
458	E	62.4	Low	54.6	Low	106 Å²	106	125.1 Å²	125.1	50%	0.495	63%	0.628	S	S	.	*	H	α-helix	trans	-56.8	-39.4	175.4	-71.2	-179.5	160.7	0	0	112.1	Q454 R460 E461 M462	Q454-E458 PolarHBondContact O-N 2.78Å; E458-R460 VanDerWaalsContact C-N 3.34Å; E458-R460 PolarHBondContact O-N 2.84Å; E458-E461 PolarHBondContact O-N 2.87Å; E458-M462 PolarHBondContact O-N 3.13Å
459	A	59.4	Low	54.4	Low	50 Å²	50	120.8 Å²	120.8	41%	0.413	63%	0.627	S	S	.	*	H	α-helix	trans	-63.6	-36.1	173.2	0	0	0	0	0	113.2	L455 N457 E463	L455-A459 WeakPolarHBondContact O-CB 3.41Å; L455-A459 PolarHBondContact O-N 2.9Å; N457-A459 VanDerWaalsContact C-N 3.26Å; N457-A459 PolarHBondContact O-N 2.84Å; A459-E463 PolarHBondContact O-N 2.68Å
460	R	61.5	Low	53.5	Low	160 Å²	160	120.4 Å²	120.4	60%	0.604	64%	0.638	S	S	*	*	H	α-helix	trans	-78.3	-26.3	179.3	-77.6	175.1	165.1	172.3	-7.2	113.6	K456 N457 E458 M462	K456-R460 WeakPolarHBondContact O-CD 3.26Å; K456-R460 WeakPolarHBondContact O-CG 3.31Å; N457-R460 CarbonylContact O-C 3.51Å; N457-R460 WeakPolarHBondContact O-CA 3.45Å; N457-R460 WeakPolarHBondContact O-CB 3.26Å; N457-R460 PolarHBondContact O-N 3.23Å; E458-R460 VanDerWaalsContact C-N 3.34Å; E458-R460 PolarHBondContact O-N 2.84Å; R460-M462 VanDerWaalsContact C-N 3.33Å
461	E	56.6	Low	53	Low	155 Å²	155	120.8 Å²	120.8	72%	0.724	65%	0.645	S	S	*	*	H	α-helix	trans	-79.7	-16.9	175.9	-70.7	176.6	-172.6	0	0	112	N457 E458	N457-E461 PolarHBondContact O-N 3.29Å; E458-E461 PolarHBondContact O-N 2.87Å
462	M	56.3	Low	52.1	Low	159 Å²	159	118 Å²	118	78%	0.783	65%	0.649	S	S	*	*	H	α-helix	trans	-93.6	-15.7	173.1	-71.8	-163.7	-67.1	0	0	115.7	E458 R460	E458-M462 PolarHBondContact O-N 3.13Å; R460-M462 VanDerWaalsContact C-N 3.33Å
463	E	48.9	Very low	51	Low	172 Å²	172	123.3 Å²	123.3	80%	0.804	67%	0.669	S	S	*	*	S	Bend	trans	-94.6	0.1	-177.8	-74.6	-171.4	150.7	0	0	114.8	A459	A459-E463 PolarHBondContact O-N 2.68Å
464	N	38.4	Very low	49.9	Very low	144 Å²	144	129 Å²	129	77%	0.77	69%	0.689	S	S	*	*	S	Bend	trans	-107.5	8.8	-164.9	-126.4	-9.1	0	0	0	115.4
465	D	38.4	Very low	48.9	Very low	163 Å²	163	128.3 Å²	128.3	87%	0.872	69%	0.689	S	S	*	*			trans	-124	85.1	-173.7	-129.1	-12.2	0	0	0	112.4
466	S	38.5	Very low	47.6	Very low	114 Å²	114	129.7 Å²	129.7	80%	0.797	70%	0.703	S	S	*	*			trans	163.6	129.5	134.6	-170	0	0	0	0	111.9
467	S	41.1	Very low	46.4	Very low	96 Å²	96	132.8 Å²	132.8	67%	0.671	71%	0.712	S	S	*	*			trans	-84.3	-179.4	162.9	67.5	0	0	0	0	110.5
468	D	38.1	Very low	45.1	Very low	147 Å²	147	139.3 Å²	139.3	79%	0.786	73%	0.731	S	S	*	*			cis	-161.5	-175	8	-142.4	-42	0	0	0	111.3
469	S	38.4	Very low	43.8	Very low	97 Å²	97	142.2 Å²	142.2	68%	0.678	74%	0.742	S	S	*	*			trans	73.5	85.2	146.7	-172.8	0	0	0	0	121.1
470	A	39.2	Very low	42.7	Very low	94 Å²	94	145.9 Å²	145.9	78%	0.777	75%	0.754	S	S	*	*				64.2	125.4	111.7	0	0	0	0	0	123.7
471	D	40.6	Very low	41.5	Very low	155 Å²	155	147 Å²	147	83%	0.829	77%	0.766	S	S	*	*				119.5	148.9	117	-151.7	24	0	0	0	120.7
472	S	38.8	Very low	40.7	Very low	101 Å²	101	149.3 Å²	149.3	71%	0.706	77%	0.774	S	S	*	*			trans	81	123.7	161.1	71	0	0	0	0	121.4
473	D	40	Very low	40.1	Very low	169 Å²	169	147.4 Å²	147.4	90%	0.904	77%	0.773	S	S	*	*			trans	-58.4	157.1	177.4	-58.3	-58.9	0	0	0	115.9
474	Y	41.2	Very low	39.6	Very low	197 Å²	197	145.4 Å²	145.4	77%	0.773	78%	0.775	S	S	*	*			trans	-144.4	138.2	161.9	-167	-101.1	0	0	0	114
475	D	47.2	Very low	39.5	Very low	102 Å²	102	150.4 Å²	150.4	55%	0.545	78%	0.783	S	S	.	*			trans	-101.4	124	-170.5	177.4	23.3	0	0	0	112.6	Y477	D475-Y477 PolarHBondContact O-N 2.68Å; D475-Y477 VanDerWaalsContact OD1-CD2 3.28Å; D475-Y477 WeakPolarHBondContact OD1-CD2 3.43Å
476	P	40.3	Very low	39.5	Very low	119 Å²	119	148.7 Å²	148.7	77%	0.773	78%	0.784	S	S	*	*	S	Bend	trans	-76.7	29	-168.4	31.6	-39	0	0	0	116.9
477	Y	42.9	Very low	39.3	Very low	206 Å²	206	146.5 Å²	146.5	81%	0.808	78%	0.78	S	S	*	*			trans	-89.2	9.9	-176.7	-85.4	-64.7	0	0	0	116.8	D475	D475-Y477 PolarHBondContact O-N 2.68Å; D475-Y477 VanDerWaalsContact OD1-CD2 3.28Å; D475-Y477 WeakPolarHBondContact OD1-CD2 3.43Å
478	R	39.8	Very low	39.1	Very low	220 Å²	220	147.7 Å²	147.7	83%	0.83	79%	0.788	S	S	*	*			trans	-101.5	138.7	177.6	-150.2	166.7	-170.6	159.4	2.4	113.2
479	K	33.7	Very low	39	Very low	167 Å²	167	145.1 Å²	145.1	73%	0.726	78%	0.782	S	S	*	*			trans	-119.8	161.5	-166.1	-140.1	-169.4	-176.3	-167	0	110.7
480	D	37	Very low	38.8	Very low	126 Å²	126	146 Å²	146	67%	0.674	78%	0.783	S	S	*	*			trans	67.2	146.3	166.7	-43.4	-39.3	0	0	0	113.9
481	E	36.4	Very low	38.7	Very low	184 Å²	184	146.6 Å²	146.6	86%	0.86	78%	0.782	S	S	*	*			cis	-154.4	170.3	-1.7	-129.3	169.1	-166.4	0	0	110
482	K	39.7	Very low	38.5	Very low	203 Å²	203	143.9 Å²	143.9	88%	0.883	78%	0.775	S	S	*	*			trans	-106.9	142	-178.4	-73.9	-174.7	177.4	-178.6	0	113.8
483	P	43.2	Very low	38.3	Very low	119 Å²	119	147.1 Å²	147.1	77%	0.773	78%	0.776	S	S	*	*			trans	-129.7	-167.3	141.4	44.7	-32.7	0	0	0	110.9
484	P	39.5	Very low	37.9	Very low	131 Å²	131	142.2 Å²	142.2	85%	0.851	76%	0.755	S	S	*	*				-129.3	-168.2	-110.7	29.8	-4.1	0	0	0	116.2
485	R	35.1	Very low	37.5	Very low	248 Å²	248	139 Å²	139	94%	0.936	75%	0.748	S	S	*	*			trans	-90.8	150.6	-169.9	-65.7	171.8	165.8	174.2	-7.2	115.8
486	S	38.1	Very low	36.7	Very low	127 Å²	127	142 Å²	142	89%	0.888	76%	0.758	S	S	*	*			trans	-161.3	150.4	148.3	52.4	0	0	0	0	109.2
487	G	34.8	Very low	36.4	Very low	69 Å²	69	144.2 Å²	144.2	71%	0.711	76%	0.758	S	S	*	*			cis	162.4	155.2	-4.6	0	0	0	0	0	111.1
488	S	36.2	Very low	35.8	Very low	121 Å²	121	139 Å²	139	85%	0.846	75%	0.752	S	S	*	*			trans	65.4	159.1	179.7	-107.9	0	0	0	0	117.2
489	S	36.8	Very low	35.4	Very low	93 Å²	93	135.9 Å²	135.9	65%	0.65	75%	0.752	S	S	*	*			cis	-173.5	-177.7	-31.6	54.3	0	0	0	0	107.6
490	T	34	Very low	35.4	Very low	114 Å²	114	135.3 Å²	135.3	70%	0.699	75%	0.752	S	S	*	*			cis	-160.5	139.8	9.5	-22.8	0	0	0	0	110.8
491	S	37	Very low	35.1	Very low	108 Å²	108	137.7 Å²	137.7	76%	0.755	76%	0.759	S	S	*	*			trans	56	168.3	152.3	76.9	0	0	0	0	120
492	S	37.1	Very low	35.1	Very low	98 Å²	98	137.6 Å²	137.6	69%	0.685	76%	0.755	S	S	*	*			cis	-161.8	144.2	2.9	1.9	0	0	0	0	112
493	K	33.4	Very low	34.7	Very low	168 Å²	168	137.2 Å²	137.2	73%	0.73	76%	0.757	S	S	*	*			trans	48.7	156.7	141.6	-80.9	-157.9	146.3	-109.8	0	122.1	E495	K493-E495 VanDerWaalsContact NZ-CD 3.27Å; K493-E495 IonicContact NZ-OE1 2.68Å; K493-E495 PolarHBondContact NZ-OE1 2.77Å; K493-E495 IonicContact NZ-OE2 3.63Å; K493-E495 PolarHBondContact NZ-OE2 2.75Å
494	S	33	Very low	34.4	Very low	66 Å²	66	136.3 Å²	136.3	46%	0.462	75%	0.753	S	S	.	*			cis	-177.7	165	-23.2	52.2	0	0	0	0	111.9
495	E	32.4	Very low	34.1	Very low	131 Å²	131	135.6 Å²	135.6	61%	0.612	75%	0.752	S	S	*	*			trans	62.5	153.2	149.5	-66.9	129.3	-146.1	0	0	117.6	K493	K493-E495 VanDerWaalsContact NZ-CD 3.27Å; K493-E495 IonicContact NZ-OE1 2.68Å; K493-E495 PolarHBondContact NZ-OE1 2.77Å; K493-E495 IonicContact NZ-OE2 3.63Å; K493-E495 PolarHBondContact NZ-OE2 2.75Å
496	E	31	Very low	34	Very low	163 Å²	163	127.2 Å²	127.2	76%	0.762	74%	0.742	S	S	*	*			cis	-162.5	167.2	-14.8	-114.1	165.9	-173.1	0	0	110.9
497	E	32.5	Very low	33.8	Very low	166 Å²	166	127.6 Å²	127.6	78%	0.776	74%	0.739	S	S	*	*			trans	41.6	125.5	150.9	-61.3	-151.5	161.7	0	0	122.9
498	S	31.6	Very low	33.8	Very low	97 Å²	97	133 Å²	133	68%	0.678	75%	0.746	S	S	*	*				87	160.5	94.1	90.2	0	0	0	0	113.5
499	D	31	Very low	33.7	Very low	155 Å²	155	131.6 Å²	131.6	83%	0.829	74%	0.736	S	S	*	*			cis	-157.3	-166.3	-16	-139.3	-37.1	0	0	0	110.1
500	E	34.1	Very low	33.5	Very low	155 Å²	155	134.4 Å²	134.4	72%	0.724	74%	0.744	S	S	*	*			trans	86.9	151.9	160.5	-69.9	-148.3	-173.9	0	0	121.7	K502	E500-K502 IonicContact OE2-NZ 2.75Å; E500-K502 PolarHBondContact OE2-NZ 2.86Å
501	E	30.8	Very low	33.3	Very low	176 Å²	176	133.1 Å²	133.1	82%	0.822	75%	0.745	S	S	*	*			trans	-111.7	169.6	-171.9	-45.7	170.5	135.5	0	0	111.8
502	K	36.1	Very low	33	Very low	182 Å²	182	137 Å²	137	79%	0.791	75%	0.751	S	S	*	*				-172.8	151.8	128.6	-100	141.8	-157.8	131.1	0	115	E500	E500-K502 IonicContact OE2-NZ 2.75Å; E500-K502 PolarHBondContact OE2-NZ 2.86Å
503	E	30.2	Very low	32.6	Very low	194 Å²	194	140.3 Å²	140.3	91%	0.907	76%	0.755	S	S	*	*			trans	-100	160.9	178	-53.2	-178.4	123.4	0	0	112.9
504	S	37	Very low	32.5	Very low	101 Å²	101	136.6 Å²	136.6	71%	0.706	75%	0.751	S	S	*	*			trans	-168.7	119.8	147.9	-172.3	0	0	0	0	107.2
505	S	33.6	Very low	32.4	Very low	116 Å²	116	139.7 Å²	139.7	81%	0.811	76%	0.762	S	S	*	*				53.5	132	73.7	99.3	0	0	0	0	113.5
506	G	34.2	Very low	32.4	Very low	71 Å²	71	140.8 Å²	140.8	73%	0.732	77%	0.765	S	S	*	*			cis	-166	-163.4	-1.6	0	0	0	0	0	107.9
507	T	34	Very low	32.4	Very low	135 Å²	135	139.3 Å²	139.3	83%	0.828	76%	0.758	S	S	*	*			cis	-158.3	-175.5	-0.2	-55.9	0	0	0	0	107.9
508	E	33.6	Very low	32.4	Very low	183 Å²	183	139.3 Å²	139.3	86%	0.855	76%	0.755	S	S	*	*			trans	-74.2	-174.5	-179.4	-52.7	151.7	146.1	0	0	112.7
509	S	34.2	Very low	32.5	Very low	92 Å²	92	146.7 Å²	146.7	64%	0.643	77%	0.769	S	S	*	*			cis	-162.7	167.5	14.3	74.2	0	0	0	0	115.4
510	D	31.8	Very low	32.8	Very low	151 Å²	151	144.5 Å²	144.5	81%	0.807	77%	0.765	S	S	*	*			trans	61	159.9	141.7	-57.3	-33.3	0	0	0	127.6
511	A	31.1	Very low	33.1	Very low	87 Å²	87	143 Å²	143	72%	0.719	77%	0.769	S	S	*	*			trans	71	121.8	163.6	0	0	0	0	0	118.5
512	E	30.3	Very low	33.6	Very low	189 Å²	189	139.8 Å²	139.8	88%	0.883	77%	0.766	S	S	*	*				68.3	141.3	76.2	-68.1	-174.7	177	0	0	113.6
513	E	29.2	Very low	33.9	Very low	168 Å²	168	136.2 Å²	136.2	79%	0.785	76%	0.761	S	S	*	*			cis	-155.1	174.9	4.2	-149.4	-150.1	135.4	0	0	111.2
514	S	30.6	Very low	34.5	Very low	91 Å²	91	135.3 Å²	135.3	64%	0.636	76%	0.757	S	S	*	*			trans	68.7	107.9	147.5	72.6	0	0	0	0	123.6
515	D	30.5	Very low	34.8	Very low	131 Å²	131	141 Å²	141	70%	0.701	76%	0.763	S	S	*	*				75.6	155	108.4	-147.3	13.7	0	0	0	124.9
516	K	33.1	Very low	35.1	Very low	154 Å²	154	140.9 Å²	140.9	67%	0.67	76%	0.759	S	S	*	*			trans	75.6	102	157.6	-79.7	169.3	-175.5	91.3	0	124.5
517	E	30.5	Very low	35.2	Very low	131 Å²	131	142 Å²	142	61%	0.612	76%	0.761	S	S	*	*				81.3	113.6	115.9	-72.4	-167.6	134.4	0	0	125.2
518	K	32.9	Very low	35.4	Very low	166 Å²	166	144.4 Å²	144.4	72%	0.722	76%	0.761	S	S	*	*				55.2	124.6	122.1	-59.8	170	-177.1	166	0	120.7
519	R	33.6	Very low	35.5	Very low	253 Å²	253	146.8 Å²	146.8	96%	0.955	76%	0.762	S	S	*	*				-164.9	156.5	107.9	-102.4	155.6	-171.7	-150.1	1.4	113.3
520	S	37.4	Very low	35.5	Very low	109 Å²	109	149.9 Å²	149.9	76%	0.762	77%	0.766	S	S	*	*			trans	-120.2	179.5	179.3	65	0	0	0	0	109.7
521	P	40.2	Very low	35.8	Very low	122 Å²	122	150.1 Å²	150.1	79%	0.792	77%	0.766	S	S	*	*				-149.3	-175.5	67.3	38.8	-16.6	0	0	0	116.6
522	S	41.2	Very low	36.1	Very low	109 Å²	109	151.2 Å²	151.2	76%	0.762	77%	0.768	S	S	*	*			trans	-93.4	-169.8	-179.8	-45	0	0	0	0	113.8
523	P	43.8	Very low	36.2	Very low	108 Å²	108	147.8 Å²	147.8	70%	0.701	77%	0.766	S	S	*	*				-148	147.9	104.8	38.7	-23.6	0	0	0	117.7
524	H	42.4	Very low	36.5	Very low	174 Å²	174	144.7 Å²	144.7	81%	0.806	76%	0.763	S	S	*	*			trans	50.6	146.4	137.2	-66.7	-31.3	0	0	0	123
525	R	42.7	Very low	36.6	Very low	222 Å²	222	146.5 Å²	146.5	84%	0.838	77%	0.765	S	S	*	*			cis	-160	-172	-8.4	-131.5	-167.4	160.9	-168.2	-2.5	109.6
526	P	39	Very low	36.6	Very low	112 Å²	112	148 Å²	148	73%	0.727	77%	0.768	S	S	*	*				-124.8	179.8	-125.5	42.4	-23.2	0	0	0	117.4
527	A	37	Very low	36.4	Very low	95 Å²	95	146.1 Å²	146.1	79%	0.785	76%	0.762	S	S	*	*			trans	-94.8	-173.8	177.8	0	0	0	0	0	114.3
528	K	38.1	Very low	36.3	Very low	186 Å²	186	147 Å²	147	81%	0.809	76%	0.763	S	S	*	*			trans	-163.1	152.6	150.6	-120	176	-176	-175.6	0	114.9
529	R	36.4	Very low	36.1	Very low	233 Å²	233	146.9 Å²	146.9	88%	0.879	76%	0.763	S	S	*	*			trans	70.1	101.3	-177	-67.6	-179.2	160.5	165.4	-6.5	113.7
530	E	34.8	Very low	36	Very low	156 Å²	156	142.5 Å²	142.5	73%	0.729	76%	0.755	S	S	*	*			cis	69.3	138.4	31	-47.5	177.9	-169.9	0	0	114.6
531	L	36.7	Very low	35.9	Very low	157 Å²	157	142.5 Å²	142.5	82%	0.822	75%	0.752	S	S	*	*			cis	-155.1	169.3	-12.7	-133	76.5	0	0	0	105
532	S	37.5	Very low	35.8	Very low	109 Å²	109	141.6 Å²	141.6	76%	0.762	75%	0.746	S	S	*	*			cis	-153.7	143.8	19.9	45.7	0	0	0	0	114.4
533	S	33.8	Very low	35.4	Very low	118 Å²	118	145.8 Å²	145.8	83%	0.825	75%	0.751	S	S	*	*			trans	-159.3	139.6	167.7	54.6	0	0	0	0	107.9
534	S	33.7	Very low	34.7	Very low	103 Å²	103	150 Å²	150	72%	0.72	76%	0.758	S	S	*	*			trans	-171.7	139.7	-179.3	134.9	0	0	0	0	108.9
535	D	33.4	Very low	34.4	Very low	128 Å²	128	150.4 Å²	150.4	68%	0.684	76%	0.763	S	S	*	*			cis	-143.4	152.1	-13.6	-70.9	-51.6	0	0	0	106.7
536	E	30.1	Very low	33.8	Very low	162 Å²	162	145.3 Å²	145.3	76%	0.757	76%	0.756	S	S	*	*				63.2	146.7	52.8	-78.8	-157.7	172.2	0	0	115
537	E	29.3	Very low	33.5	Very low	116 Å²	116	149.4 Å²	149.4	54%	0.542	76%	0.763	S	S	.	*			cis	-175	157.2	-34.4	-126.3	-163.1	146.7	0	0	110.3
538	K	28.9	Very low	33.3	Very low	149 Å²	149	154.3 Å²	154.3	65%	0.648	77%	0.766	S	S	*	*			trans	62.1	165.4	154.8	-66.9	163.6	177.5	145.2	0	116.2
539	K	28.4	Very low	32.9	Very low	163 Å²	163	152 Å²	152	71%	0.709	77%	0.767	S	S	*	*			cis	-162.5	133.9	-18.2	-112.3	173	179.7	-176.3	0	110.7
540	M	31.3	Very low	32.5	Very low	162 Å²	162	152.6 Å²	152.6	80%	0.798	77%	0.77	S	S	*	*			trans	65.4	166.3	141.8	-68.4	179.6	73.9	0	0	121
541	P	35.9	Very low	32.3	Very low	108 Å²	108	154.3 Å²	154.3	70%	0.701	78%	0.778	S	S	*	*			cis	-125.5	-128.5	-24.9	30.6	-5.7	0	0	0	114.2
542	P	38.5	Very low	32.1	Very low	103 Å²	103	152.1 Å²	152.1	67%	0.669	78%	0.775	S	S	*	*				-133.7	-176.3	-119.8	43.2	-22.5	0	0	0	118.8
543	K	32	Very low	31.9	Very low	198 Å²	198	151.1 Å²	151.1	86%	0.861	77%	0.774	S	S	*	*			trans	94.5	149.1	176.4	-61.5	171.6	-179	175.5	0	114
544	K	28.7	Very low	31.7	Very low	196 Å²	196	150 Å²	150	85%	0.852	78%	0.781	S	S	*	*			cis	166	120.4	-27.3	-120.2	-170.9	178.5	-176.6	0	105
545	M	36.1	Very low	31.6	Very low	182 Å²	182	148.7 Å²	148.7	90%	0.897	78%	0.777	S	S	*	*			trans	154.1	140.3	152.1	-91.4	-174.5	162.1	0	0	110.3
546	T	30.3	Very low	31.6	Very low	115 Å²	115	148.9 Å²	148.9	71%	0.706	78%	0.777	S	S	*	*			cis	168.2	121.7	-33.2	28	0	0	0	0	107.3
547	K	33.7	Very low	31.8	Very low	199 Å²	199	153.1 Å²	153.1	87%	0.865	79%	0.786	S	S	*	*			trans	-162.7	110.5	144.1	-114.2	163.8	-172.9	171.8	0	112.3
548	K	31.5	Very low	32.1	Very low	197 Å²	197	151.2 Å²	151.2	86%	0.857	79%	0.786	S	S	*	*			trans	39.8	87.6	158	-58.9	-176.8	179.4	-178	0	116.1
549	V	30.2	Very low	32.3	Very low	137 Å²	137	147.7 Å²	147.7	83%	0.83	79%	0.792	S	S	*	*				59.4	103.2	61.3	-171.1	0	0	0	0	114.3
550	R	28.6	Very low	32.5	Very low	246 Å²	246	151.4 Å²	151.4	93%	0.928	80%	0.802	S	S	*	*			trans	-153.9	73.5	134.4	-139.2	176.5	-169.1	176.8	4.8	112.2
551	Q	30.7	Very low	32.8	Very low	192 Å²	192	153 Å²	153	90%	0.897	80%	0.804	S	S	*	*			trans	-73.6	139.3	160	-71.6	172.9	-28.5	0	0	109
552	S	32	Very low	33.1	Very low	111 Å²	111	159.3 Å²	159.3	78%	0.776	81%	0.814	S	S	*	*			trans	-154.4	131.4	161.3	59.7	0	0	0	0	109.4
553	A	32.7	Very low	33.3	Very low	89 Å²	89	163.5 Å²	163.5	74%	0.736	82%	0.824	S	S	*	*			trans	-32.9	143.7	-175.1	0	0	0	0	0	116.9	A555	A553-A555 PolarHBondContact O-N 3.48Å
554	G	29.4	Very low	34.1	Very low	94 Å²	94	162.5 Å²	162.5	97%	0.969	82%	0.82	S	S	*	*			trans	-65.1	87.3	153.1	0	0	0	0	0	109.1
555	A	32.9	Very low	35.7	Very low	76 Å²	76	156.6 Å²	156.6	63%	0.628	80%	0.798	S	S	*	*			trans	-100.9	141.2	172.1	0	0	0	0	0	109.9	A553	A553-A555 PolarHBondContact O-N 3.48Å
556	D	31.9	Very low	37.4	Very low	131 Å²	131	152.1 Å²	152.1	70%	0.701	80%	0.798	S	S	*	*			trans	-36.3	136	176.2	178.1	25	0	0	0	114.6	S558	D556-S558 WeakPolarHBondContact OD1-CB 3.22Å; D556-S558 PolarHBondContact OD1-N 2.82Å; D556-S558 WeakPolarHBondContact OD2-CB 3.45Å; D556-S558 PolarHBondContact OD2-OG 3.27Å
557	R	35.2	Very low	39.6	Very low	251 Å²	251	152.2 Å²	152.2	95%	0.947	79%	0.794	S	S	*	*			trans	-103	20.6	173.7	-74.7	-169.7	176.5	-177.5	1.8	113
558	S	36.1	Very low	41.7	Very low	77 Å²	77	144.5 Å²	144.5	54%	0.538	77%	0.768	S	S	.	*	S	Bend	trans	-58.7	154.8	163.6	81.5	0	0	0	0	111.4	D556 R560	D556-S558 WeakPolarHBondContact OD1-CB 3.22Å; D556-S558 PolarHBondContact OD1-N 2.82Å; D556-S558 WeakPolarHBondContact OD2-CB 3.45Å; D556-S558 PolarHBondContact OD2-OG 3.27Å; S558-R560 VanDerWaalsContact C-N 3.3Å; S558-R560 PolarHBondContact O-N 2.85Å
559	G	32.4	Very low	44.2	Very low	74 Å²	74	136.2 Å²	136.2	76%	0.763	73%	0.734	S	S	*	*			trans	-80.6	44.7	-158.6	0	0	0	0	0	116.8	K561	G559-K561 PolarHBondContact O-N 2.79Å
560	R	33.4	Very low	46.8	Very low	242 Å²	242	138 Å²	138	91%	0.913	73%	0.73	S	S	*	*			trans	-69.3	85.5	170	-155	172.5	-166.2	173.5	4.6	109	S558 R562	S558-R560 VanDerWaalsContact C-N 3.3Å; S558-R560 PolarHBondContact O-N 2.85Å; R560-R562 PolarHBondContact O-N 3.23Å
561	K	36.2	Very low	49.6	Very low	196 Å²	196	134 Å²	134	85%	0.852	72%	0.72	S	S	*	*			trans	-45.8	113.2	176.5	-70.9	174.1	-176.9	164.2	0	108	G559 Q563	G559-K561 PolarHBondContact O-N 2.79Å; K561-Q563 PolarHBondContact O-N 2.83Å
562	R	42.1	Very low	52.5	Low	240 Å²	240	127.2 Å²	127.2	91%	0.906	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-49	120.1	168.3	-80.8	-174.8	167.8	-162.7	-6.3	107.1	R560 K564	R560-R562 PolarHBondContact O-N 3.23Å; R562-K564 PolarHBondContact O-N 3.27Å
563	Q	43.3	Very low	55.2	Low	191 Å²	191	123.9 Å²	123.9	89%	0.893	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-53.5	120.3	168.6	-77.3	176.6	-26.2	0	0	106	K561	K561-Q563 PolarHBondContact O-N 2.83Å
564	K	49.4	Very low	57.9	Low	177 Å²	177	122.6 Å²	122.6	77%	0.77	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-67.1	138.4	166.5	-71.7	-178.7	178	177.7	0	106.1	R562 G566	R562-K564 PolarHBondContact O-N 3.27Å; K564-G566 PolarHBondContact O-N 3.04Å
565	D	62.4	Low	60.8	Low	72 Å²	72	118.8 Å²	118.8	39%	0.385	61%	0.61	S	S	.	*	P	Polyproline II helix	trans	-48.7	126.7	162.6	-170.5	-38.4	0	0	0	108.3	N567 A568 Y632 Q636	D565-N567 PolarHBondContact O-N 2.96Å; D565-N567 VanDerWaalsContact OD1-CB 3.27Å; D565-N567 WeakPolarHBondContact OD1-CB 3.41Å; D565-N567 PolarHBondContact OD1-N 2.89Å; D565-A568 HydrophobicContact CB-CB 4.19Å; D565-A568 WeakPolarHBondContact O-CB 3.28Å; D565-A568 PolarHBondContact O-N 2.77Å; D565-A568 VanDerWaalsContact O-N 3.12Å; D565-Y632 WeakPolarHBondContact CB-OH 3.3Å; D565-Y632 PolarHBondContact OD2-OH 2.86Å; D565-Q636 PolarHBondContact OD2-NE2 3.4Å
566	G	72.3	Confident	63.5	Low	87 Å²	87	118.3 Å²	118.3	90%	0.897	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	-22.3	-177.8	0	0	0	0	0	112.7	K564	K564-G566 PolarHBondContact O-N 3.04Å
567	N	74.6	Confident	66.2	Low	117 Å²	117	114.2 Å²	114.2	63%	0.626	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	-7.3	178.8	-158.3	35.6	0	0	0	113	D565 Y632	D565-N567 PolarHBondContact O-N 2.96Å; D565-N567 VanDerWaalsContact OD1-CB 3.27Å; D565-N567 WeakPolarHBondContact OD1-CB 3.41Å; D565-N567 PolarHBondContact OD1-N 2.89Å; N567-Y632 HydrophobicContact CB-CE2 4.28Å; N567-Y632 WeakPolarHBondContact O-CD2 3.38Å
568	A	78.8	Confident	68.8	Low	38 Å²	38	103.5 Å²	103.5	31%	0.314	53%	0.533	S	S	.	.	S	Bend	trans	-68.5	127.4	-178.3	0	0	0	0	0	112.4	D565 Y632	D565-A568 HydrophobicContact CB-CB 4.19Å; D565-A568 WeakPolarHBondContact O-CB 3.28Å; D565-A568 PolarHBondContact O-N 2.77Å; D565-A568 VanDerWaalsContact O-N 3.12Å; A568-Y632 VanDerWaalsContact CA-CE2 3.45Å; A568-Y632 HydrophobicContact CB-CE2 4.01Å
569	P	84.3	Confident	71.5	Confident	22 Å²	22	100.3 Å²	100.3	14%	0.143	51%	0.509	C	S	.	.			trans	-51	138.5	-179.3	-32.2	37.3	0	0	0	114.5	K571 Y625 E628 M629 Y632	P569-K571 PolarHBondContact O-N 2.66Å; P569-Y625 HydrophobicContact CB-CD2 3.96Å; P569-Y625 HydrophobicContact CB-CE2 3.93Å; P569-E628 HydrophobicContact CB-CB 3.79Å; P569-E628 HydrophobicContact CG-CB 3.74Å; P569-E628 WeakPolarHBondContact CG-O 3.4Å; P569-M629 HydrophobicContact CB-CG 4.28Å; P569-M629 HydrophobicContact CB-SD 4.06Å; P569-M629 HydrophobicContact CG-CG 4.32Å; P569-M629 HydrophobicContact CG-SD 3.92Å; P569-Y632 HydrophobicContact CG-CG 4.28Å
570	K	84.8	Confident	74.2	Confident	174 Å²	174	99 Å²	99	76%	0.757	48%	0.484	S	S	*	.			trans	-76.5	116	180	-72.8	172.5	-175.8	162.8	0	109.6	R624 Y625	K570-R624 PolarHBondContact O-NH2 3.11Å; K570-Y625 WeakPolarHBondContact O-CD2 3.25Å
571	K	87.6	Confident	76.8	Confident	163 Å²	163	95.2 Å²	95.2	71%	0.709	47%	0.47	S	S	*	.			trans	-39.9	140.4	178.2	-72.3	-165.2	174.4	-166.7	0	112.8	P569 Y625	P569-K571 PolarHBondContact O-N 2.66Å; K571-Y625 HydrophobicContact CG-CE2 4.36Å
572	P	90.1	Very high	79.3	Confident	49 Å²	49	88.6 Å²	88.6	32%	0.318	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-70.1	146.4	-169.9	29.9	-33.6	0	0	0	111.4	D621 R622 Y625	P572-D621 VanDerWaalsContact CA-OD2 3.25Å; P572-D621 WeakPolarHBondContact CA-OD2 3.11Å; P572-R622 HydrophobicContact CB-CG 4.04Å; P572-R622 HydrophobicContact CG-CG 4.2Å; P572-Y625 HydrophobicContact CB-CG 4.36Å; P572-Y625 HydrophobicContact CG-CD1 4.05Å; P572-Y625 HydrophobicContact CG-CG 4.1Å
573	Q	88.4	Confident	81.5	Confident	41 Å²	41	79.3 Å²	79.3	19%	0.192	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-80.8	142.5	-177.8	-48.7	-134.1	-80.7	0	0	110.9	V577 L578 R581 D621	Q573-V577 HydrophobicContact CB-CB 4.49Å; Q573-V577 HydrophobicContact CB-CG1 4.46Å; Q573-V577 VanDerWaalsContact NE2-CG1 3.33Å; Q573-L578 HydrophobicContact CB-CD1 4.02Å; Q573-L578 HydrophobicContact CB-CD2 3.99Å; Q573-L578 HydrophobicContact CB-CG 3.71Å; Q573-L578 HydrophobicContact CG-CD2 4.33Å; Q573-R581 VanDerWaalsContact CD-NH1 3.35Å; Q573-D621 WeakPolarHBondContact CG-OD2 3.18Å; Q573-D621 PolarHBondContact N-OD2 3.34Å
574	S	89.9	Confident	83.4	Confident	62 Å²	62	75.5 Å²	75.5	43%	0.434	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-80.6	158.7	168.4	68	0	0	0	0	110.9	Y576 V577 L578	S574-Y576 PolarHBondContact O-N 2.98Å; S574-V577 PolarHBondContact O-N 3.03Å; S574-V577 WeakPolarHBondContact OG-CG2 3.34Å; S574-L578 PolarHBondContact O-N 2.86Å; S574-L578 VanDerWaalsContact O-N 3.07Å
575	A	90.6	Very high	85	Confident	15 Å²	15	73 Å²	73	12%	0.124	39%	0.393	C	S	.	.	H	α-helix	trans	-50.3	-41.2	176.7	0	0	0	0	0	112.4	L578 W579 W605 W614 E615 A618	A575-L578 PolarHBondContact O-N 3.38Å; A575-W579 WeakPolarHBondContact O-CB 3.49Å; A575-W579 PolarHBondContact O-N 2.93Å; A575-W605 HydrophobicContact CB-CH2 3.96Å; A575-W605 HydrophobicContact CB-CZ2 3.98Å; A575-W614 HydrophobicContact CB-CB 3.81Å; A575-W614 WeakPolarHBondContact CB-O 3.33Å; A575-E615 HydrophobicContact CB-CG 4.24Å; A575-A618 HydrophobicContact CB-CB 4.26Å
576	Y	89.6	Confident	86	Confident	66 Å²	66	78 Å²	78	26%	0.259	41%	0.411	S	S	.	.	H	α-helix	trans	-61.2	-42.3	174.7	175.4	-118.4	0	0	0	113.4	S574 W579 M580 A601 G602 W605	S574-Y576 PolarHBondContact O-N 2.98Å; Y576-W579 AromaticContact CD2-CE3 3.94Å; Y576-W579 HydrophobicContact CD2-CE3 3.94Å; Y576-W579 HydrophobicContact CD2-CZ3 4.27Å; Y576-W579 AromaticContact CE2-CE3 3.98Å; Y576-W579 HydrophobicContact CE2-CE3 3.98Å; Y576-W579 AromaticContact CE2-CZ3 3.85Å; Y576-W579 HydrophobicContact CE2-CZ3 3.85Å; Y576-M580 HydrophobicContact CE2-CB 4.44Å; Y576-M580 WeakPolarHBondContact O-CB 3.49Å; Y576-M580 PolarHBondContact O-N 2.87Å; Y576-A601 HydrophobicContact CE2-CB 4.47Å; Y576-G602 PolarHBondContact OH-N 2.98Å; Y576-W605 HydrophobicContact CD2-CB 3.64Å; Y576-W605 AromaticContact CD2-CD1 3.6Å; Y576-W605 AromaticContact CD2-CD2 3.87Å; Y576-W605 HydrophobicContact CD2-CD2 3.87Å; Y576-W605 AromaticContact CD2-CG 3.4Å; Y576-W605 HydrophobicContact CD2-CG 3.4Å; Y576-W605 HydrophobicContact CE2-CB 3.72Å; Y576-W605 HydrophobicContact CE2-CG 4.01Å; Y576-W605 HydrophobicContact CG-CG 4.34Å
577	V	89.4	Confident	86.4	Confident	45 Å²	45	74.1 Å²	74.1	27%	0.273	37%	0.369	S	S	.	.	H	α-helix	trans	-70.8	-35.1	-179.3	176.2	0	0	0	0	111.2	Q573 S574 R581	Q573-V577 HydrophobicContact CB-CB 4.49Å; Q573-V577 HydrophobicContact CB-CG1 4.46Å; Q573-V577 VanDerWaalsContact NE2-CG1 3.33Å; S574-V577 PolarHBondContact O-N 3.03Å; S574-V577 WeakPolarHBondContact OG-CG2 3.34Å; V577-R581 WeakPolarHBondContact O-CB 3.18Å; V577-R581 VanDerWaalsContact O-CG 3.31Å; V577-R581 WeakPolarHBondContact O-CG 3.44Å; V577-R581 PolarHBondContact O-N 2.85Å
578	L	89.9	Confident	86.7	Confident	25 Å²	25	74.6 Å²	74.6	13%	0.131	37%	0.366	C	S	.	.	H	α-helix	trans	-68.2	-46.4	175	-69.7	156.5	0	0	0	111.4	Q573 S574 A575 R581 A582 W614 L617 A618	Q573-L578 HydrophobicContact CB-CD1 4.02Å; Q573-L578 HydrophobicContact CB-CD2 3.99Å; Q573-L578 HydrophobicContact CB-CG 3.71Å; Q573-L578 HydrophobicContact CG-CD2 4.33Å; S574-L578 PolarHBondContact O-N 2.86Å; S574-L578 VanDerWaalsContact O-N 3.07Å; A575-L578 PolarHBondContact O-N 3.38Å; L578-R581 PolarHBondContact O-N 2.63Å; L578-A582 PolarHBondContact O-N 2.64Å; L578-W614 HydrophobicContact CB-CE3 4.04Å; L578-W614 HydrophobicContact CB-CZ3 4.49Å; L578-L617 HydrophobicContact CD1-CB 4.04Å; L578-A618 HydrophobicContact CD1-CB 3.87Å
579	W	92.7	Very high	86.7	Confident	10 Å²	10	77.9 Å²	77.9	4%	0.038	38%	0.375	C	S	.	.	H	α-helix	trans	-61.5	-48.1	173.5	172.4	82.9	0	0	0	111.7	A575 Y576 R581 A582 N583 I587 A601 L604 W605 V608 W614	A575-W579 WeakPolarHBondContact O-CB 3.49Å; A575-W579 PolarHBondContact O-N 2.93Å; Y576-W579 AromaticContact CD2-CE3 3.94Å; Y576-W579 HydrophobicContact CD2-CE3 3.94Å; Y576-W579 HydrophobicContact CD2-CZ3 4.27Å; Y576-W579 AromaticContact CE2-CE3 3.98Å; Y576-W579 HydrophobicContact CE2-CE3 3.98Å; Y576-W579 AromaticContact CE2-CZ3 3.85Å; Y576-W579 HydrophobicContact CE2-CZ3 3.85Å; W579-R581 VanDerWaalsContact C-N 3.31Å; W579-R581 PolarHBondContact O-N 2.78Å; W579-A582 PolarHBondContact O-N 3.09Å; W579-N583 HydrophobicContact CD2-CB 4.5Å; W579-N583 HydrophobicContact CZ2-CB 4.12Å; W579-N583 PolarHBondContact NE1-ND2 2.97Å; W579-N583 WeakPolarHBondContact O-CB 3.37Å; W579-N583 PolarHBondContact O-N 3.47Å; W579-I587 HydrophobicContact CH2-CD1 3.69Å; W579-I587 HydrophobicContact CZ2-CD1 4.3Å; W579-I587 HydrophobicContact CZ3-CD1 4.25Å; W579-A601 HydrophobicContact CH2-CB 4.39Å; W579-A601 WeakPolarHBondContact CH2-O 3.26Å; W579-A601 HydrophobicContact CZ3-CB 3.99Å; W579-A601 WeakPolarHBondContact CZ3-O 3.28Å; W579-L604 HydrophobicContact CH2-CB 3.61Å; W579-L604 HydrophobicContact CZ2-CB 3.91Å; W579-W605 HydrophobicContact CB-CE3 3.85Å; W579-W605 HydrophobicContact CB-CH2 4.46Å; W579-W605 HydrophobicContact CB-CZ3 3.59Å; W579-W605 AromaticContact CD1-CZ3 4Å; W579-W605 HydrophobicContact CD2-CD2 4.49Å; W579-W605 AromaticContact CD2-CE3 3.56Å; W579-W605 HydrophobicContact CD2-CE3 3.56Å; W579-W605 HydrophobicContact CD2-CZ3 4.15Å; W579-W605 HydrophobicContact CE3-CB 4.06Å; W579-W605 HydrophobicContact CE3-CD2 4.38Å; W579-W605 AromaticContact CE3-CE3 3.86Å; W579-W605 HydrophobicContact CE3-CE3 3.86Å; W579-W605 HydrophobicContact CE3-CG 4.5Å; W579-W605 AromaticContact CG-CE3 3.53Å; W579-W605 HydrophobicContact CG-CE3 3.53Å; W579-W605 AromaticContact CG-CZ3 3.6Å; W579-W605 HydrophobicContact CG-CZ3 3.6Å; W579-W605 HydrophobicContact CH2-CB 4.31Å; W579-W605 HydrophobicContact CZ3-CB 3.87Å; W579-V608 HydrophobicContact CZ2-CG2 4.27Å; W579-W614 HydrophobicContact CB-CD2 3.73Å; W579-W614 HydrophobicContact CB-CE3 4Å; W579-W614 HydrophobicContact CB-CG 3.99Å; W579-W614 HydrophobicContact CB-CZ2 4.48Å; W579-W614 HydrophobicContact CB-CZ3 4.48Å; W579-W614 AromaticContact CD1-CE2 3.61Å; W579-W614 AromaticContact CD1-CZ2 3.86Å; W579-W614 AromaticContact CD1-NE1 3.56Å; W579-W614 HydrophobicContact CG-CD2 4.42Å
580	M	88.5	Confident	86.1	Confident	47 Å²	47	86.1 Å²	86.1	23%	0.232	41%	0.411	C	S	.	.	H	α-helix	trans	-62.5	-38.3	-179.6	-175	-86.3	-76.3	0	0	111.2	Y576 A582 N583 R584 A601	Y576-M580 HydrophobicContact CE2-CB 4.44Å; Y576-M580 WeakPolarHBondContact O-CB 3.49Å; Y576-M580 PolarHBondContact O-N 2.87Å; M580-A582 PolarHBondContact O-N 3.12Å; M580-N583 PolarHBondContact O-N 2.8Å; M580-R584 WeakPolarHBondContact O-CA 3.41Å; M580-R584 VanDerWaalsContact O-CB 3.28Å; M580-R584 WeakPolarHBondContact O-CB 3.47Å; M580-R584 PolarHBondContact O-N 3.35Å; M580-A601 HydrophobicContact CG-CB 4.13Å
581	R	87.4	Confident	85.6	Confident	162 Å²	162	82 Å²	82	61%	0.611	42%	0.418	S	S	*	.	H	α-helix	trans	-59.2	-42.7	171.7	-83.7	174.8	159	-155.5	-16.4	113	Q573 V577 L578 W579	Q573-R581 VanDerWaalsContact CD-NH1 3.35Å; V577-R581 WeakPolarHBondContact O-CB 3.18Å; V577-R581 VanDerWaalsContact O-CG 3.31Å; V577-R581 WeakPolarHBondContact O-CG 3.44Å; V577-R581 PolarHBondContact O-N 2.85Å; L578-R581 PolarHBondContact O-N 2.63Å; W579-R581 VanDerWaalsContact C-N 3.31Å; W579-R581 PolarHBondContact O-N 2.78Å
582	A	88.9	Confident	85.1	Confident	58 Å²	58	76.3 Å²	76.3	48%	0.479	40%	0.395	S	S	.	.	H	α-helix	trans	-77.9	-23.5	-179.3	0	0	0	0	0	114	L578 W579 M580 W614	L578-A582 PolarHBondContact O-N 2.64Å; W579-A582 PolarHBondContact O-N 3.09Å; M580-A582 PolarHBondContact O-N 3.12Å; A582-W614 HydrophobicContact CB-CH2 3.51Å; A582-W614 HydrophobicContact CB-CZ3 3.95Å
583	N	88.2	Confident	84.6	Confident	45 Å²	45	76.5 Å²	76.5	24%	0.241	40%	0.397	C	S	.	.	H	α-helix	trans	-105	-8.8	-177.9	-80.8	51.3	0	0	0	113.9	W579 M580 D585 K586 I587	W579-N583 HydrophobicContact CD2-CB 4.5Å; W579-N583 HydrophobicContact CZ2-CB 4.12Å; W579-N583 PolarHBondContact NE1-ND2 2.97Å; W579-N583 WeakPolarHBondContact O-CB 3.37Å; W579-N583 PolarHBondContact O-N 3.47Å; M580-N583 PolarHBondContact O-N 2.8Å; N583-D585 VanDerWaalsContact C-N 3.3Å; N583-D585 PolarHBondContact O-N 3.36Å; N583-K586 WeakPolarHBondContact O-CA 3.23Å; N583-K586 WeakPolarHBondContact O-CB 3.18Å; N583-K586 PolarHBondContact O-N 2.6Å; N583-I587 HydrophobicContact CB-CD1 3.94Å; N583-I587 WeakPolarHBondContact O-CG1 3.3Å; N583-I587 PolarHBondContact O-N 2.78Å; N583-I587 VanDerWaalsContact O-N 3.14Å
584	R	83.1	Confident	84.1	Confident	111 Å²	111	82.1 Å²	82.1	42%	0.419	42%	0.422	S	S	.	.	H	α-helix	trans	-50.2	-48.5	-174	-174.2	-179.8	-175.9	-160.4	-0.6	112.8	M580 K586 I587 K588	M580-R584 WeakPolarHBondContact O-CA 3.41Å; M580-R584 VanDerWaalsContact O-CB 3.28Å; M580-R584 WeakPolarHBondContact O-CB 3.47Å; M580-R584 PolarHBondContact O-N 3.35Å; R584-K586 PolarHBondContact O-N 3.01Å; R584-I587 CarbonylContact O-C 3.59Å; R584-I587 PolarHBondContact O-N 2.85Å; R584-K588 WeakPolarHBondContact O-CB 3.37Å; R584-K588 PolarHBondContact O-N 3.22Å
585	D	83.2	Confident	83.7	Confident	125 Å²	125	82.2 Å²	82.2	67%	0.668	43%	0.426	S	S	*	.	H	α-helix	trans	-76.3	-11.1	-174.3	-48.9	-50.6	0	0	0	112.6	N583	N583-D585 VanDerWaalsContact C-N 3.3Å; N583-D585 PolarHBondContact O-N 3.36Å
586	K	82.6	Confident	83.3	Confident	176 Å²	176	85.9 Å²	85.9	77%	0.765	44%	0.44	S	S	*	.	H	α-helix	trans	-91	-12.3	167.5	-56.9	-172.7	178.2	-171.3	0	113.4	N583 R584	N583-K586 WeakPolarHBondContact O-CA 3.23Å; N583-K586 WeakPolarHBondContact O-CB 3.18Å; N583-K586 PolarHBondContact O-N 2.6Å; R584-K586 PolarHBondContact O-N 3.01Å
587	I	81.7	Confident	83.1	Confident	5 Å²	5	83.3 Å²	83.3	3%	0.026	43%	0.431	C	S	.	.	H	α-helix	trans	-101.9	-26.9	179.2	-63.5	166.7	0	0	0	110.5	W579 N583 R584 E589 M592 I597 K600 A601 L604	W579-I587 HydrophobicContact CH2-CD1 3.69Å; W579-I587 HydrophobicContact CZ2-CD1 4.3Å; W579-I587 HydrophobicContact CZ3-CD1 4.25Å; N583-I587 HydrophobicContact CB-CD1 3.94Å; N583-I587 WeakPolarHBondContact O-CG1 3.3Å; N583-I587 PolarHBondContact O-N 2.78Å; N583-I587 VanDerWaalsContact O-N 3.14Å; R584-I587 CarbonylContact O-C 3.59Å; R584-I587 PolarHBondContact O-N 2.85Å; I587-E589 PolarHBondContact O-N 3.04Å; I587-E589 VanDerWaalsContact O-N 3.15Å; I587-M592 WeakPolarHBondContact O-CE 3.3Å; I587-I597 HydrophobicContact CG2-CG2 4.17Å; I587-K600 HydrophobicContact CG2-CB 4.07Å; I587-K600 HydrophobicContact CG2-CD 4.3Å; I587-K600 HydrophobicContact CG2-CG 4.11Å; I587-A601 HydrophobicContact CD1-CB 4.01Å; I587-L604 HydrophobicContact CD1-CD1 4Å; I587-L604 HydrophobicContact CG1-CD1 3.78Å
588	K	81.2	Confident	82.9	Confident	127 Å²	127	82.9 Å²	82.9	55%	0.552	44%	0.436	S	S	*	.			trans	-80.9	84.2	180	-173.7	-147.6	172.4	-157	0	111.5	R584 I597	R584-K588 WeakPolarHBondContact O-CB 3.37Å; R584-K588 PolarHBondContact O-N 3.22Å; K588-I597 HydrophobicContact CB-CD1 4.23Å; K588-I597 HydrophobicContact CG-CD1 3.92Å
589	E	78.7	Confident	82.8	Confident	107 Å²	107	88.7 Å²	88.7	50%	0.5	46%	0.46	S	S	.	.			trans	-68.4	165	156.8	-59	130.4	-175.9	0	0	110.2	I587 M592 K600	I587-E589 PolarHBondContact O-N 3.04Å; I587-E589 VanDerWaalsContact O-N 3.15Å; E589-M592 HydrophobicContact CB-CE 3.93Å; E589-M592 HydrophobicContact CG-CE 4.33Å; E589-M592 WeakPolarHBondContact OE2-CE 3.34Å; E589-K600 IonicContact OE1-NZ 2.68Å; E589-K600 PolarHBondContact OE1-NZ 2.79Å; E589-K600 IonicContact OE2-NZ 2.63Å; E589-K600 PolarHBondContact OE2-NZ 2.86Å
590	E	71.2	Confident	82.5	Confident	195 Å²	195	91.3 Å²	91.3	91%	0.911	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	151.6	178.5	-59.9	-163.3	136.1	0	0	112.2	M592	E590-M592 PolarHBondContact O-N 2.99Å; E590-M592 VanDerWaalsContact O-N 3.15Å
591	G	73.7	Confident	82.5	Confident	88 Å²	88	89.1 Å²	89.1	91%	0.907	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	-25.9	-179	0	0	0	0	0	116.5	S593	G591-S593 PolarHBondContact O-N 2.83Å
592	M	78.4	Confident	82.4	Confident	43 Å²	43	82.6 Å²	82.6	21%	0.212	44%	0.444	C	S	.	.			trans	-65.2	132.7	-176.6	-95.8	-164.2	-64.1	0	0	114.1	I587 E589 E590 E596 I597 K600	I587-M592 WeakPolarHBondContact O-CE 3.3Å; E589-M592 HydrophobicContact CB-CE 3.93Å; E589-M592 HydrophobicContact CG-CE 4.33Å; E589-M592 WeakPolarHBondContact OE2-CE 3.34Å; E590-M592 PolarHBondContact O-N 2.99Å; E590-M592 VanDerWaalsContact O-N 3.15Å; M592-E596 HydrophobicContact CB-CB 4.45Å; M592-E596 HydrophobicContact CG-CB 4.04Å; M592-E596 HydrophobicContact SD-CB 4.01Å; M592-I597 HydrophobicContact CB-CG1 4.12Å; M592-K600 HydrophobicContact CE-CD 4.03Å; M592-K600 HydrophobicContact SD-CD 4.04Å
593	S	79.3	Confident	82.4	Confident	53 Å²	53	85.6 Å²	85.6	37%	0.371	45%	0.448	S	S	.	.			trans	-72.2	162.3	174	73.8	0	0	0	0	112.7	G591 A595 E596 I597	G591-S593 PolarHBondContact O-N 2.83Å; S593-A595 PolarHBondContact O-N 3.33Å; S593-A595 PolarHBondContact OG-N 3.25Å; S593-E596 WeakPolarHBondContact CA-OE2 3.48Å; S593-E596 WeakPolarHBondContact CB-OE2 3.14Å; S593-E596 PolarHBondContact N-OE2 2.91Å; S593-E596 PolarHBondContact O-N 3.36Å; S593-E596 VanDerWaalsContact O-N 3.13Å; S593-E596 VanDerWaalsContact OG-CD 3.32Å; S593-E596 PolarHBondContact OG-N 2.84Å; S593-E596 PolarHBondContact OG-OE2 3.45Å; S593-I597 WeakPolarHBondContact O-CG1 3.38Å; S593-I597 PolarHBondContact O-N 3Å
594	F	77	Confident	82.3	Confident	160 Å²	160	87.1 Å²	87.1	70%	0.702	46%	0.456	S	S	*	.	H	α-helix	trans	-56.8	-31.5	174.4	-177.7	-99.7	0	0	0	113.1	G598	F594-G598 PolarHBondContact O-N 2.84Å; F594-G598 VanDerWaalsContact O-N 3.12Å
595	A	81.8	Confident	82.7	Confident	64 Å²	64	83.9 Å²	83.9	53%	0.529	44%	0.444	S	S	.	.	H	α-helix	trans	-72.1	-37.9	178	0	0	0	0	0	112.4	S593 G598 K599	S593-A595 PolarHBondContact O-N 3.33Å; S593-A595 PolarHBondContact OG-N 3.25Å; A595-G598 PolarHBondContact O-N 2.91Å; A595-K599 PolarHBondContact O-N 2.84Å
596	E	83.5	Confident	82.9	Confident	91 Å²	91	85.7 Å²	85.7	43%	0.425	45%	0.446	S	S	.	.	H	α-helix	trans	-73.2	-42.8	178.9	-70.3	153.4	140.1	0	0	111.6	M592 S593 G598 K599 K600	M592-E596 HydrophobicContact CB-CB 4.45Å; M592-E596 HydrophobicContact CG-CB 4.04Å; M592-E596 HydrophobicContact SD-CB 4.01Å; S593-E596 WeakPolarHBondContact CA-OE2 3.48Å; S593-E596 WeakPolarHBondContact CB-OE2 3.14Å; S593-E596 PolarHBondContact N-OE2 2.91Å; S593-E596 PolarHBondContact O-N 3.36Å; S593-E596 VanDerWaalsContact O-N 3.13Å; S593-E596 VanDerWaalsContact OG-CD 3.32Å; S593-E596 PolarHBondContact OG-N 2.84Å; S593-E596 PolarHBondContact OG-OE2 3.45Å; E596-G598 PolarHBondContact O-N 3.29Å; E596-K599 PolarHBondContact O-N 2.92Å; E596-K599 VanDerWaalsContact O-N 3.09Å; E596-K600 WeakPolarHBondContact O-CB 3.48Å; E596-K600 PolarHBondContact O-N 3.41Å
597	I	85.2	Confident	83.1	Confident	12 Å²	12	83.4 Å²	83.4	6%	0.062	44%	0.442	C	S	.	.	H	α-helix	trans	-54.5	-41.9	169.6	-62.6	166.3	0	0	0	109.9	I587 K588 M592 S593 A601	I587-I597 HydrophobicContact CG2-CG2 4.17Å; K588-I597 HydrophobicContact CB-CD1 4.23Å; K588-I597 HydrophobicContact CG-CD1 3.92Å; M592-I597 HydrophobicContact CB-CG1 4.12Å; S593-I597 WeakPolarHBondContact O-CG1 3.38Å; S593-I597 PolarHBondContact O-N 3Å; I597-A601 WeakPolarHBondContact O-CB 3.42Å; I597-A601 PolarHBondContact O-N 2.96Å
598	G	85.4	Confident	83.3	Confident	36 Å²	36	84.8 Å²	84.8	37%	0.371	45%	0.45	S	S	.	.	H	α-helix	trans	-62.9	-40	176.2	0	0	0	0	0	114.4	F594 A595 E596 G602	F594-G598 PolarHBondContact O-N 2.84Å; F594-G598 VanDerWaalsContact O-N 3.12Å; A595-G598 PolarHBondContact O-N 2.91Å; E596-G598 PolarHBondContact O-N 3.29Å; G598-G602 PolarHBondContact O-N 3.4Å; G598-G602 VanDerWaalsContact O-N 3.13Å
599	K	86.8	Confident	83.4	Confident	148 Å²	148	85.6 Å²	85.6	64%	0.643	47%	0.466	S	S	*	.	H	α-helix	trans	-67.3	-53.8	174.9	-71.8	176.3	179.6	177.8	0	111.5	A595 E596 A601 G602 E603	A595-K599 PolarHBondContact O-N 2.84Å; E596-K599 PolarHBondContact O-N 2.92Å; E596-K599 VanDerWaalsContact O-N 3.09Å; K599-A601 VanDerWaalsContact C-N 3.28Å; K599-A601 PolarHBondContact O-N 3.44Å; K599-G602 WeakPolarHBondContact O-CA 2.97Å; K599-G602 PolarHBondContact O-N 3.47Å; K599-E603 PolarHBondContact O-N 2.78Å
600	K	86.6	Confident	83.7	Confident	65 Å²	65	85 Å²	85	28%	0.283	47%	0.466	S	S	.	.	H	α-helix	trans	-60	-38.1	-178.4	-164.5	167.6	177.8	165.6	0	111.4	I587 E589 M592 E596 L604	I587-K600 HydrophobicContact CG2-CB 4.07Å; I587-K600 HydrophobicContact CG2-CD 4.3Å; I587-K600 HydrophobicContact CG2-CG 4.11Å; E589-K600 IonicContact OE1-NZ 2.68Å; E589-K600 PolarHBondContact OE1-NZ 2.79Å; E589-K600 IonicContact OE2-NZ 2.63Å; E589-K600 PolarHBondContact OE2-NZ 2.86Å; M592-K600 HydrophobicContact CE-CD 4.03Å; M592-K600 HydrophobicContact SD-CD 4.04Å; E596-K600 WeakPolarHBondContact O-CB 3.48Å; E596-K600 PolarHBondContact O-N 3.41Å; K600-L604 HydrophobicContact CG-CD1 4.43Å; K600-L604 WeakPolarHBondContact O-CB 3.44Å; K600-L604 VanDerWaalsContact O-CG 3.31Å; K600-L604 WeakPolarHBondContact O-CG 3.32Å; K600-L604 PolarHBondContact O-N 2.91Å
601	A	87.9	Confident	84.6	Confident	0 Å²	0	78 Å²	78	0%	0	43%	0.433	C	S	.	.	H	α-helix	trans	-64.6	-41.2	170.7	0	0	0	0	0	113.2	Y576 W579 M580 I587 I597 K599 W605	Y576-A601 HydrophobicContact CE2-CB 4.47Å; W579-A601 HydrophobicContact CH2-CB 4.39Å; W579-A601 WeakPolarHBondContact CH2-O 3.26Å; W579-A601 HydrophobicContact CZ3-CB 3.99Å; W579-A601 WeakPolarHBondContact CZ3-O 3.28Å; M580-A601 HydrophobicContact CG-CB 4.13Å; I587-A601 HydrophobicContact CD1-CB 4.01Å; I597-A601 WeakPolarHBondContact O-CB 3.42Å; I597-A601 PolarHBondContact O-N 2.96Å; K599-A601 VanDerWaalsContact C-N 3.28Å; K599-A601 PolarHBondContact O-N 3.44Å; A601-W605 VanDerWaalsContact O-CB 3.32Å; A601-W605 WeakPolarHBondContact O-CB 3.41Å; A601-W605 PolarHBondContact O-N 3.04Å
602	G	86.7	Confident	85.3	Confident	25 Å²	25	81.2 Å²	81.2	26%	0.258	42%	0.422	S	S	.	.	H	α-helix	trans	-64.8	-37.9	177.7	0	0	0	0	0	113.6	Y576 G598 K599 K606	Y576-G602 PolarHBondContact OH-N 2.98Å; G598-G602 PolarHBondContact O-N 3.4Å; G598-G602 VanDerWaalsContact O-N 3.13Å; K599-G602 WeakPolarHBondContact O-CA 2.97Å; K599-G602 PolarHBondContact O-N 3.47Å; G602-K606 PolarHBondContact O-N 2.88Å
603	E	87.4	Confident	85.9	Confident	121 Å²	121	85.5 Å²	85.5	57%	0.565	44%	0.439	S	S	*	.	H	α-helix	trans	-69.7	-49.9	175.6	-71.6	166.8	-178.4	0	0	111.6	K599 W605 K606 N607	K599-E603 PolarHBondContact O-N 2.78Å; E603-W605 VanDerWaalsContact C-N 3.28Å; E603-W605 PolarHBondContact O-N 2.85Å; E603-K606 WeakPolarHBondContact O-CB 3.22Å; E603-K606 PolarHBondContact O-N 2.87Å; E603-K606 VanDerWaalsContact O-N 3.12Å; E603-N607 PolarHBondContact O-N 3.04Å
604	L	88.1	Confident	86.4	Confident	77 Å²	77	84.5 Å²	84.5	40%	0.403	43%	0.427	S	S	.	.	H	α-helix	trans	-57.1	-40.7	174.8	-75.6	168.9	0	0	0	111.9	W579 I587 K600 K606 N607 V608	W579-L604 HydrophobicContact CH2-CB 3.61Å; W579-L604 HydrophobicContact CZ2-CB 3.91Å; I587-L604 HydrophobicContact CD1-CD1 4Å; I587-L604 HydrophobicContact CG1-CD1 3.78Å; K600-L604 HydrophobicContact CG-CD1 4.43Å; K600-L604 WeakPolarHBondContact O-CB 3.44Å; K600-L604 VanDerWaalsContact O-CG 3.31Å; K600-L604 WeakPolarHBondContact O-CG 3.32Å; K600-L604 PolarHBondContact O-N 2.91Å; L604-K606 PolarHBondContact O-N 3.19Å; L604-N607 CarbonylContact O-C 3.58Å; L604-N607 PolarHBondContact O-N 2.77Å; L604-N607 VanDerWaalsContact O-N 3.09Å; L604-V608 WeakPolarHBondContact O-CG2 3.16Å; L604-V608 PolarHBondContact O-N 2.81Å
605	W	89.9	Confident	87.1	Confident	43 Å²	43	81.8 Å²	81.8	16%	0.163	42%	0.417	C	S	.	.	H	α-helix	trans	-65	-33.1	177.1	179.2	-112	0	0	0	113.9	A575 Y576 W579 A601 E603 N607 V608 K611 W614	A575-W605 HydrophobicContact CB-CH2 3.96Å; A575-W605 HydrophobicContact CB-CZ2 3.98Å; Y576-W605 HydrophobicContact CD2-CB 3.64Å; Y576-W605 AromaticContact CD2-CD1 3.6Å; Y576-W605 AromaticContact CD2-CD2 3.87Å; Y576-W605 HydrophobicContact CD2-CD2 3.87Å; Y576-W605 AromaticContact CD2-CG 3.4Å; Y576-W605 HydrophobicContact CD2-CG 3.4Å; Y576-W605 HydrophobicContact CE2-CB 3.72Å; Y576-W605 HydrophobicContact CE2-CG 4.01Å; Y576-W605 HydrophobicContact CG-CG 4.34Å; W579-W605 HydrophobicContact CB-CE3 3.85Å; W579-W605 HydrophobicContact CB-CH2 4.46Å; W579-W605 HydrophobicContact CB-CZ3 3.59Å; W579-W605 AromaticContact CD1-CZ3 4Å; W579-W605 HydrophobicContact CD2-CD2 4.49Å; W579-W605 AromaticContact CD2-CE3 3.56Å; W579-W605 HydrophobicContact CD2-CE3 3.56Å; W579-W605 HydrophobicContact CD2-CZ3 4.15Å; W579-W605 HydrophobicContact CE3-CB 4.06Å; W579-W605 HydrophobicContact CE3-CD2 4.38Å; W579-W605 AromaticContact CE3-CE3 3.86Å; W579-W605 HydrophobicContact CE3-CE3 3.86Å; W579-W605 HydrophobicContact CE3-CG 4.5Å; W579-W605 AromaticContact CG-CE3 3.53Å; W579-W605 HydrophobicContact CG-CE3 3.53Å; W579-W605 AromaticContact CG-CZ3 3.6Å; W579-W605 HydrophobicContact CG-CZ3 3.6Å; W579-W605 HydrophobicContact CH2-CB 4.31Å; W579-W605 HydrophobicContact CZ3-CB 3.87Å; A601-W605 VanDerWaalsContact O-CB 3.32Å; A601-W605 WeakPolarHBondContact O-CB 3.41Å; A601-W605 PolarHBondContact O-N 3.04Å; E603-W605 VanDerWaalsContact C-N 3.28Å; E603-W605 PolarHBondContact O-N 2.85Å; W605-N607 VanDerWaalsContact C-N 3.27Å; W605-N607 PolarHBondContact O-N 2.83Å; W605-V608 HydrophobicContact CE3-CB 4.3Å; W605-V608 HydrophobicContact CE3-CG2 4.03Å; W605-V608 HydrophobicContact CZ3-CG1 4.41Å; W605-K611 HydrophobicContact CH2-CB 4.12Å; W605-K611 HydrophobicContact CH2-CD 3.93Å; W605-K611 HydrophobicContact CH2-CG 3.77Å; W605-K611 HydrophobicContact CZ2-CD 3.7Å; W605-K611 HydrophobicContact CZ2-CG 4.09Å; W605-K611 HydrophobicContact CZ3-CG 4.18Å; W605-K611 WeakPolarHBondContact O-CE 3.45Å; W605-K611 PolarHBondContact O-NZ 3.28Å; W605-W614 HydrophobicContact CH2-CB 3.92Å; W605-W614 HydrophobicContact CH2-CG 4.23Å; W605-W614 HydrophobicContact CZ3-CB 4.28Å; W605-W614 AromaticContact CZ3-CD1 3.84Å; W605-W614 HydrophobicContact CZ3-CG 4.11Å
606	K	87.9	Confident	87.5	Confident	164 Å²	164	81.9 Å²	81.9	71%	0.713	41%	0.407	S	S	*	.	H	α-helix	trans	-58.7	-46	170.3	-71.8	175.3	-179.9	179.2	0	109.9	G602 E603 L604 V608 K611	G602-K606 PolarHBondContact O-N 2.88Å; E603-K606 WeakPolarHBondContact O-CB 3.22Å; E603-K606 PolarHBondContact O-N 2.87Å; E603-K606 VanDerWaalsContact O-N 3.12Å; L604-K606 PolarHBondContact O-N 3.19Å; K606-V608 PolarHBondContact O-N 2.82Å; K606-K611 PolarHBondContact O-NZ 2.91Å; K606-K611 VanDerWaalsContact O-NZ 3.14Å
607	N	87.3	Confident	87.9	Confident	128 Å²	128	81.1 Å²	81.1	68%	0.684	41%	0.405	S	S	*	.	H	α-helix	trans	-79.1	-9.7	-174	-62.4	-4.2	0	0	0	115.1	E603 L604 W605 T609	E603-N607 PolarHBondContact O-N 3.04Å; L604-N607 CarbonylContact O-C 3.58Å; L604-N607 PolarHBondContact O-N 2.77Å; L604-N607 VanDerWaalsContact O-N 3.09Å; W605-N607 VanDerWaalsContact C-N 3.27Å; W605-N607 PolarHBondContact O-N 2.83Å; N607-T609 PolarHBondContact O-N 2.83Å; N607-T609 VanDerWaalsContact O-N 3.13Å
608	V	85.7	Confident	88.2	Confident	33 Å²	33	80.9 Å²	80.9	20%	0.2	41%	0.405	C	S	.	.			trans	-62.7	113.4	170.7	177.2	0	0	0	0	109.6	W579 L604 W605 K606 D610 K611	W579-V608 HydrophobicContact CZ2-CG2 4.27Å; L604-V608 WeakPolarHBondContact O-CG2 3.16Å; L604-V608 PolarHBondContact O-N 2.81Å; W605-V608 HydrophobicContact CE3-CB 4.3Å; W605-V608 HydrophobicContact CE3-CG2 4.03Å; W605-V608 HydrophobicContact CZ3-CG1 4.41Å; K606-V608 PolarHBondContact O-N 2.82Å; V608-D610 VanDerWaalsContact CG1-O 3.25Å; V608-D610 WeakPolarHBondContact CG1-O 3.4Å; V608-K611 HydrophobicContact CB-CG 4.3Å; V608-K611 HydrophobicContact CG1-CG 3.91Å; V608-K611 PolarHBondContact O-NZ 3.47Å
609	T	82.2	Confident	88.4	Confident	145 Å²	145	85.6 Å²	85.6	89%	0.89	41%	0.412	S	S	*	.	S	Bend	trans	-77.1	-47.2	-180	46.8	0	0	0	0	112.9	N607	N607-T609 PolarHBondContact O-N 2.83Å; N607-T609 VanDerWaalsContact O-N 3.13Å
610	D	86.8	Confident	88.6	Confident	93 Å²	93	84.7 Å²	84.7	50%	0.497	41%	0.408	S	S	.	.			trans	-94	103.7	172.1	-175	17.8	0	0	0	112.1	V608 K612	V608-D610 VanDerWaalsContact CG1-O 3.25Å; V608-D610 WeakPolarHBondContact CG1-O 3.4Å; D610-K612 WeakPolarHBondContact OD1-CB 3.17Å; D610-K612 VanDerWaalsContact OD1-CG 3.24Å; D610-K612 WeakPolarHBondContact OD1-CG 3.17Å; D610-K612 PolarHBondContact OD1-N 2.82Å
611	K	89.2	Confident	88.8	Confident	48 Å²	48	82.9 Å²	82.9	21%	0.209	40%	0.401	C	S	.	.			trans	-96.2	-7.7	175.7	-67.6	-178.4	165.8	88.2	0	113.3	W605 K606 V608 K613 W614 E615	W605-K611 HydrophobicContact CH2-CB 4.12Å; W605-K611 HydrophobicContact CH2-CD 3.93Å; W605-K611 HydrophobicContact CH2-CG 3.77Å; W605-K611 HydrophobicContact CZ2-CD 3.7Å; W605-K611 HydrophobicContact CZ2-CG 4.09Å; W605-K611 HydrophobicContact CZ3-CG 4.18Å; W605-K611 WeakPolarHBondContact O-CE 3.45Å; W605-K611 PolarHBondContact O-NZ 3.28Å; K606-K611 PolarHBondContact O-NZ 2.91Å; K606-K611 VanDerWaalsContact O-NZ 3.14Å; V608-K611 HydrophobicContact CB-CG 4.3Å; V608-K611 HydrophobicContact CG1-CG 3.91Å; V608-K611 PolarHBondContact O-NZ 3.47Å; K611-K613 VanDerWaalsContact C-N 3.32Å; K611-K613 PolarHBondContact O-N 2.69Å; K611-W614 PolarHBondContact O-N 3.48Å; K611-E615 HydrophobicContact CB-CG 4.44Å; K611-E615 PolarHBondContact O-N 3.19Å
612	K	88.3	Confident	88.9	Confident	157 Å²	157	89.2 Å²	89.2	68%	0.683	43%	0.425	S	S	*	.	H	α-helix	trans	-56.7	-41.8	-171.2	-65.2	172.6	-178.9	176.6	0	112.9	D610 W614 E615 E616	D610-K612 WeakPolarHBondContact OD1-CB 3.17Å; D610-K612 VanDerWaalsContact OD1-CG 3.24Å; D610-K612 WeakPolarHBondContact OD1-CG 3.17Å; D610-K612 PolarHBondContact OD1-N 2.82Å; K612-W614 VanDerWaalsContact C-N 3.28Å; K612-W614 PolarHBondContact O-N 2.97Å; K612-E615 PolarHBondContact O-N 2.99Å; K612-E616 WeakPolarHBondContact O-CB 3.3Å; K612-E616 PolarHBondContact O-N 2.68Å
613	K	90.5	Very high	89.1	Confident	133 Å²	133	90.6 Å²	90.6	58%	0.578	43%	0.428	S	S	*	.	H	α-helix	trans	-53.8	-44.5	175.5	178	174.2	178.3	174.3	0	112.1	K611 L617	K611-K613 VanDerWaalsContact C-N 3.32Å; K611-K613 PolarHBondContact O-N 2.69Å; K613-L617 HydrophobicContact CG-CD1 4.44Å; K613-L617 WeakPolarHBondContact O-CD1 3.2Å; K613-L617 PolarHBondContact O-N 2.77Å; K613-L617 VanDerWaalsContact O-N 3.1Å
614	W	91.4	Very high	89.3	Confident	31 Å²	31	88.3 Å²	88.3	12%	0.117	41%	0.414	C	S	.	.	H	α-helix	trans	-81.5	-31.3	-174.8	-53.9	107.1	0	0	0	112.4	A575 L578 W579 A582 W605 K611 K612 A618	A575-W614 HydrophobicContact CB-CB 3.81Å; A575-W614 WeakPolarHBondContact CB-O 3.33Å; L578-W614 HydrophobicContact CB-CE3 4.04Å; L578-W614 HydrophobicContact CB-CZ3 4.49Å; W579-W614 HydrophobicContact CB-CD2 3.73Å; W579-W614 HydrophobicContact CB-CE3 4Å; W579-W614 HydrophobicContact CB-CG 3.99Å; W579-W614 HydrophobicContact CB-CZ2 4.48Å; W579-W614 HydrophobicContact CB-CZ3 4.48Å; W579-W614 AromaticContact CD1-CE2 3.61Å; W579-W614 AromaticContact CD1-CZ2 3.86Å; W579-W614 AromaticContact CD1-NE1 3.56Å; W579-W614 HydrophobicContact CG-CD2 4.42Å; A582-W614 HydrophobicContact CB-CH2 3.51Å; A582-W614 HydrophobicContact CB-CZ3 3.95Å; W605-W614 HydrophobicContact CH2-CB 3.92Å; W605-W614 HydrophobicContact CH2-CG 4.23Å; W605-W614 HydrophobicContact CZ3-CB 4.28Å; W605-W614 AromaticContact CZ3-CD1 3.84Å; W605-W614 HydrophobicContact CZ3-CG 4.11Å; K611-W614 PolarHBondContact O-N 3.48Å; K612-W614 VanDerWaalsContact C-N 3.28Å; K612-W614 PolarHBondContact O-N 2.97Å; W614-A618 VanDerWaalsContact O-CB 3.28Å; W614-A618 WeakPolarHBondContact O-CB 3.5Å; W614-A618 PolarHBondContact O-N 2.6Å
615	E	90.2	Very high	89.5	Confident	104 Å²	104	87.3 Å²	87.3	49%	0.486	41%	0.405	S	S	.	.	H	α-helix	trans	-67.8	-41.7	172.3	-69.9	165.6	174.4	0	0	111.4	A575 K611 K612 A618 R619	A575-E615 HydrophobicContact CB-CG 4.24Å; K611-E615 HydrophobicContact CB-CG 4.44Å; K611-E615 PolarHBondContact O-N 3.19Å; K612-E615 PolarHBondContact O-N 2.99Å; E615-A618 PolarHBondContact O-N 2.94Å; E615-R619 WeakPolarHBondContact O-CB 3.42Å; E615-R619 PolarHBondContact O-N 2.84Å
616	E	91.1	Very high	89.4	Confident	66 Å²	66	91 Å²	91	31%	0.308	43%	0.425	S	S	.	.	H	α-helix	trans	-68.3	-40.8	174.8	176.7	56.9	-165.3	0	0	112.2	K612 A618 R619 K620	K612-E616 WeakPolarHBondContact O-CB 3.3Å; K612-E616 PolarHBondContact O-N 2.68Å; E616-A618 VanDerWaalsContact C-N 3.34Å; E616-A618 PolarHBondContact O-N 2.96Å; E616-R619 WeakPolarHBondContact O-CB 3.39Å; E616-R619 PolarHBondContact O-N 2.92Å; E616-R619 IonicContact OE1-CZ 2.65Å; E616-R619 IonicContact OE1-NE 3.18Å; E616-R619 IonicContact OE1-NH2 3.41Å; E616-R619 PolarHBondContact OE1-NH2 3.35Å; E616-R619 IonicContact OE2-CZ 2.61Å; E616-R619 IonicContact OE2-NE 2.8Å; E616-R619 PolarHBondContact OE2-NE 2.84Å; E616-R619 IonicContact OE2-NH2 2.72Å; E616-R619 PolarHBondContact OE2-NH2 2.87Å; E616-K620 WeakPolarHBondContact O-CG 3.46Å; E616-K620 PolarHBondContact O-N 2.84Å; E616-K620 WeakPolarHBondContact OE1-CE 3.36Å; E616-K620 IonicContact OE1-NZ 3.92Å
617	L	90.8	Very high	89.5	Confident	74 Å²	74	88.3 Å²	88.3	39%	0.387	42%	0.415	S	S	.	.	H	α-helix	trans	-61.4	-42.3	171	-95.4	72.3	0	0	0	111.3	L578 K613 R619 K620 D621	L578-L617 HydrophobicContact CD1-CB 4.04Å; K613-L617 HydrophobicContact CG-CD1 4.44Å; K613-L617 WeakPolarHBondContact O-CD1 3.2Å; K613-L617 PolarHBondContact O-N 2.77Å; K613-L617 VanDerWaalsContact O-N 3.1Å; L617-R619 VanDerWaalsContact C-N 3.31Å; L617-R619 PolarHBondContact O-N 2.87Å; L617-K620 PolarHBondContact O-N 3.4Å; L617-D621 WeakPolarHBondContact O-CB 3.38Å; L617-D621 PolarHBondContact O-N 2.88Å
618	A	91.4	Very high	89.6	Confident	8 Å²	8	85.6 Å²	85.6	7%	0.066	40%	0.398	C	S	.	.	H	α-helix	trans	-66.7	-31	176	0	0	0	0	0	112.9	A575 L578 W614 E615 E616 R622	A575-A618 HydrophobicContact CB-CB 4.26Å; L578-A618 HydrophobicContact CD1-CB 3.87Å; W614-A618 VanDerWaalsContact O-CB 3.28Å; W614-A618 WeakPolarHBondContact O-CB 3.5Å; W614-A618 PolarHBondContact O-N 2.6Å; E615-A618 PolarHBondContact O-N 2.94Å; E616-A618 VanDerWaalsContact C-N 3.34Å; E616-A618 PolarHBondContact O-N 2.96Å; A618-R622 VanDerWaalsContact O-CG 3.31Å; A618-R622 WeakPolarHBondContact O-CG 3.43Å; A618-R622 PolarHBondContact O-N 3.04Å; A618-R622 VanDerWaalsContact O-N 3.07Å
619	R	90.3	Very high	89.6	Confident	135 Å²	135	85.8 Å²	85.8	51%	0.509	40%	0.397	S	S	.	.	H	α-helix	trans	-66.3	-47.3	172.3	-167.9	-173.8	69.1	85.5	2	110.8	E615 E616 L617 D621 R622 V623	E615-R619 WeakPolarHBondContact O-CB 3.42Å; E615-R619 PolarHBondContact O-N 2.84Å; E616-R619 WeakPolarHBondContact O-CB 3.39Å; E616-R619 PolarHBondContact O-N 2.92Å; E616-R619 IonicContact OE1-CZ 2.65Å; E616-R619 IonicContact OE1-NE 3.18Å; E616-R619 IonicContact OE1-NH2 3.41Å; E616-R619 PolarHBondContact OE1-NH2 3.35Å; E616-R619 IonicContact OE2-CZ 2.61Å; E616-R619 IonicContact OE2-NE 2.8Å; E616-R619 PolarHBondContact OE2-NE 2.84Å; E616-R619 IonicContact OE2-NH2 2.72Å; E616-R619 PolarHBondContact OE2-NH2 2.87Å; L617-R619 VanDerWaalsContact C-N 3.31Å; L617-R619 PolarHBondContact O-N 2.87Å; R619-D621 VanDerWaalsContact C-N 3.34Å; R619-D621 PolarHBondContact O-N 3.2Å; R619-R622 WeakPolarHBondContact O-CB 3.35Å; R619-R622 PolarHBondContact O-N 3.26Å; R619-V623 PolarHBondContact O-N 3.21Å; R619-V623 VanDerWaalsContact O-N 3.15Å
620	K	91.6	Very high	89.8	Confident	129 Å²	129	81.6 Å²	81.6	56%	0.561	37%	0.373	S	S	*	.	H	α-helix	trans	-61.8	-40.6	175.2	-68	-176.1	-173.5	-170.3	0	112	E616 L617 R622 V623 R624	E616-K620 WeakPolarHBondContact O-CG 3.46Å; E616-K620 PolarHBondContact O-N 2.84Å; E616-K620 WeakPolarHBondContact OE1-CE 3.36Å; E616-K620 IonicContact OE1-NZ 3.92Å; L617-K620 PolarHBondContact O-N 3.4Å; K620-R622 VanDerWaalsContact C-N 3.33Å; K620-R622 PolarHBondContact O-N 2.95Å; K620-V623 PolarHBondContact O-N 2.9Å; K620-R624 PolarHBondContact O-N 3.22Å
621	D	89.4	Confident	89.8	Confident	27 Å²	27	83.7 Å²	83.7	14%	0.144	38%	0.378	C	S	.	.	H	α-helix	trans	-68	-31	179	-154.1	67	0	0	0	113.1	P572 Q573 L617 R619 R624 Y625	P572-D621 VanDerWaalsContact CA-OD2 3.25Å; P572-D621 WeakPolarHBondContact CA-OD2 3.11Å; Q573-D621 WeakPolarHBondContact CG-OD2 3.18Å; Q573-D621 PolarHBondContact N-OD2 3.34Å; L617-D621 WeakPolarHBondContact O-CB 3.38Å; L617-D621 PolarHBondContact O-N 2.88Å; R619-D621 VanDerWaalsContact C-N 3.34Å; R619-D621 PolarHBondContact O-N 3.2Å; D621-R624 IonicContact OD1-CZ 2.72Å; D621-R624 IonicContact OD1-NH1 2.73Å; D621-R624 PolarHBondContact OD1-NH1 3.36Å; D621-R624 IonicContact OD2-NH1 2.69Å; D621-R624 PolarHBondContact OD2-NH1 3.35Å; D621-R624 VanDerWaalsContact OD2-NH1 3.11Å; D621-Y625 WeakPolarHBondContact O-CB 3.43Å; D621-Y625 PolarHBondContact O-N 2.87Å
622	R	90	Very high	89.6	Confident	133 Å²	133	83 Å²	83	50%	0.502	37%	0.374	S	S	.	.	H	α-helix	trans	-65.5	-43.5	169	-75.7	171.4	178.8	-174.8	-0.4	112.4	P572 A618 R619 K620 Y625 Q626	P572-R622 HydrophobicContact CB-CG 4.04Å; P572-R622 HydrophobicContact CG-CG 4.2Å; A618-R622 VanDerWaalsContact O-CG 3.31Å; A618-R622 WeakPolarHBondContact O-CG 3.43Å; A618-R622 PolarHBondContact O-N 3.04Å; A618-R622 VanDerWaalsContact O-N 3.07Å; R619-R622 WeakPolarHBondContact O-CB 3.35Å; R619-R622 PolarHBondContact O-N 3.26Å; K620-R622 VanDerWaalsContact C-N 3.33Å; K620-R622 PolarHBondContact O-N 2.95Å; R622-Y625 PolarHBondContact O-N 2.97Å; R622-Q626 WeakPolarHBondContact O-CG 3.27Å; R622-Q626 PolarHBondContact O-N 3.44Å
623	V	90.8	Very high	89.3	Confident	53 Å²	53	81.1 Å²	81.1	32%	0.321	37%	0.368	S	S	.	.	H	α-helix	trans	-63.9	-48	176.9	174.6	0	0	0	0	110.4	R619 K620 Y625 Q626 E627	R619-V623 PolarHBondContact O-N 3.21Å; R619-V623 VanDerWaalsContact O-N 3.15Å; K620-V623 PolarHBondContact O-N 2.9Å; V623-Y625 VanDerWaalsContact C-N 3.29Å; V623-Y625 PolarHBondContact O-N 3.43Å; V623-Q626 WeakPolarHBondContact O-CB 3.32Å; V623-Q626 PolarHBondContact O-N 3.14Å; V623-E627 HydrophobicContact CG1-CG 4.49Å; V623-E627 VanDerWaalsContact CG1-OE1 3.32Å; V623-E627 WeakPolarHBondContact CG1-OE1 3.43Å; V623-E627 PolarHBondContact O-N 2.88Å
624	R	93.3	Very high	88.9	Confident	74 Å²	74	80.9 Å²	80.9	28%	0.279	37%	0.369	S	S	.	.	H	α-helix	trans	-49.9	-49	172.8	-166.6	-146.9	90.1	-121.7	-10.2	111.7	K570 K620 D621 Q626 E627 E628	K570-R624 PolarHBondContact O-NH2 3.11Å; K620-R624 PolarHBondContact O-N 3.22Å; D621-R624 IonicContact OD1-CZ 2.72Å; D621-R624 IonicContact OD1-NH1 2.73Å; D621-R624 PolarHBondContact OD1-NH1 3.36Å; D621-R624 IonicContact OD2-NH1 2.69Å; D621-R624 PolarHBondContact OD2-NH1 3.35Å; D621-R624 VanDerWaalsContact OD2-NH1 3.11Å; R624-Q626 PolarHBondContact O-N 3.15Å; R624-E627 PolarHBondContact O-N 3.16Å; R624-E628 WeakPolarHBondContact CD-OE1 3.46Å; R624-E628 IonicContact CZ-OE1 3.11Å; R624-E628 IonicContact CZ-OE2 3.24Å; R624-E628 IonicContact NE-OE1 3.69Å; R624-E628 PolarHBondContact NE-OE1 2.86Å; R624-E628 IonicContact NE-OE2 3.62Å; R624-E628 PolarHBondContact NE-OE2 3.05Å; R624-E628 IonicContact NH2-OE1 3.37Å; R624-E628 IonicContact NH2-OE2 3.82Å; R624-E628 PolarHBondContact NH2-OE2 2.83Å; R624-E628 WeakPolarHBondContact O-CB 3.33Å; R624-E628 VanDerWaalsContact O-CG 3.26Å; R624-E628 WeakPolarHBondContact O-CG 3.43Å; R624-E628 PolarHBondContact O-N 2.72Å
625	Y	91.3	Very high	88.3	Confident	55 Å²	55	83.2 Å²	83.2	22%	0.216	40%	0.395	C	S	.	.	H	α-helix	trans	-66.4	-33.7	177.8	177.5	-98.6	0	0	0	113.4	P569 K570 K571 P572 D621 R622 V623 M629	P569-Y625 HydrophobicContact CB-CD2 3.96Å; P569-Y625 HydrophobicContact CB-CE2 3.93Å; K570-Y625 WeakPolarHBondContact O-CD2 3.25Å; K571-Y625 HydrophobicContact CG-CE2 4.36Å; P572-Y625 HydrophobicContact CB-CG 4.36Å; P572-Y625 HydrophobicContact CG-CD1 4.05Å; P572-Y625 HydrophobicContact CG-CG 4.1Å; D621-Y625 WeakPolarHBondContact O-CB 3.43Å; D621-Y625 PolarHBondContact O-N 2.87Å; R622-Y625 PolarHBondContact O-N 2.97Å; V623-Y625 VanDerWaalsContact C-N 3.29Å; V623-Y625 PolarHBondContact O-N 3.43Å; Y625-M629 HydrophobicContact CD1-CG 4.01Å; Y625-M629 HydrophobicContact CD2-CG 4.16Å; Y625-M629 HydrophobicContact CE1-CG 3.57Å; Y625-M629 HydrophobicContact CE1-SD 4.45Å; Y625-M629 HydrophobicContact CE2-CG 3.75Å; Y625-M629 HydrophobicContact CE2-SD 4.02Å; Y625-M629 HydrophobicContact CG-CG 4.3Å; Y625-M629 VanDerWaalsContact CZ-CG 3.43Å; Y625-M629 WeakPolarHBondContact O-CB 3.39Å; Y625-M629 WeakPolarHBondContact O-CG 3.39Å; Y625-M629 PolarHBondContact O-N 2.9Å
626	Q	87.5	Confident	87.1	Confident	121 Å²	121	81.6 Å²	81.6	57%	0.565	39%	0.387	S	S	*	.	H	α-helix	trans	-68.4	-42.9	175.6	-74.7	172.9	-51.4	0	0	111.7	R622 V623 R624 M629 S630	R622-Q626 WeakPolarHBondContact O-CG 3.27Å; R622-Q626 PolarHBondContact O-N 3.44Å; V623-Q626 WeakPolarHBondContact O-CB 3.32Å; V623-Q626 PolarHBondContact O-N 3.14Å; R624-Q626 PolarHBondContact O-N 3.15Å; Q626-M629 PolarHBondContact O-N 3.46Å; Q626-S630 PolarHBondContact O-N 2.99Å
627	E	89.7	Confident	85.3	Confident	108 Å²	108	81 Å²	81	51%	0.505	40%	0.399	S	S	.	.	H	α-helix	trans	-65.3	-44	175.4	-68	172.9	-164.1	0	0	112.3	V623 R624 S630 K631	V623-E627 HydrophobicContact CG1-CG 4.49Å; V623-E627 VanDerWaalsContact CG1-OE1 3.32Å; V623-E627 WeakPolarHBondContact CG1-OE1 3.43Å; V623-E627 PolarHBondContact O-N 2.88Å; R624-E627 PolarHBondContact O-N 3.16Å; E627-S630 PolarHBondContact O-N 2.83Å; E627-K631 WeakPolarHBondContact O-CG 3.49Å; E627-K631 PolarHBondContact O-N 2.69Å; E627-K631 VanDerWaalsContact O-N 3.16Å
628	E	90.2	Very high	83	Confident	70 Å²	70	83.8 Å²	83.8	33%	0.327	43%	0.425	S	S	.	.	H	α-helix	trans	-63.3	-40.4	174.2	-74.2	172.6	179.8	0	0	112	P569 R624 Y632	P569-E628 HydrophobicContact CB-CB 3.79Å; P569-E628 HydrophobicContact CG-CB 3.74Å; P569-E628 WeakPolarHBondContact CG-O 3.4Å; R624-E628 WeakPolarHBondContact CD-OE1 3.46Å; R624-E628 IonicContact CZ-OE1 3.11Å; R624-E628 IonicContact CZ-OE2 3.24Å; R624-E628 IonicContact NE-OE1 3.69Å; R624-E628 PolarHBondContact NE-OE1 2.86Å; R624-E628 IonicContact NE-OE2 3.62Å; R624-E628 PolarHBondContact NE-OE2 3.05Å; R624-E628 IonicContact NH2-OE1 3.37Å; R624-E628 IonicContact NH2-OE2 3.82Å; R624-E628 PolarHBondContact NH2-OE2 2.83Å; R624-E628 WeakPolarHBondContact O-CB 3.33Å; R624-E628 VanDerWaalsContact O-CG 3.26Å; R624-E628 WeakPolarHBondContact O-CG 3.43Å; R624-E628 PolarHBondContact O-N 2.72Å; E628-Y632 VanDerWaalsContact O-CB 3.28Å; E628-Y632 WeakPolarHBondContact O-CB 3.4Å; E628-Y632 PolarHBondContact O-N 3.4Å
629	M	86.5	Confident	80.9	Confident	37 Å²	37	86.6 Å²	86.6	18%	0.182	45%	0.454	C	S	.	.	H	α-helix	trans	-67.5	-38.6	176.5	-80.7	-63	-43.9	0	0	112.5	P569 Y625 Q626 Y632 E633	P569-M629 HydrophobicContact CB-CG 4.28Å; P569-M629 HydrophobicContact CB-SD 4.06Å; P569-M629 HydrophobicContact CG-CG 4.32Å; P569-M629 HydrophobicContact CG-SD 3.92Å; Y625-M629 HydrophobicContact CD1-CG 4.01Å; Y625-M629 HydrophobicContact CD2-CG 4.16Å; Y625-M629 HydrophobicContact CE1-CG 3.57Å; Y625-M629 HydrophobicContact CE1-SD 4.45Å; Y625-M629 HydrophobicContact CE2-CG 3.75Å; Y625-M629 HydrophobicContact CE2-SD 4.02Å; Y625-M629 HydrophobicContact CG-CG 4.3Å; Y625-M629 VanDerWaalsContact CZ-CG 3.43Å; Y625-M629 WeakPolarHBondContact O-CB 3.39Å; Y625-M629 WeakPolarHBondContact O-CG 3.39Å; Y625-M629 PolarHBondContact O-N 2.9Å; Q626-M629 PolarHBondContact O-N 3.46Å; M629-Y632 HydrophobicContact CE-CD1 4.38Å; M629-Y632 PolarHBondContact O-N 3.47Å; M629-E633 HydrophobicContact CE-CG 4.05Å; M629-E633 VanDerWaalsContact CE-OE1 3.26Å; M629-E633 WeakPolarHBondContact CE-OE1 3.33Å; M629-E633 WeakPolarHBondContact O-CB 3.46Å; M629-E633 WeakPolarHBondContact O-CG 3.47Å; M629-E633 PolarHBondContact O-N 3.16Å
630	S	86.1	Confident	79	Confident	57 Å²	57	86 Å²	86	40%	0.399	46%	0.461	S	S	.	.	H	α-helix	trans	-59.7	-52.9	175.1	-158.7	0	0	0	0	110.2	Q626 E627 Y632 E633 E634	Q626-S630 PolarHBondContact O-N 2.99Å; E627-S630 PolarHBondContact O-N 2.83Å; S630-Y632 PolarHBondContact O-N 2.7Å; S630-E633 PolarHBondContact O-N 3.39Å; S630-E633 VanDerWaalsContact O-N 3.1Å; S630-E634 WeakPolarHBondContact CB-OE1 3.29Å; S630-E634 WeakPolarHBondContact O-CB 3.46Å; S630-E634 VanDerWaalsContact O-CD 3.27Å; S630-E634 VanDerWaalsContact O-CG 3.22Å; S630-E634 WeakPolarHBondContact O-CG 3.4Å; S630-E634 PolarHBondContact O-N 2.9Å; S630-E634 PolarHBondContact OG-OE1 2.7Å
631	K	86.4	Confident	76.6	Confident	137 Å²	137	85.2 Å²	85.2	60%	0.596	47%	0.469	S	S	*	.	H	α-helix	trans	-59.9	-33.3	177.8	-68.4	171.6	-176.6	173.1	0	112.9	E627 A635	E627-K631 WeakPolarHBondContact O-CG 3.49Å; E627-K631 PolarHBondContact O-N 2.69Å; E627-K631 VanDerWaalsContact O-N 3.16Å; K631-A635 WeakPolarHBondContact O-CB 3.16Å; K631-A635 PolarHBondContact O-N 2.67Å
632	Y	85.6	Confident	74.4	Confident	33 Å²	33	93.9 Å²	93.9	13%	0.129	51%	0.505	C	S	.	.	H	α-helix	trans	-73.4	-41.6	174.9	179.6	-86.5	0	0	0	112.6	D565 N567 A568 P569 E628 M629 S630 A635 Q636	D565-Y632 WeakPolarHBondContact CB-OH 3.3Å; D565-Y632 PolarHBondContact OD2-OH 2.86Å; N567-Y632 HydrophobicContact CB-CE2 4.28Å; N567-Y632 WeakPolarHBondContact O-CD2 3.38Å; A568-Y632 VanDerWaalsContact CA-CE2 3.45Å; A568-Y632 HydrophobicContact CB-CE2 4.01Å; P569-Y632 HydrophobicContact CG-CG 4.28Å; E628-Y632 VanDerWaalsContact O-CB 3.28Å; E628-Y632 WeakPolarHBondContact O-CB 3.4Å; E628-Y632 PolarHBondContact O-N 3.4Å; M629-Y632 HydrophobicContact CE-CD1 4.38Å; M629-Y632 PolarHBondContact O-N 3.47Å; S630-Y632 PolarHBondContact O-N 2.7Å; Y632-A635 PolarHBondContact O-N 3.42Å; Y632-Q636 HydrophobicContact CE1-CG 4.22Å; Y632-Q636 VanDerWaalsContact CE1-OE1 3.29Å; Y632-Q636 HydrophobicContact CE2-CG 4.32Å; Y632-Q636 WeakPolarHBondContact O-CB 3.35Å; Y632-Q636 WeakPolarHBondContact O-CG 3.45Å; Y632-Q636 PolarHBondContact O-N 3.22Å; Y632-Q636 PolarHBondContact OH-NE2 3.33Å; Y632-Q636 PolarHBondContact OH-OE1 3.34Å
633	E	81.8	Confident	72.1	Confident	118 Å²	118	93.7 Å²	93.7	55%	0.551	52%	0.519	S	S	*	.	H	α-helix	trans	-68.4	-35.5	176	-74	179.9	-163.1	0	0	111.7	M629 S630	M629-E633 HydrophobicContact CE-CG 4.05Å; M629-E633 VanDerWaalsContact CE-OE1 3.26Å; M629-E633 WeakPolarHBondContact CE-OE1 3.33Å; M629-E633 WeakPolarHBondContact O-CB 3.46Å; M629-E633 WeakPolarHBondContact O-CG 3.47Å; M629-E633 PolarHBondContact O-N 3.16Å; S630-E633 PolarHBondContact O-N 3.39Å; S630-E633 VanDerWaalsContact O-N 3.1Å
634	E	81.9	Confident	69.6	Low	129 Å²	129	100.9 Å²	100.9	60%	0.603	55%	0.546	S	S	*	.	H	α-helix	trans	-62.7	-50.6	169.8	-70.8	154	-138.7	0	0	111.1	S630 Q636 G637	S630-E634 WeakPolarHBondContact CB-OE1 3.29Å; S630-E634 WeakPolarHBondContact O-CB 3.46Å; S630-E634 VanDerWaalsContact O-CD 3.27Å; S630-E634 VanDerWaalsContact O-CG 3.22Å; S630-E634 WeakPolarHBondContact O-CG 3.4Å; S630-E634 PolarHBondContact O-N 2.9Å; S630-E634 PolarHBondContact OG-OE1 2.7Å; E634-Q636 VanDerWaalsContact C-N 3.3Å; E634-Q636 PolarHBondContact O-N 2.93Å; E634-G637 PolarHBondContact O-N 2.94Å
635	A	77.9	Confident	66.8	Low	80 Å²	80	105 Å²	105	66%	0.661	57%	0.568	S	S	*	*	H	α-helix	trans	-71.1	-17	-178.5	0	0	0	0	0	114.8	K631 Y632	K631-A635 WeakPolarHBondContact O-CB 3.16Å; K631-A635 PolarHBondContact O-N 2.67Å; Y632-A635 PolarHBondContact O-N 3.42Å
636	Q	66.4	Low	64.1	Low	69 Å²	69	108 Å²	108	32%	0.322	59%	0.594	S	S	.	*	T	Hydrogen-bonded Turn	trans	-103.8	15.6	178.5	-67.4	-150.4	-28	0	0	115	D565 Y632 E634	D565-Q636 PolarHBondContact OD2-NE2 3.4Å; Y632-Q636 HydrophobicContact CE1-CG 4.22Å; Y632-Q636 VanDerWaalsContact CE1-OE1 3.29Å; Y632-Q636 HydrophobicContact CE2-CG 4.32Å; Y632-Q636 WeakPolarHBondContact O-CB 3.35Å; Y632-Q636 WeakPolarHBondContact O-CG 3.45Å; Y632-Q636 PolarHBondContact O-N 3.22Å; Y632-Q636 PolarHBondContact OH-NE2 3.33Å; Y632-Q636 PolarHBondContact OH-OE1 3.34Å; E634-Q636 VanDerWaalsContact C-N 3.3Å; E634-Q636 PolarHBondContact O-N 2.93Å
637	G	52.6	Low	61.5	Low	54 Å²	54	108.6 Å²	108.6	56%	0.557	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	54	66.1	156.1	0	0	0	0	0	115.9	E634 G639	E634-G637 PolarHBondContact O-N 2.94Å; G637-G639 PolarHBondContact O-N 3.36Å
638	S	43.4	Very low	58.8	Low	132 Å²	132	111 Å²	111	92%	0.923	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	55.9	2.6	163.4	72	0	0	0	0	119.6
639	G	46	Very low	56.2	Low	67 Å²	67	112.4 Å²	112.4	69%	0.691	64%	0.638	S	S	*	*			trans	-85.4	-8.2	-169	0	0	0	0	0	118.6	G637	G637-G639 PolarHBondContact O-N 3.36Å
640	L	49.8	Very low	53.7	Low	124 Å²	124	120 Å²	120	65%	0.649	67%	0.67	S	S	*	*	S	Bend	trans	-111.1	138.8	-168.1	-77.9	162.4	0	0	0	114.3	K642	L640-K642 PolarHBondContact O-N 3.04Å
641	P	42.2	Very low	51	Low	111 Å²	111	123.3 Å²	123.3	72%	0.721	69%	0.693	S	S	*	*			trans	-73.2	122.3	-176.6	28.9	-34	0	0	0	112.1	T643	P641-T643 PolarHBondContact O-N 3.29Å
642	K	42.4	Very low	48.4	Very low	209 Å²	209	120.9 Å²	120.9	91%	0.909	70%	0.698	S	S	*	*			trans	-50	109	-180	-66.4	-176.1	177	-177	0	111.9	L640	L640-K642 PolarHBondContact O-N 3.04Å
643	T	41.5	Very low	45.8	Very low	130 Å²	130	127.4 Å²	127.4	80%	0.798	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-83.2	132	175	-57	0	0	0	0	109	P641 Q645	P641-T643 PolarHBondContact O-N 3.29Å; T643-Q645 PolarHBondContact O-N 2.88Å; T643-Q645 VanDerWaalsContact O-N 3.12Å
644	K	38.2	Very low	43.5	Very low	204 Å²	204	128.5 Å²	128.5	89%	0.887	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-53.7	117.1	-172.7	-67.4	-173.2	177.2	-175.4	0	112.1
645	Q	36.4	Very low	41.2	Very low	160 Å²	160	128.7 Å²	128.7	75%	0.748	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-68.5	144	165.5	-66.8	-174.8	-0.8	0	0	109.8	T643	T643-Q645 PolarHBondContact O-N 2.88Å; T643-Q645 VanDerWaalsContact O-N 3.12Å
646	P	33.2	Very low	39	Very low	117 Å²	117	130.5 Å²	130.5	76%	0.76	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-75.3	126.1	171.2	30.7	-32.3	0	0	0	110.2
647	T	32.9	Very low	37.6	Very low	134 Å²	134	136.6 Å²	136.6	82%	0.822	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-70.1	135.9	176.9	39.8	0	0	0	0	111.5
648	M	34.1	Very low	36.8	Very low	158 Å²	158	139.6 Å²	139.6	78%	0.778	78%	0.783	S	S	*	*			trans	-132.5	68.2	-177.1	-87.8	-72.5	-57.2	0	0	110.6
649	S	34.2	Very low	36.5	Very low	101 Å²	101	140.5 Å²	140.5	71%	0.706	78%	0.776	S	S	*	*			trans	-165.6	141.6	175.4	44.6	0	0	0	0	109.6
650	K	33.9	Very low	36	Very low	196 Å²	196	143.7 Å²	143.7	85%	0.852	78%	0.776	S	S	*	*			cis	-144.9	133.7	-12.7	-102.8	174.5	179.9	178.2	0	106.9	A652	K650-A652 PolarHBondContact O-N 2.93Å; K650-A652 VanDerWaalsContact O-N 3.08Å
651	S	30.6	Very low	35.5	Very low	127 Å²	127	144.7 Å²	144.7	89%	0.888	78%	0.782	S	S	*	*			trans	-77.9	87.6	167.5	52.1	0	0	0	0	109.9	K653	S651-K653 PolarHBondContact O-N 3.34Å
652	A	32.2	Very low	35.4	Very low	86 Å²	86	144.2 Å²	144.2	71%	0.711	78%	0.777	S	S	*	*			trans	-88.3	97.3	173.8	0	0	0	0	0	110.1	K650 V654	K650-A652 PolarHBondContact O-N 2.93Å; K650-A652 VanDerWaalsContact O-N 3.08Å; A652-V654 PolarHBondContact O-N 3Å
653	K	30.8	Very low	35.2	Very low	169 Å²	169	142.2 Å²	142.2	74%	0.735	77%	0.771	S	S	*	*			trans	-72.8	103.8	170.5	-177	-165.5	177.3	-148.3	0	108	S651 E655	S651-K653 PolarHBondContact O-N 3.34Å; K653-E655 HydrophobicContact CD-CG 4.33Å; K653-E655 HydrophobicContact CG-CG 4.4Å; K653-E655 IonicContact NZ-OE1 3.2Å; K653-E655 PolarHBondContact NZ-OE1 2.87Å; K653-E655 PolarHBondContact O-N 2.59Å
654	V	33.1	Very low	35.2	Very low	141 Å²	141	143.1 Å²	143.1	86%	0.855	77%	0.77	S	S	*	*			trans	-74.9	115.7	171.8	178.6	0	0	0	0	107.7	A652	A652-V654 PolarHBondContact O-N 3Å
655	E	34.2	Very low	35.4	Very low	133 Å²	133	137.8 Å²	137.8	62%	0.621	76%	0.759	S	S	*	*			trans	-87.2	146.9	177.7	-62.4	-169.8	139.4	0	0	110.6	K653 K657	K653-E655 HydrophobicContact CD-CG 4.33Å; K653-E655 HydrophobicContact CG-CG 4.4Å; K653-E655 IonicContact NZ-OE1 3.2Å; K653-E655 PolarHBondContact NZ-OE1 2.87Å; K653-E655 PolarHBondContact O-N 2.59Å; E655-K657 PolarHBondContact O-N 2.9Å
656	S	30.7	Very low	36.1	Very low	118 Å²	118	137.4 Å²	137.4	83%	0.825	76%	0.762	S	S	*	*			trans	-61.6	119.4	177.9	50.1	0	0	0	0	111.2
657	K	36.9	Very low	36.9	Very low	198 Å²	198	141.6 Å²	141.6	86%	0.861	79%	0.794	S	S	*	*			trans	-107.8	109.8	155.3	-83.9	-164.1	169.9	-169.4	0	109.8	E655	E655-K657 PolarHBondContact O-N 2.9Å
658	V	35.8	Very low	37.1	Very low	116 Å²	116	142 Å²	142	70%	0.703	79%	0.793	S	S	*	*			trans	-59.4	133.8	160	171.8	0	0	0	0	108	I660	V658-I660 HydrophobicContact CG1-CD1 3.62Å; V658-I660 HydrophobicContact CG1-CG1 3.64Å
659	I	38	Very low	37.3	Very low	152 Å²	152	141.1 Å²	141.1	78%	0.779	79%	0.793	S	S	*	*			trans	-104.8	121	163.1	-63.4	177.3	0	0	0	106.3
660	I	35.3	Very low	37.5	Very low	133 Å²	133	143.3 Å²	143.3	68%	0.682	80%	0.798	S	S	*	*			trans	-127.2	102.4	166.3	-69.4	160.4	0	0	0	105.4	V658 V662	V658-I660 HydrophobicContact CG1-CD1 3.62Å; V658-I660 HydrophobicContact CG1-CG1 3.64Å; I660-V662 HydrophobicContact CG2-CG2 4.38Å
661	D	38	Very low	37.7	Very low	145 Å²	145	140.2 Å²	140.2	78%	0.775	80%	0.795	S	S	*	*			trans	-118.3	105.5	147.2	-78.5	-55.7	0	0	0	103.2
662	V	40.9	Very low	38.1	Very low	102 Å²	102	141.1 Å²	141.1	62%	0.618	79%	0.789	S	S	*	*				70.4	92.7	75.1	179.5	0	0	0	0	110.9	I660	I660-V662 HydrophobicContact CG2-CG2 4.38Å
663	Q	38.5	Very low	38.5	Very low	167 Å²	167	144.7 Å²	144.7	78%	0.78	79%	0.794	S	S	*	*			trans	36.1	117.8	138.2	-59.5	-178.4	-113.8	0	0	119.7
664	D	40.7	Very low	39.1	Very low	148 Å²	148	143 Å²	143	79%	0.791	80%	0.799	S	S	*	*				154.1	140.5	123.5	-78.6	-11.7	0	0	0	107.9
665	S	43.6	Very low	39.5	Very low	92 Å²	92	143.2 Å²	143.2	64%	0.643	79%	0.794	S	S	*	*			cis	172.9	149.7	-16.3	48	0	0	0	0	104.4
666	D	51	Low	40	Very low	152 Å²	152	144 Å²	144	81%	0.813	81%	0.809	S	S	*	*			trans	56.9	90.2	162.3	-57.6	-7.8	0	0	0	120.2
667	S	50.1	Low	40.8	Very low	205 Å²	205	146.4 Å²	146.4	100%	1.434	81%	0.807	S	S	*	*				-169.9	0	126.9	-76.7	0	0	0	0	111.5

Retrieved 667 of 667 residues in 407.4 ms (Link to these results)

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