A0A087XGP2_POEFO Loading...

DnaJ homolog subfamily C member 11

Required for mitochondrial inner membrane organization. Seems to function through its association with the MICOS complex and the mitochondrial outer membrane sorting assembly machinery (SAM) complex.

AlphaFold DB , UniProt , Accession A0A087XGP2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 558 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	30.5	Very low	32.4	Very low	237 Å²	237	129.4 Å²	129.4	100%	1.167	75%	0.748	S	S	*	*				0	77.9	0	-70.1	179	167	0	0	105.4
2	A	30.4	Very low	33.5	Very low	94 Å²	94	122 Å²	122	78%	0.777	70%	0.704	S	S	*	*				52.9	121.2	57	0	0	0	0	0	111.8
3	S	30.3	Very low	35.4	Very low	125 Å²	125	117.9 Å²	117.9	87%	0.874	68%	0.678	S	S	*	*			trans	84.2	92.2	178.2	83.9	0	0	0	0	118.1
4	A	26.5	Very low	38.2	Very low	85 Å²	85	110.4 Å²	110.4	70%	0.702	63%	0.634	S	S	*	*			trans	-179.7	79.1	132	0	0	0	0	0	106.6	D6	A4-D6 PolarHBondContact O-N 3.22Å
5	L	30	Very low	41.4	Very low	174 Å²	174	103.2 Å²	103.2	91%	0.911	59%	0.593	S	S	*	*			trans	-79.9	104.8	163.8	-72	163.8	0	0	0	104.2	D7	L5-D7 PolarHBondContact O-N 2.91Å
6	D	28.5	Very low	44.2	Very low	156 Å²	156	96.9 Å²	96.9	83%	0.834	56%	0.556	S	S	*	*			trans	-73	108.6	173.3	-76.5	-26.8	0	0	0	107.7	A4	A4-D6 PolarHBondContact O-N 3.22Å
7	D	34.2	Very low	46.6	Very low	139 Å²	139	91.4 Å²	91.4	74%	0.743	52%	0.524	S	S	*	.			trans	-55.8	157.2	157.2	-80.4	-42.9	0	0	0	110	L5	L5-D7 PolarHBondContact O-N 2.91Å
8	D	34.8	Very low	48.7	Very low	136 Å²	136	87.2 Å²	87.2	73%	0.727	50%	0.5	S	S	*	.			trans	93.4	72.9	169.6	-54.5	-29.8	0	0	0	118
9	E	33.8	Very low	50.8	Low	142 Å²	142	83 Å²	83	66%	0.664	48%	0.476	S	S	*	.			trans	-152.1	66	132.9	-115.5	178.8	-179.6	0	0	108.5	S11 K97	E9-S11 PolarHBondContact O-N 3.44Å; E9-K97 IonicContact OE2-NZ 3.63Å; E9-K97 PolarHBondContact OE2-NZ 2.96Å
10	I	37.1	Very low	52.6	Low	64 Å²	64	80.3 Å²	80.3	33%	0.328	46%	0.46	S	S	.	.			trans	-73.5	97.2	174.4	-56.2	171.1	0	0	0	107.5	N12 T542	I10-N12 PolarHBondContact O-N 2.96Å; I10-T542 HydrophobicContact CD1-CG2 3.96Å
11	S	40.8	Very low	54.3	Low	71 Å²	71	77 Å²	77	50%	0.497	44%	0.441	S	S	.	.			trans	-56.1	123	159.1	56.7	0	0	0	0	107.3	E9 D13 D14	E9-S11 PolarHBondContact O-N 3.44Å; S11-D13 PolarHBondContact O-N 3.36Å; S11-D14 PolarHBondContact O-N 3.19Å; S11-D14 VanDerWaalsContact O-N 3.17Å
12	N	45.5	Very low	56.9	Low	41 Å²	41	70.6 Å²	70.6	22%	0.219	40%	0.404	C	S	.	.	S	Bend	trans	-62.6	16.1	179.6	-108	-20.5	0	0	0	115.2	I10 S508 G509	I10-N12 PolarHBondContact O-N 2.96Å; N12-S508 VanDerWaalsContact CG-OG 3.24Å; N12-S508 VanDerWaalsContact ND2-CB 3.33Å; N12-S508 WeakPolarHBondContact ND2-CB 3.41Å; N12-S508 PolarHBondContact ND2-OG 3.16Å; N12-S508 VanDerWaalsContact OD1-CB 3.25Å; N12-S508 WeakPolarHBondContact OD1-CB 3.36Å; N12-S508 PolarHBondContact OD1-O 3.05Å; N12-S508 PolarHBondContact OD1-OG 2.89Å; N12-G509 WeakPolarHBondContact OD1-CA 3.35Å; N12-G509 PolarHBondContact OD1-N 3.03Å
13	D	57.8	Low	59.4	Low	69 Å²	69	72.9 Å²	72.9	37%	0.369	39%	0.393	S	S	.	.			trans	-117.8	39.5	172.3	-55.1	-28.8	0	0	0	109.1	S11 Y15 Y78 K433	S11-D13 PolarHBondContact O-N 3.36Å; D13-Y15 PolarHBondContact O-N 3.24Å; D13-Y78 PolarHBondContact O-OH 3.23Å; D13-K433 IonicContact OD1-NZ 3.31Å; D13-K433 PolarHBondContact OD1-NZ 2.94Å
14	D	74.8	Confident	61.9	Low	12 Å²	12	74.3 Å²	74.3	6%	0.064	39%	0.385	C	S	.	.			trans	-72.5	115.1	171	-171.1	-15.2	0	0	0	108.3	S11 Y16 S17 L18 R23 Y78	S11-D14 PolarHBondContact O-N 3.19Å; S11-D14 VanDerWaalsContact O-N 3.17Å; D14-Y16 PolarHBondContact O-N 3.46Å; D14-Y16 WeakPolarHBondContact OD1-CB 3.39Å; D14-Y16 VanDerWaalsContact OD1-CD2 3.28Å; D14-Y16 WeakPolarHBondContact OD1-CD2 3.36Å; D14-Y16 PolarHBondContact OD1-N 3.09Å; D14-S17 WeakPolarHBondContact O-CA 3.39Å; D14-S17 WeakPolarHBondContact O-CB 3.33Å; D14-S17 PolarHBondContact O-N 2.74Å; D14-S17 PolarHBondContact O-OG 2.91Å; D14-L18 PolarHBondContact O-N 3.06Å; D14-R23 IonicContact OD2-NH2 2.67Å; D14-Y78 VanDerWaalsContact CA-OH 3.27Å; D14-Y78 WeakPolarHBondContact CA-OH 3.37Å
15	Y	86.2	Confident	64.6	Low	3 Å²	3	70.3 Å²	70.3	1%	0.012	35%	0.353	C	S	.	.	H	α-helix	trans	-60.1	-29.3	-179.3	-68.9	-25.1	0	0	0	111.9	D13 L19 E64 A65 V68 Y78 K83 L86	D13-Y15 PolarHBondContact O-N 3.24Å; Y15-L19 WeakPolarHBondContact O-CG 3.41Å; Y15-L19 PolarHBondContact O-N 3.29Å; Y15-L19 VanDerWaalsContact O-N 3.14Å; Y15-E64 PolarHBondContact OH-OE1 2.83Å; Y15-A65 HydrophobicContact CD1-CB 3.55Å; Y15-A65 HydrophobicContact CD2-CB 4.43Å; Y15-A65 HydrophobicContact CE1-CB 4.17Å; Y15-A65 HydrophobicContact CG-CB 3.7Å; Y15-V68 HydrophobicContact CD2-CB 4.09Å; Y15-V68 HydrophobicContact CD2-CG1 3.91Å; Y15-V68 HydrophobicContact CE2-CB 3.94Å; Y15-V68 HydrophobicContact CE2-CG1 3.9Å; Y15-V68 HydrophobicContact CE2-CG2 3.88Å; Y15-Y78 HydrophobicContact CD2-CD1 4.39Å; Y15-Y78 AromaticContact CD2-CD2 3.78Å; Y15-Y78 HydrophobicContact CD2-CD2 3.78Å; Y15-Y78 AromaticContact CD2-CE1 4Å; Y15-Y78 HydrophobicContact CD2-CE1 4Å; Y15-Y78 AromaticContact CD2-CE2 3.28Å; Y15-Y78 HydrophobicContact CD2-CE2 3.28Å; Y15-Y78 HydrophobicContact CD2-CG 4.29Å; Y15-Y78 AromaticContact CD2-CZ 3.43Å; Y15-Y78 VanDerWaalsContact CD2-CZ 3.43Å; Y15-Y78 AromaticContact CE2-CD2 3.92Å; Y15-Y78 HydrophobicContact CE2-CD2 3.92Å; Y15-Y78 AromaticContact CE2-CE2 3.53Å; Y15-Y78 HydrophobicContact CE2-CE2 3.53Å; Y15-Y78 HydrophobicContact CG-CE1 4.28Å; Y15-Y78 AromaticContact CG-CE2 3.95Å; Y15-Y78 HydrophobicContact CG-CE2 3.95Å; Y15-Y78 AromaticContact CG-CZ 3.68Å; Y15-Y78 PolarHBondContact N-OH 3.13Å; Y15-K83 HydrophobicContact CE1-CD 4.24Å; Y15-K83 VanDerWaalsContact OH-CD 3.24Å; Y15-K83 WeakPolarHBondContact OH-CD 3.41Å; Y15-K83 WeakPolarHBondContact OH-CE 3.43Å; Y15-K83 WeakPolarHBondContact OH-CG 3.28Å; Y15-K83 PolarHBondContact OH-NZ 3.16Å; Y15-L86 HydrophobicContact CE2-CD1 3.87Å
16	Y	86.8	Confident	67.4	Low	3 Å²	3	65.6 Å²	65.6	1%	0.012	33%	0.331	C	S	.	.	H	α-helix	trans	-68	-40.7	172.7	-64.7	-75.2	0	0	0	111.5	D14 N20 V21 R22 R23 L69 R75 Y78 D79	D14-Y16 PolarHBondContact O-N 3.46Å; D14-Y16 WeakPolarHBondContact OD1-CB 3.39Å; D14-Y16 VanDerWaalsContact OD1-CD2 3.28Å; D14-Y16 WeakPolarHBondContact OD1-CD2 3.36Å; D14-Y16 PolarHBondContact OD1-N 3.09Å; Y16-N20 WeakPolarHBondContact O-CA 3.36Å; Y16-N20 PolarHBondContact O-N 3.25Å; Y16-V21 HydrophobicContact CD1-CG2 4.05Å; Y16-V21 PolarHBondContact O-N 2.82Å; Y16-R22 WeakPolarHBondContact CD1-O 3.02Å; Y16-R23 HydrophobicContact CD1-CG 4.36Å; Y16-R23 HydrophobicContact CD2-CG 3.92Å; Y16-R23 HydrophobicContact CE2-CG 4.05Å; Y16-R23 HydrophobicContact CG-CG 4.08Å; Y16-L69 HydrophobicContact CD1-CD1 3.97Å; Y16-L69 HydrophobicContact CD1-CD2 4.38Å; Y16-L69 HydrophobicContact CD2-CD2 4.39Å; Y16-L69 HydrophobicContact CE1-CD1 4.02Å; Y16-L69 HydrophobicContact CE1-CD2 3.74Å; Y16-L69 HydrophobicContact CE1-CG 4.47Å; Y16-L69 HydrophobicContact CE2-CD2 3.78Å; Y16-L69 HydrophobicContact CG-CD1 4.35Å; Y16-L69 VanDerWaalsContact CZ-CD2 3.42Å; Y16-R75 WeakPolarHBondContact OH-CG 3.33Å; Y16-R75 PolarHBondContact OH-NE 3.06Å; Y16-Y78 HydrophobicContact CD2-CE1 4.03Å; Y16-Y78 AromaticContact CE2-CD1 3.97Å; Y16-Y78 HydrophobicContact CE2-CD1 3.97Å; Y16-Y78 AromaticContact CE2-CE1 3.91Å; Y16-Y78 HydrophobicContact CE2-CE1 3.91Å; Y16-D79 WeakPolarHBondContact CE2-OD1 3.28Å; Y16-D79 VanDerWaalsContact CZ-OD1 3.29Å; Y16-D79 PolarHBondContact OH-OD1 3.1Å; Y16-D79 PolarHBondContact OH-OD2 3.11Å
17	S	83.6	Confident	70.2	Confident	2 Å²	2	64 Å²	64	1%	0.014	32%	0.319	C	S	.	.	H	α-helix	trans	-66	-43.5	176.3	76.7	0	0	0	0	111.4	D14 L19 N20 L510	D14-S17 WeakPolarHBondContact O-CA 3.39Å; D14-S17 WeakPolarHBondContact O-CB 3.33Å; D14-S17 PolarHBondContact O-N 2.74Å; D14-S17 PolarHBondContact O-OG 2.91Å; S17-L19 PolarHBondContact O-N 3.45Å; S17-N20 WeakPolarHBondContact O-CA 3.38Å; S17-N20 PolarHBondContact O-N 3Å; S17-L510 WeakPolarHBondContact O-CD2 3.47Å
18	L	86	Confident	72.8	Confident	17 Å²	17	65.1 Å²	65.1	9%	0.089	32%	0.319	C	S	.	.	H	α-helix	trans	-59.3	-46.8	179.1	-178.6	84.4	0	0	0	112.2	D14 N20 L61 V62 A65 P511	D14-L18 PolarHBondContact O-N 3.06Å; L18-N20 PolarHBondContact O-N 3.44Å; L18-L61 HydrophobicContact CD1-CD2 3.43Å; L18-L61 VanDerWaalsContact CD1-CD2 3.43Å; L18-L61 HydrophobicContact CD2-CD2 3.31Å; L18-L61 HydrophobicContact CG-CD2 3.96Å; L18-V62 HydrophobicContact CD2-CG2 4.05Å; L18-V62 HydrophobicContact CG-CG2 4.41Å; L18-A65 HydrophobicContact CD2-CB 3.57Å; L18-P511 HydrophobicContact CD1-CG 3.9Å
19	L	87.4	Confident	75.3	Confident	7 Å²	7	63.8 Å²	63.8	4%	0.037	31%	0.309	C	S	.	.	H	α-helix	trans	-79	-7.3	177.9	-62.9	-177.9	0	0	0	112.7	Y15 S17 V21 L30 A33 L37 V62 A65 L69	Y15-L19 WeakPolarHBondContact O-CG 3.41Å; Y15-L19 PolarHBondContact O-N 3.29Å; Y15-L19 VanDerWaalsContact O-N 3.14Å; S17-L19 PolarHBondContact O-N 3.45Å; L19-V21 HydrophobicContact CB-CG1 4.25Å; L19-V21 HydrophobicContact CB-CG2 3.83Å; L19-L30 HydrophobicContact CD1-CD2 4.11Å; L19-A33 HydrophobicContact CB-CB 4.41Å; L19-L37 HydrophobicContact CD2-CD1 3.65Å; L19-V62 HydrophobicContact CD2-CG1 4.1Å; L19-A65 HydrophobicContact CD1-CB 4.37Å; L19-A65 HydrophobicContact CG-CB 4.29Å; L19-L69 HydrophobicContact CD1-CD1 3.96Å
20	N	86.4	Confident	77.9	Confident	28 Å²	28	57 Å²	57	15%	0.15	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.4	52.3	-172.1	-173.8	35.5	0	0	0	112.3	Y16 S17 L18 I501 L510	Y16-N20 WeakPolarHBondContact O-CA 3.36Å; Y16-N20 PolarHBondContact O-N 3.25Å; S17-N20 WeakPolarHBondContact O-CA 3.38Å; S17-N20 PolarHBondContact O-N 3Å; L18-N20 PolarHBondContact O-N 3.44Å; N20-I501 PolarHBondContact ND2-O 2.78Å; N20-L510 HydrophobicContact CB-CD2 4.07Å
21	V	88.1	Confident	80.4	Confident	13 Å²	13	59.1 Å²	59.1	8%	0.079	28%	0.284	C	S	.	.			trans	-125.1	162.8	179.9	-65.3	0	0	0	0	110.7	Y16 L19 A25 L30 A33 T503	Y16-V21 HydrophobicContact CD1-CG2 4.05Å; Y16-V21 PolarHBondContact O-N 2.82Å; L19-V21 HydrophobicContact CB-CG1 4.25Å; L19-V21 HydrophobicContact CB-CG2 3.83Å; V21-A25 HydrophobicContact CB-CB 3.95Å; V21-A25 HydrophobicContact CG2-CB 4.4Å; V21-L30 HydrophobicContact CB-CD2 4.46Å; V21-L30 HydrophobicContact CG2-CD2 3.69Å; V21-A33 HydrophobicContact CG1-CB 3.76Å; V21-T503 PolarHBondContact O-OG1 2.81Å
22	R	85.7	Confident	82.6	Confident	101 Å²	101	57.7 Å²	57.7	38%	0.381	28%	0.276	S	S	.	.			trans	-82.9	158.6	178	-66.9	179.2	174.8	-159.4	-17.5	110.7	Y16 E24 A25 T503	Y16-R22 WeakPolarHBondContact CD1-O 3.02Å; R22-E24 PolarHBondContact O-N 2.77Å; R22-A25 WeakPolarHBondContact O-CB 3.29Å; R22-A25 PolarHBondContact O-N 2.78Å; R22-T503 HydrophobicContact CG-CG2 3.77Å
23	R	82.8	Confident	84.6	Confident	143 Å²	143	56.1 Å²	56.1	54%	0.54	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-26.8	174.1	-70.4	-171.2	175.9	-167.2	-0.9	112.7	D14 Y16 A25 R75	D14-R23 IonicContact OD2-NH2 2.67Å; Y16-R23 HydrophobicContact CD1-CG 4.36Å; Y16-R23 HydrophobicContact CD2-CG 3.92Å; Y16-R23 HydrophobicContact CE2-CG 4.05Å; Y16-R23 HydrophobicContact CG-CG 4.08Å; R23-A25 VanDerWaalsContact C-N 3.35Å; R23-R75 PolarHBondContact O-NH2 3.16Å
24	E	82.5	Confident	86.1	Confident	154 Å²	154	54.7 Å²	54.7	72%	0.72	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	11.8	174.2	-49.8	76.1	-164.7	0	0	113.4	R22 T26	R22-E24 PolarHBondContact O-N 2.77Å; E24-T26 PolarHBondContact O-N 2.89Å
25	A	83.9	Confident	86.8	Confident	2 Å²	2	60.7 Å²	60.7	2%	0.017	28%	0.28	C	S	.	.			trans	-59.7	138.9	-175.6	0	0	0	0	0	112.3	V21 R22 R23 E29 L30 R75	V21-A25 HydrophobicContact CB-CB 3.95Å; V21-A25 HydrophobicContact CG2-CB 4.4Å; R22-A25 WeakPolarHBondContact O-CB 3.29Å; R22-A25 PolarHBondContact O-N 2.78Å; R23-A25 VanDerWaalsContact C-N 3.35Å; A25-E29 WeakPolarHBondContact CA-OE2 3.22Å; A25-E29 HydrophobicContact CB-CB 4.37Å; A25-L30 HydrophobicContact CB-CG 4.46Å; A25-R75 PolarHBondContact O-NH1 3.31Å; A25-R75 VanDerWaalsContact O-NH1 3.14Å; A25-R75 PolarHBondContact O-NH2 2.67Å
26	T	89.4	Confident	86.7	Confident	74 Å²	74	65.7 Å²	65.7	45%	0.454	30%	0.299	S	S	.	.			trans	-74.4	160.5	178.1	66.2	0	0	0	0	111.2	E24 E28 E29 L30	E24-T26 PolarHBondContact O-N 2.89Å; T26-E28 PolarHBondContact O-N 2.74Å; T26-E29 PolarHBondContact N-OE2 3.33Å; T26-E29 PolarHBondContact O-N 3.42Å; T26-E29 VanDerWaalsContact O-N 3.12Å; T26-E29 WeakPolarHBondContact OG1-CG 3.34Å; T26-E29 PolarHBondContact OG1-N 3.32Å; T26-L30 PolarHBondContact O-N 2.79Å
27	Q	86.7	Confident	86.6	Confident	124 Å²	124	66.2 Å²	66.2	58%	0.579	30%	0.302	S	S	*	.	H	α-helix	trans	-62.1	-29.7	179.3	-153.4	176.7	35.3	0	0	112.3	K31 S70	Q27-K31 WeakPolarHBondContact O-CB 3.36Å; Q27-K31 PolarHBondContact O-N 3.21Å; Q27-S70 PolarHBondContact NE2-O 3.29Å
28	E	87.8	Confident	86.7	Confident	162 Å²	162	66.9 Å²	66.9	76%	0.757	31%	0.306	S	S	*	.	H	α-helix	trans	-67.1	-43	174.5	-63.2	-172.4	172.4	0	0	112.1	T26 K31 A32	T26-E28 PolarHBondContact O-N 2.74Å; E28-K31 PolarHBondContact O-N 2.88Å; E28-A32 WeakPolarHBondContact O-CB 3.36Å; E28-A32 PolarHBondContact O-N 3.1Å
29	E	87.3	Confident	86.7	Confident	107 Å²	107	72.2 Å²	72.2	50%	0.5	33%	0.332	S	S	.	.	H	α-helix	trans	-63.9	-44.5	175.8	-72.2	175.9	169.3	0	0	111.3	A25 T26 K31 A32 A33	A25-E29 WeakPolarHBondContact CA-OE2 3.22Å; A25-E29 HydrophobicContact CB-CB 4.37Å; T26-E29 PolarHBondContact N-OE2 3.33Å; T26-E29 PolarHBondContact O-N 3.42Å; T26-E29 VanDerWaalsContact O-N 3.12Å; T26-E29 WeakPolarHBondContact OG1-CG 3.34Å; T26-E29 PolarHBondContact OG1-N 3.32Å; E29-K31 PolarHBondContact O-N 3.12Å; E29-A32 PolarHBondContact O-N 3.27Å; E29-A33 WeakPolarHBondContact O-CB 3.48Å; E29-A33 PolarHBondContact O-N 3.34Å
30	L	88.8	Confident	86.4	Confident	1 Å²	1	72.9 Å²	72.9	1%	0.005	34%	0.336	C	S	.	.	H	α-helix	trans	-58.7	-47.8	175.1	-71.6	173.1	0	0	0	111.6	L19 V21 A25 T26 A32 A33 Y34 Y66 L69	L19-L30 HydrophobicContact CD1-CD2 4.11Å; V21-L30 HydrophobicContact CB-CD2 4.46Å; V21-L30 HydrophobicContact CG2-CD2 3.69Å; A25-L30 HydrophobicContact CB-CG 4.46Å; T26-L30 PolarHBondContact O-N 2.79Å; L30-A32 VanDerWaalsContact C-N 3.29Å; L30-A32 PolarHBondContact O-N 3.05Å; L30-A33 PolarHBondContact O-N 2.62Å; L30-Y34 WeakPolarHBondContact O-CB 3.48Å; L30-Y34 PolarHBondContact O-N 3.21Å; L30-Y66 HydrophobicContact CB-CD2 4.44Å; L30-Y66 HydrophobicContact CB-CE2 4.38Å; L30-L69 HydrophobicContact CD1-CB 4.13Å; L30-L69 WeakPolarHBondContact CD1-O 3.4Å; L30-L69 HydrophobicContact CD2-CB 4.21Å; L30-L69 HydrophobicContact CD2-CD1 4.16Å
31	K	89.5	Confident	86.3	Confident	108 Å²	108	71.7 Å²	71.7	47%	0.47	33%	0.329	S	S	.	.	H	α-helix	trans	-66.6	-30.6	178.8	-170	175.6	-176.2	175	0	112.7	Q27 E28 E29 R35 Y66	Q27-K31 WeakPolarHBondContact O-CB 3.36Å; Q27-K31 PolarHBondContact O-N 3.21Å; E28-K31 PolarHBondContact O-N 2.88Å; E29-K31 PolarHBondContact O-N 3.12Å; K31-R35 WeakPolarHBondContact O-CB 3.25Å; K31-R35 VanDerWaalsContact O-CG 3.32Å; K31-R35 WeakPolarHBondContact O-CG 3.22Å; K31-R35 PolarHBondContact O-N 2.76Å; K31-R35 PolarHBondContact O-NE 3.32Å; K31-Y66 HydrophobicContact CB-CE2 4.12Å
32	A	88.1	Confident	86.1	Confident	41 Å²	41	74.3 Å²	74.3	34%	0.339	34%	0.341	S	S	.	.	H	α-helix	trans	-74.1	-38.8	175.3	0	0	0	0	0	112.2	E28 E29 L30 R36	E28-A32 WeakPolarHBondContact O-CB 3.36Å; E28-A32 PolarHBondContact O-N 3.1Å; E29-A32 PolarHBondContact O-N 3.27Å; L30-A32 VanDerWaalsContact C-N 3.29Å; L30-A32 PolarHBondContact O-N 3.05Å; A32-R36 PolarHBondContact O-N 3.38Å
33	A	86.4	Confident	86.1	Confident	7 Å²	7	70.7 Å²	70.7	6%	0.058	33%	0.331	C	S	.	.	H	α-helix	trans	-66.7	-48.8	174.6	0	0	0	0	0	111.4	L19 V21 E29 L30 R35 R36 L37	L19-A33 HydrophobicContact CB-CB 4.41Å; V21-A33 HydrophobicContact CG1-CB 3.76Å; E29-A33 WeakPolarHBondContact O-CB 3.48Å; E29-A33 PolarHBondContact O-N 3.34Å; L30-A33 PolarHBondContact O-N 2.62Å; A33-R35 PolarHBondContact O-N 3.06Å; A33-R36 WeakPolarHBondContact O-CB 3.26Å; A33-R36 PolarHBondContact O-N 3.46Å; A33-R36 VanDerWaalsContact O-N 3.16Å; A33-L37 PolarHBondContact O-N 2.94Å; A33-L37 VanDerWaalsContact O-N 3.11Å
34	Y	90.4	Very high	86.2	Confident	39 Å²	39	69.8 Å²	69.8	15%	0.153	34%	0.336	C	S	.	.	H	α-helix	trans	-55.2	-53.2	177.8	173.3	-113.7	0	0	0	112.6	L30 R36 L37 C38 V62 H63 Y66	L30-Y34 WeakPolarHBondContact O-CB 3.48Å; L30-Y34 PolarHBondContact O-N 3.21Å; Y34-R36 PolarHBondContact O-N 2.87Å; Y34-R36 VanDerWaalsContact O-N 3.14Å; Y34-L37 PolarHBondContact O-N 3.04Å; Y34-C38 WeakPolarHBondContact CE2-SG 3.42Å; Y34-C38 WeakPolarHBondContact O-CB 3.47Å; Y34-C38 PolarHBondContact O-N 2.86Å; Y34-C38 PolarHBondContact O-SG 3.12Å; Y34-C38 VanDerWaalsContact O-SG 3.36Å; Y34-V62 HydrophobicContact CD2-CG1 3.76Å; Y34-V62 HydrophobicContact CE2-CG1 4.11Å; Y34-H63 HydrophobicContact CE2-CB 4.2Å; Y34-H63 AromaticContact CE2-ND1 3.92Å; Y34-H63 AromaticContact CZ-ND1 3.62Å; Y34-H63 PolarHBondContact OH-ND1 2.75Å; Y34-Y66 AromaticContact CD1-CD1 3.89Å; Y34-Y66 HydrophobicContact CD1-CD1 3.89Å; Y34-Y66 HydrophobicContact CD1-CD2 4.13Å; Y34-Y66 HydrophobicContact CD1-CE1 4.14Å; Y34-Y66 HydrophobicContact CD1-CE2 4.36Å; Y34-Y66 AromaticContact CD1-CG 3.88Å; Y34-Y66 HydrophobicContact CD1-CG 3.88Å; Y34-Y66 HydrophobicContact CD2-CD1 4.24Å; Y34-Y66 HydrophobicContact CD2-CD2 4.36Å; Y34-Y66 AromaticContact CD2-CG 3.75Å; Y34-Y66 HydrophobicContact CD2-CG 3.75Å; Y34-Y66 HydrophobicContact CE1-CD1 4.05Å; Y34-Y66 HydrophobicContact CE1-CE1 4.35Å; Y34-Y66 HydrophobicContact CE1-CG 4.42Å; Y34-Y66 HydrophobicContact CE2-CD1 4.41Å; Y34-Y66 HydrophobicContact CE2-CG 4.32Å; Y34-Y66 AromaticContact CG-CD1 3.99Å; Y34-Y66 HydrophobicContact CG-CD1 3.99Å; Y34-Y66 AromaticContact CG-CD2 3.74Å; Y34-Y66 HydrophobicContact CG-CD2 3.74Å; Y34-Y66 HydrophobicContact CG-CE2 4.37Å; Y34-Y66 AromaticContact CG-CG 3.51Å; Y34-Y66 HydrophobicContact CG-CG 3.51Å
35	R	88.1	Confident	86	Confident	139 Å²	139	67.3 Å²	67.3	53%	0.525	32%	0.323	S	S	.	.	H	α-helix	trans	-55.2	-36.7	178.6	-79.5	-176.8	-75.3	171.6	-4.9	112.9	K31 A33 M39	K31-R35 WeakPolarHBondContact O-CB 3.25Å; K31-R35 VanDerWaalsContact O-CG 3.32Å; K31-R35 WeakPolarHBondContact O-CG 3.22Å; K31-R35 PolarHBondContact O-N 2.76Å; K31-R35 PolarHBondContact O-NE 3.32Å; A33-R35 PolarHBondContact O-N 3.06Å; R35-M39 VanDerWaalsContact O-CG 3.31Å; R35-M39 WeakPolarHBondContact O-CG 3.23Å; R35-M39 PolarHBondContact O-N 3.36Å; R35-M39 VanDerWaalsContact O-N 3.16Å
36	R	85.1	Confident	85.7	Confident	108 Å²	108	68.2 Å²	68.2	41%	0.408	33%	0.327	S	S	.	.	H	α-helix	trans	-69.2	-48.9	-179.4	-168.9	-169.9	-44	173.1	11.3	111.5	A32 A33 Y34 M39 L40	A32-R36 PolarHBondContact O-N 3.38Å; A33-R36 WeakPolarHBondContact O-CB 3.26Å; A33-R36 PolarHBondContact O-N 3.46Å; A33-R36 VanDerWaalsContact O-N 3.16Å; Y34-R36 PolarHBondContact O-N 2.87Å; Y34-R36 VanDerWaalsContact O-N 3.14Å; R36-M39 PolarHBondContact O-N 3.43Å; R36-L40 PolarHBondContact O-N 3.49Å; R36-L40 VanDerWaalsContact O-N 3.13Å
37	L	85.3	Confident	85	Confident	13 Å²	13	76.3 Å²	76.3	7%	0.068	35%	0.349	C	S	.	.	H	α-helix	trans	-68	-35.8	-179.9	-67.5	171.9	0	0	0	111.5	L19 A33 Y34 M39 L40 Y41 V62	L19-L37 HydrophobicContact CD2-CD1 3.65Å; A33-L37 PolarHBondContact O-N 2.94Å; A33-L37 VanDerWaalsContact O-N 3.11Å; Y34-L37 PolarHBondContact O-N 3.04Å; L37-M39 PolarHBondContact O-N 3.49Å; L37-L40 HydrophobicContact CD2-CD2 4.42Å; L37-L40 WeakPolarHBondContact O-CB 3.34Å; L37-L40 PolarHBondContact O-N 3.43Å; L37-L40 VanDerWaalsContact O-N 3.1Å; L37-Y41 HydrophobicContact CB-CD2 4.37Å; L37-Y41 HydrophobicContact CB-CE2 4.3Å; L37-Y41 HydrophobicContact CD2-CE2 3.93Å; L37-Y41 VanDerWaalsContact O-CD2 3.29Å; L37-Y41 WeakPolarHBondContact O-CD2 3.43Å; L37-Y41 PolarHBondContact O-N 3.03Å; L37-V62 HydrophobicContact CB-CG1 3.67Å; L37-V62 HydrophobicContact CB-CG2 4.1Å; L37-V62 HydrophobicContact CD1-CG1 4.29Å; L37-V62 HydrophobicContact CD1-CG2 4.21Å
38	C	85.9	Confident	84.8	Confident	16 Å²	16	75 Å²	75	11%	0.108	35%	0.346	C	S	.	.	H	α-helix	trans	-61.3	-40.9	171.5	-73	0	0	0	0	113.1	Y34 L40 H42 F59	Y34-C38 WeakPolarHBondContact CE2-SG 3.42Å; Y34-C38 WeakPolarHBondContact O-CB 3.47Å; Y34-C38 PolarHBondContact O-N 2.86Å; Y34-C38 PolarHBondContact O-SG 3.12Å; Y34-C38 VanDerWaalsContact O-SG 3.36Å; C38-L40 PolarHBondContact O-N 3.26Å; C38-H42 WeakPolarHBondContact O-CB 3.33Å; C38-H42 PolarHBondContact O-N 3.09Å; C38-F59 HydrophobicContact CB-CD2 4.36Å; C38-F59 HydrophobicContact CB-CE2 3.76Å
39	M	85.6	Confident	84.5	Confident	129 Å²	129	71.8 Å²	71.8	64%	0.635	34%	0.34	S	S	*	.	H	α-helix	trans	-66.5	-29.4	175	-74	179.7	-174.8	0	0	112	R35 R36 L37 K45	R35-M39 VanDerWaalsContact O-CG 3.31Å; R35-M39 WeakPolarHBondContact O-CG 3.23Å; R35-M39 PolarHBondContact O-N 3.36Å; R35-M39 VanDerWaalsContact O-N 3.16Å; R36-M39 PolarHBondContact O-N 3.43Å; L37-M39 PolarHBondContact O-N 3.49Å; M39-K45 WeakPolarHBondContact O-CD 3.42Å; M39-K45 VanDerWaalsContact O-CE 3.23Å; M39-K45 WeakPolarHBondContact O-CE 3.34Å; M39-K45 PolarHBondContact O-NZ 3.24Å
40	L	81.3	Confident	84.1	Confident	22 Å²	22	73.2 Å²	73.2	12%	0.115	35%	0.346	C	S	.	.	H	α-helix	trans	-75.4	-47.2	179.7	-175.8	63.8	0	0	0	111.6	R36 L37 C38 M444 S447 C493	R36-L40 PolarHBondContact O-N 3.49Å; R36-L40 VanDerWaalsContact O-N 3.13Å; L37-L40 HydrophobicContact CD2-CD2 4.42Å; L37-L40 WeakPolarHBondContact O-CB 3.34Å; L37-L40 PolarHBondContact O-N 3.43Å; L37-L40 VanDerWaalsContact O-N 3.1Å; C38-L40 PolarHBondContact O-N 3.26Å; L40-M444 HydrophobicContact CD2-CG 4.29Å; L40-S447 WeakPolarHBondContact CD1-OG 3.42Å; L40-C493 VanDerWaalsContact CD1-SG 3.59Å; L40-C493 VanDerWaalsContact CD2-SG 3.53Å
41	Y	83.4	Confident	83.6	Confident	2 Å²	2	75.1 Å²	75.1	1%	0.008	36%	0.356	C	S	.	.	S	Bend	trans	-99.5	20	-174	-53.4	-55.5	0	0	0	114.5	L37 L58 V62 M444 P511	L37-Y41 HydrophobicContact CB-CD2 4.37Å; L37-Y41 HydrophobicContact CB-CE2 4.3Å; L37-Y41 HydrophobicContact CD2-CE2 3.93Å; L37-Y41 VanDerWaalsContact O-CD2 3.29Å; L37-Y41 WeakPolarHBondContact O-CD2 3.43Å; L37-Y41 PolarHBondContact O-N 3.03Å; Y41-L58 HydrophobicContact CD1-CB 4.3Å; Y41-L58 HydrophobicContact CD1-CD1 4.06Å; Y41-L58 HydrophobicContact CD2-CB 4.19Å; Y41-L58 HydrophobicContact CE1-CD1 3.96Å; Y41-L58 HydrophobicContact CG-CB 4.04Å; Y41-V62 HydrophobicContact CD2-CG2 4.17Å; Y41-V62 HydrophobicContact CE2-CG2 4.23Å; Y41-M444 HydrophobicContact CE1-CE 4.1Å; Y41-M444 HydrophobicContact CE1-CG 4.37Å; Y41-M444 WeakPolarHBondContact OH-CE 2.78Å; Y41-P511 WeakPolarHBondContact OH-CB 3.26Å
42	H	85.2	Confident	83.3	Confident	68 Å²	68	74.2 Å²	74.2	32%	0.315	35%	0.352	S	S	.	.			trans	-65.6	127.6	-178.6	-164.8	-83.3	0	0	0	111.3	C38 D44 K45	C38-H42 WeakPolarHBondContact O-CB 3.33Å; C38-H42 PolarHBondContact O-N 3.09Å; H42-D44 IonicContact CE1-OD2 3.89Å; H42-D44 PolarHBondContact CE1-OD2 2.9Å; H42-D44 VanDerWaalsContact CE1-OD2 3.31Å; H42-D44 WeakPolarHBondContact ND1-CB 3.43Å; H42-D44 PolarHBondContact ND1-N 2.96Å; H42-D44 VanDerWaalsContact ND1-N 3.19Å; H42-D44 IonicContact ND1-OD2 2.69Å; H42-D44 PolarHBondContact O-N 3.33Å; H42-D44 VanDerWaalsContact O-N 3.14Å; H42-K45 HydrophobicContact CB-CG 4.4Å; H42-K45 PolarHBondContact O-N 2.92Å
43	P	85.1	Confident	83	Confident	26 Å²	26	80.3 Å²	80.3	17%	0.169	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-61.6	-28.8	-174.1	23.4	-33.9	0	0	0	113.4	K45 H46 K52	P43-K45 PolarHBondContact O-N 3.09Å; P43-H46 PolarHBondContact O-N 2.97Å; P43-K52 HydrophobicContact CB-CG 4.06Å
44	D	84.4	Confident	82.6	Confident	124 Å²	124	82.9 Å²	82.9	66%	0.663	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-70	-14.2	178.1	-67	-12.4	0	0	0	114.8	H42 H46	H42-D44 IonicContact CE1-OD2 3.89Å; H42-D44 PolarHBondContact CE1-OD2 2.9Å; H42-D44 VanDerWaalsContact CE1-OD2 3.31Å; H42-D44 WeakPolarHBondContact ND1-CB 3.43Å; H42-D44 PolarHBondContact ND1-N 2.96Å; H42-D44 VanDerWaalsContact ND1-N 3.19Å; H42-D44 IonicContact ND1-OD2 2.69Å; H42-D44 PolarHBondContact O-N 3.33Å; H42-D44 VanDerWaalsContact O-N 3.14Å; D44-H46 VanDerWaalsContact C-N 3.29Å
45	K	78.2	Confident	82.2	Confident	101 Å²	101	81 Å²	81	44%	0.439	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-78.1	-17.4	176.8	-72.6	-172.7	171	-172.7	0	112.9	M39 H42 P43	M39-K45 WeakPolarHBondContact O-CD 3.42Å; M39-K45 VanDerWaalsContact O-CE 3.23Å; M39-K45 WeakPolarHBondContact O-CE 3.34Å; M39-K45 PolarHBondContact O-NZ 3.24Å; H42-K45 HydrophobicContact CB-CG 4.4Å; H42-K45 PolarHBondContact O-N 2.92Å; P43-K45 PolarHBondContact O-N 3.09Å
46	H	78.5	Confident	82	Confident	22 Å²	22	79 Å²	79	10%	0.102	37%	0.367	C	S	.	.			trans	-109.1	125.2	-174.1	-56.6	-71.9	0	0	0	110.6	P43 D44 L51 A55	P43-H46 PolarHBondContact O-N 2.97Å; D44-H46 VanDerWaalsContact C-N 3.29Å; H46-L51 HydrophobicContact CB-CB 4.27Å; H46-A55 VanDerWaalsContact CD2-CB 3.46Å; H46-A55 WeakPolarHBondContact CD2-CB 3.34Å
47	R	74.7	Confident	81.9	Confident	243 Å²	243	76.7 Å²	76.7	92%	0.917	37%	0.371	S	S	*	.			trans	-85.3	-27.4	-179.3	-66.8	-177.9	178.5	-178.2	-0.4	112.9
48	D	82.4	Confident	81.7	Confident	96 Å²	96	77.6 Å²	77.6	51%	0.513	38%	0.375	S	S	.	.	S	Bend	trans	-78.4	133.2	-177.2	-61.1	-39.2	0	0	0	111.4	E50 L51 K52	D48-E50 PolarHBondContact O-N 3.25Å; D48-E50 VanDerWaalsContact O-N 3.16Å; D48-L51 HydrophobicContact CB-CB 4.19Å; D48-L51 HydrophobicContact CB-CD1 4.07Å; D48-L51 HydrophobicContact CB-CG 4.23Å; D48-L51 PolarHBondContact O-N 2.81Å; D48-L51 WeakPolarHBondContact OD2-CD1 3.38Å; D48-K52 VanDerWaalsContact O-CB 3.27Å; D48-K52 WeakPolarHBondContact O-CB 3.32Å; D48-K52 PolarHBondContact O-N 2.58Å
49	P	80.9	Confident	81.7	Confident	96 Å²	96	79 Å²	79	62%	0.623	38%	0.379	S	S	*	.	H	α-helix	trans	-62.8	-24	-175.8	-23.5	32.5	0	0	0	115.2	R53	P49-R53 PolarHBondContact O-NE 2.87Å
50	E	78.9	Confident	81.7	Confident	136 Å²	136	77 Å²	77	64%	0.636	37%	0.371	S	S	*	.	H	α-helix	trans	-86.9	-45.4	-178.5	-163.3	161	-156.7	0	0	111.3	D48 K52 R53 Q54	D48-E50 PolarHBondContact O-N 3.25Å; D48-E50 VanDerWaalsContact O-N 3.16Å; E50-K52 VanDerWaalsContact C-N 3.29Å; E50-K52 PolarHBondContact O-N 2.87Å; E50-R53 PolarHBondContact O-N 2.95Å; E50-Q54 WeakPolarHBondContact O-CG 3.2Å; E50-Q54 PolarHBondContact O-N 2.78Å; E50-Q54 VanDerWaalsContact O-N 3.15Å
51	L	77.9	Confident	81.8	Confident	41 Å²	41	78.7 Å²	78.7	22%	0.215	38%	0.38	C	S	.	.	H	α-helix	trans	-61.6	-37.5	170.7	-68.4	176.5	0	0	0	111.5	H46 D48 R53 Q54 A55 L442 L443	H46-L51 HydrophobicContact CB-CB 4.27Å; D48-L51 HydrophobicContact CB-CB 4.19Å; D48-L51 HydrophobicContact CB-CD1 4.07Å; D48-L51 HydrophobicContact CB-CG 4.23Å; D48-L51 PolarHBondContact O-N 2.81Å; D48-L51 WeakPolarHBondContact OD2-CD1 3.38Å; L51-R53 PolarHBondContact O-N 2.81Å; L51-Q54 PolarHBondContact O-N 3.25Å; L51-A55 WeakPolarHBondContact O-CB 3.44Å; L51-A55 PolarHBondContact O-N 2.85Å; L51-L442 HydrophobicContact CD2-CB 4.16Å; L51-L443 HydrophobicContact CB-CD2 3.72Å; L51-L443 HydrophobicContact CD2-CD2 3.77Å; L51-L443 HydrophobicContact CD2-CG 4.28Å; L51-L443 HydrophobicContact CG-CD2 4.27Å; L51-L443 WeakPolarHBondContact O-CD2 3.41Å
52	K	83.2	Confident	82	Confident	90 Å²	90	78.7 Å²	78.7	39%	0.391	38%	0.38	S	S	.	.	H	α-helix	trans	-60.7	-43	176.4	-172.2	171.9	-174.7	175.8	0	112.4	P43 D48 E50 A55 E56	P43-K52 HydrophobicContact CB-CG 4.06Å; D48-K52 VanDerWaalsContact O-CB 3.27Å; D48-K52 WeakPolarHBondContact O-CB 3.32Å; D48-K52 PolarHBondContact O-N 2.58Å; E50-K52 VanDerWaalsContact C-N 3.29Å; E50-K52 PolarHBondContact O-N 2.87Å; K52-A55 PolarHBondContact O-N 3.14Å; K52-E56 WeakPolarHBondContact O-CB 3.31Å; K52-E56 PolarHBondContact O-N 2.91Å
53	R	81.9	Confident	82.2	Confident	168 Å²	168	78.5 Å²	78.5	63%	0.634	38%	0.38	S	S	*	.	H	α-helix	trans	-64.9	-38.9	175.9	-83.3	-175.4	-88.9	165.5	-8.4	112.4	P49 E50 L51 A57	P49-R53 PolarHBondContact O-NE 2.87Å; E50-R53 PolarHBondContact O-N 2.95Å; L51-R53 PolarHBondContact O-N 2.81Å; R53-A57 PolarHBondContact O-N 2.87Å; R53-A57 VanDerWaalsContact O-N 3.07Å
54	Q	78.7	Confident	82.3	Confident	61 Å²	61	80.3 Å²	80.3	29%	0.285	39%	0.386	S	S	.	.	H	α-helix	trans	-70.2	-40.3	177.4	-68.1	171.5	-6.2	0	0	112	E50 L51 E56 A57 L58 A439 L443	E50-Q54 WeakPolarHBondContact O-CG 3.2Å; E50-Q54 PolarHBondContact O-N 2.78Å; E50-Q54 VanDerWaalsContact O-N 3.15Å; L51-Q54 PolarHBondContact O-N 3.25Å; Q54-E56 VanDerWaalsContact C-N 3.35Å; Q54-A57 PolarHBondContact O-N 2.88Å; Q54-L58 PolarHBondContact O-N 3.26Å; Q54-A439 HydrophobicContact CG-CB 4.18Å; Q54-L443 HydrophobicContact CB-CD1 3.92Å
55	A	80.6	Confident	82.4	Confident	0 Å²	0	74.4 Å²	74.4	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-61.7	-43.6	174.1	0	0	0	0	0	111.3	H46 L51 K52 A57 L58 F59 L443	H46-A55 VanDerWaalsContact CD2-CB 3.46Å; H46-A55 WeakPolarHBondContact CD2-CB 3.34Å; L51-A55 WeakPolarHBondContact O-CB 3.44Å; L51-A55 PolarHBondContact O-N 2.85Å; K52-A55 PolarHBondContact O-N 3.14Å; A55-A57 PolarHBondContact O-N 3.49Å; A55-L58 PolarHBondContact O-N 3.34Å; A55-F59 WeakPolarHBondContact O-CB 3.38Å; A55-F59 PolarHBondContact O-N 3.5Å; A55-L443 HydrophobicContact CB-CD1 4.17Å; A55-L443 HydrophobicContact CB-CD2 4.12Å
56	E	85.4	Confident	83	Confident	98 Å²	98	71.7 Å²	71.7	46%	0.458	34%	0.341	S	S	.	.	H	α-helix	trans	-59.6	-43.8	174.5	-175.4	176.1	-171	0	0	112.3	K52 Q54 F59 N60	K52-E56 WeakPolarHBondContact O-CB 3.31Å; K52-E56 PolarHBondContact O-N 2.91Å; Q54-E56 VanDerWaalsContact C-N 3.35Å; E56-F59 PolarHBondContact O-N 3.08Å; E56-N60 WeakPolarHBondContact O-CB 3.37Å; E56-N60 PolarHBondContact O-N 3.27Å; E56-N60 PolarHBondContact O-ND2 2.98Å
57	A	81.9	Confident	83.6	Confident	59 Å²	59	75.6 Å²	75.6	49%	0.488	36%	0.36	S	S	.	.	H	α-helix	trans	-62.4	-46.6	176.9	0	0	0	0	0	112.6	R53 Q54 A55 N60 L61	R53-A57 PolarHBondContact O-N 2.87Å; R53-A57 VanDerWaalsContact O-N 3.07Å; Q54-A57 PolarHBondContact O-N 2.88Å; A55-A57 PolarHBondContact O-N 3.49Å; A57-N60 PolarHBondContact O-N 3.07Å; A57-L61 WeakPolarHBondContact O-CB 3.42Å; A57-L61 PolarHBondContact O-N 3.23Å; A57-L61 VanDerWaalsContact O-N 3.07Å
58	L	81.7	Confident	84.2	Confident	31 Å²	31	64.9 Å²	64.9	16%	0.162	32%	0.321	C	S	.	.	H	α-helix	trans	-66.8	-37.1	176.5	-75	169.6	0	0	0	112.2	Y41 Q54 A55 L61 V62 A440 L443	Y41-L58 HydrophobicContact CD1-CB 4.3Å; Y41-L58 HydrophobicContact CD1-CD1 4.06Å; Y41-L58 HydrophobicContact CD2-CB 4.19Å; Y41-L58 HydrophobicContact CE1-CD1 3.96Å; Y41-L58 HydrophobicContact CG-CB 4.04Å; Q54-L58 PolarHBondContact O-N 3.26Å; A55-L58 PolarHBondContact O-N 3.34Å; L58-L61 PolarHBondContact O-N 3.32Å; L58-V62 WeakPolarHBondContact O-CB 3.27Å; L58-V62 VanDerWaalsContact O-CG2 3.29Å; L58-V62 WeakPolarHBondContact O-CG2 3.46Å; L58-V62 PolarHBondContact O-N 2.77Å; L58-A440 HydrophobicContact CD1-CB 3.86Å; L58-L443 HydrophobicContact CD1-CD1 3.79Å
59	F	85.6	Confident	84.4	Confident	45 Å²	45	60.4 Å²	60.4	20%	0.197	30%	0.297	C	S	.	.	H	α-helix	trans	-61.5	-47.7	176.1	-178	-88.7	0	0	0	111.3	C38 A55 E56 L61 V62 H63	C38-F59 HydrophobicContact CB-CD2 4.36Å; C38-F59 HydrophobicContact CB-CE2 3.76Å; A55-F59 WeakPolarHBondContact O-CB 3.38Å; A55-F59 PolarHBondContact O-N 3.5Å; E56-F59 PolarHBondContact O-N 3.08Å; F59-L61 VanDerWaalsContact C-N 3.32Å; F59-L61 PolarHBondContact O-N 3.18Å; F59-V62 PolarHBondContact O-N 3.2Å; F59-H63 WeakPolarHBondContact O-CB 3.43Å; F59-H63 PolarHBondContact O-N 3.07Å
60	N	85.5	Confident	84.8	Confident	87 Å²	87	57.2 Å²	57.2	47%	0.465	28%	0.277	S	S	.	.	H	α-helix	trans	-62.8	-39.8	177.2	-69.3	-18.8	0	0	0	111.6	E56 A57 H63 E64	E56-N60 WeakPolarHBondContact O-CB 3.37Å; E56-N60 PolarHBondContact O-N 3.27Å; E56-N60 PolarHBondContact O-ND2 2.98Å; A57-N60 PolarHBondContact O-N 3.07Å; N60-H63 WeakPolarHBondContact O-CB 3.39Å; N60-H63 PolarHBondContact O-N 3.49Å; N60-E64 WeakPolarHBondContact O-CB 3.46Å; N60-E64 PolarHBondContact O-N 3.33Å
61	L	84.1	Confident	85.2	Confident	59 Å²	59	55.8 Å²	55.8	31%	0.309	27%	0.271	S	S	.	.	H	α-helix	trans	-68.6	-38.5	179.3	-165.9	150.3	0	0	0	111.9	L18 A57 L58 F59 H63 A65	L18-L61 HydrophobicContact CD1-CD2 3.43Å; L18-L61 VanDerWaalsContact CD1-CD2 3.43Å; L18-L61 HydrophobicContact CD2-CD2 3.31Å; L18-L61 HydrophobicContact CG-CD2 3.96Å; A57-L61 WeakPolarHBondContact O-CB 3.42Å; A57-L61 PolarHBondContact O-N 3.23Å; A57-L61 VanDerWaalsContact O-N 3.07Å; L58-L61 PolarHBondContact O-N 3.32Å; F59-L61 VanDerWaalsContact C-N 3.32Å; F59-L61 PolarHBondContact O-N 3.18Å; L61-H63 VanDerWaalsContact C-N 3.33Å; L61-A65 WeakPolarHBondContact O-CB 3.48Å; L61-A65 PolarHBondContact O-N 2.71Å
62	V	86.8	Confident	85.5	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.006	29%	0.293	C	S	.	.	H	α-helix	trans	-66	-36.3	171.7	165.9	0	0	0	0	111.7	L18 L19 Y34 L37 Y41 L58 F59 Y66	L18-V62 HydrophobicContact CD2-CG2 4.05Å; L18-V62 HydrophobicContact CG-CG2 4.41Å; L19-V62 HydrophobicContact CD2-CG1 4.1Å; Y34-V62 HydrophobicContact CD2-CG1 3.76Å; Y34-V62 HydrophobicContact CE2-CG1 4.11Å; L37-V62 HydrophobicContact CB-CG1 3.67Å; L37-V62 HydrophobicContact CB-CG2 4.1Å; L37-V62 HydrophobicContact CD1-CG1 4.29Å; L37-V62 HydrophobicContact CD1-CG2 4.21Å; Y41-V62 HydrophobicContact CD2-CG2 4.17Å; Y41-V62 HydrophobicContact CE2-CG2 4.23Å; L58-V62 WeakPolarHBondContact O-CB 3.27Å; L58-V62 VanDerWaalsContact O-CG2 3.29Å; L58-V62 WeakPolarHBondContact O-CG2 3.46Å; L58-V62 PolarHBondContact O-N 2.77Å; F59-V62 PolarHBondContact O-N 3.2Å; V62-Y66 PolarHBondContact O-N 2.87Å; V62-Y66 VanDerWaalsContact O-N 3.13Å
63	H	89.6	Confident	85.3	Confident	65 Å²	65	61.5 Å²	61.5	30%	0.301	31%	0.307	S	S	.	.	H	α-helix	trans	-65.7	-50.8	175.4	-173.7	52.5	0	0	0	111.9	Y34 F59 N60 L61 A65 Y66 E67	Y34-H63 HydrophobicContact CE2-CB 4.2Å; Y34-H63 AromaticContact CE2-ND1 3.92Å; Y34-H63 AromaticContact CZ-ND1 3.62Å; Y34-H63 PolarHBondContact OH-ND1 2.75Å; F59-H63 WeakPolarHBondContact O-CB 3.43Å; F59-H63 PolarHBondContact O-N 3.07Å; N60-H63 WeakPolarHBondContact O-CB 3.39Å; N60-H63 PolarHBondContact O-N 3.49Å; L61-H63 VanDerWaalsContact C-N 3.33Å; H63-A65 VanDerWaalsContact C-N 3.32Å; H63-A65 PolarHBondContact O-N 2.97Å; H63-Y66 PolarHBondContact O-N 3.02Å; H63-Y66 VanDerWaalsContact O-N 3.08Å; H63-E67 IonicContact CE1-OE1 3.81Å; H63-E67 IonicContact NE2-OE1 2.78Å; H63-E67 PolarHBondContact NE2-OE1 3.46Å; H63-E67 WeakPolarHBondContact O-CG 3.31Å; H63-E67 PolarHBondContact O-N 3.36Å
64	E	87.3	Confident	85.3	Confident	64 Å²	64	54.2 Å²	54.2	30%	0.299	28%	0.282	S	S	.	.	H	α-helix	trans	-54.9	-47.1	175.3	-173.4	-171.2	177	0	0	111.3	Y15 N60 Y66 E67 V68 K83	Y15-E64 PolarHBondContact OH-OE1 2.83Å; N60-E64 WeakPolarHBondContact O-CB 3.46Å; N60-E64 PolarHBondContact O-N 3.33Å; E64-Y66 VanDerWaalsContact C-N 3.31Å; E64-Y66 PolarHBondContact O-N 3.47Å; E64-E67 PolarHBondContact O-N 2.9Å; E64-V68 VanDerWaalsContact O-CG2 3.3Å; E64-V68 WeakPolarHBondContact O-CG2 3.42Å; E64-V68 PolarHBondContact O-N 2.93Å; E64-V68 VanDerWaalsContact O-N 3.09Å; E64-K83 VanDerWaalsContact OE1-CE 3.27Å; E64-K83 WeakPolarHBondContact OE1-CE 3.3Å; E64-K83 IonicContact OE1-NZ 3.69Å; E64-K83 PolarHBondContact OE1-NZ 3.46Å; E64-K83 IonicContact OE2-NZ 3.92Å; E64-K83 PolarHBondContact OE2-NZ 2.88Å
65	A	87.4	Confident	85.6	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-59.4	-40.9	177.2	0	0	0	0	0	112.6	Y15 L18 L19 L61 H63 L69	Y15-A65 HydrophobicContact CD1-CB 3.55Å; Y15-A65 HydrophobicContact CD2-CB 4.43Å; Y15-A65 HydrophobicContact CE1-CB 4.17Å; Y15-A65 HydrophobicContact CG-CB 3.7Å; L18-A65 HydrophobicContact CD2-CB 3.57Å; L19-A65 HydrophobicContact CD1-CB 4.37Å; L19-A65 HydrophobicContact CG-CB 4.29Å; L61-A65 WeakPolarHBondContact O-CB 3.48Å; L61-A65 PolarHBondContact O-N 2.71Å; H63-A65 VanDerWaalsContact C-N 3.32Å; H63-A65 PolarHBondContact O-N 2.97Å; A65-L69 VanDerWaalsContact O-CB 3.31Å; A65-L69 WeakPolarHBondContact O-CB 3.23Å; A65-L69 VanDerWaalsContact O-CG 3.22Å; A65-L69 WeakPolarHBondContact O-CG 3.38Å; A65-L69 PolarHBondContact O-N 3.43Å; A65-L69 VanDerWaalsContact O-N 3.12Å
66	Y	90.9	Very high	85.5	Confident	43 Å²	43	55.6 Å²	55.6	17%	0.169	30%	0.295	C	S	.	.	H	α-helix	trans	-69.5	-43.1	177	174.1	-100.1	0	0	0	112.1	L30 K31 Y34 V62 H63 E64 V68 L69 S70	L30-Y66 HydrophobicContact CB-CD2 4.44Å; L30-Y66 HydrophobicContact CB-CE2 4.38Å; K31-Y66 HydrophobicContact CB-CE2 4.12Å; Y34-Y66 AromaticContact CD1-CD1 3.89Å; Y34-Y66 HydrophobicContact CD1-CD1 3.89Å; Y34-Y66 HydrophobicContact CD1-CD2 4.13Å; Y34-Y66 HydrophobicContact CD1-CE1 4.14Å; Y34-Y66 HydrophobicContact CD1-CE2 4.36Å; Y34-Y66 AromaticContact CD1-CG 3.88Å; Y34-Y66 HydrophobicContact CD1-CG 3.88Å; Y34-Y66 HydrophobicContact CD2-CD1 4.24Å; Y34-Y66 HydrophobicContact CD2-CD2 4.36Å; Y34-Y66 AromaticContact CD2-CG 3.75Å; Y34-Y66 HydrophobicContact CD2-CG 3.75Å; Y34-Y66 HydrophobicContact CE1-CD1 4.05Å; Y34-Y66 HydrophobicContact CE1-CE1 4.35Å; Y34-Y66 HydrophobicContact CE1-CG 4.42Å; Y34-Y66 HydrophobicContact CE2-CD1 4.41Å; Y34-Y66 HydrophobicContact CE2-CG 4.32Å; Y34-Y66 AromaticContact CG-CD1 3.99Å; Y34-Y66 HydrophobicContact CG-CD1 3.99Å; Y34-Y66 AromaticContact CG-CD2 3.74Å; Y34-Y66 HydrophobicContact CG-CD2 3.74Å; Y34-Y66 HydrophobicContact CG-CE2 4.37Å; Y34-Y66 AromaticContact CG-CG 3.51Å; Y34-Y66 HydrophobicContact CG-CG 3.51Å; V62-Y66 PolarHBondContact O-N 2.87Å; V62-Y66 VanDerWaalsContact O-N 3.13Å; H63-Y66 PolarHBondContact O-N 3.02Å; H63-Y66 VanDerWaalsContact O-N 3.08Å; E64-Y66 VanDerWaalsContact C-N 3.31Å; E64-Y66 PolarHBondContact O-N 3.47Å; Y66-V68 PolarHBondContact O-N 3.46Å; Y66-L69 PolarHBondContact O-N 2.92Å; Y66-S70 WeakPolarHBondContact O-CA 3.42Å; Y66-S70 WeakPolarHBondContact O-CB 3.36Å; Y66-S70 PolarHBondContact O-N 3.07Å; Y66-S70 PolarHBondContact O-OG 3.26Å; Y66-S70 VanDerWaalsContact O-OG 3.06Å
67	E	89.4	Confident	85.2	Confident	105 Å²	105	54.1 Å²	54.1	49%	0.491	29%	0.29	S	S	.	.	H	α-helix	trans	-56.7	-52.5	178.8	-72.8	-170.4	145.8	0	0	110.9	H63 E64 L69 S70 E71	H63-E67 IonicContact CE1-OE1 3.81Å; H63-E67 IonicContact NE2-OE1 2.78Å; H63-E67 PolarHBondContact NE2-OE1 3.46Å; H63-E67 WeakPolarHBondContact O-CG 3.31Å; H63-E67 PolarHBondContact O-N 3.36Å; E64-E67 PolarHBondContact O-N 2.9Å; E67-L69 PolarHBondContact O-N 3.18Å; E67-S70 PolarHBondContact O-N 3.45Å; E67-S70 PolarHBondContact O-OG 3.24Å; E67-E71 PolarHBondContact O-N 3.41Å
68	V	87.4	Confident	85.2	Confident	17 Å²	17	51.9 Å²	51.9	10%	0.103	27%	0.269	C	S	.	.	H	α-helix	trans	-60.6	-47.6	-180	171.3	0	0	0	0	112	Y15 E64 Y66 S70 A74 R75 Y78 L86	Y15-V68 HydrophobicContact CD2-CB 4.09Å; Y15-V68 HydrophobicContact CD2-CG1 3.91Å; Y15-V68 HydrophobicContact CE2-CB 3.94Å; Y15-V68 HydrophobicContact CE2-CG1 3.9Å; Y15-V68 HydrophobicContact CE2-CG2 3.88Å; E64-V68 VanDerWaalsContact O-CG2 3.3Å; E64-V68 WeakPolarHBondContact O-CG2 3.42Å; E64-V68 PolarHBondContact O-N 2.93Å; E64-V68 VanDerWaalsContact O-N 3.09Å; Y66-V68 PolarHBondContact O-N 3.46Å; V68-S70 VanDerWaalsContact C-N 3.34Å; V68-A74 HydrophobicContact CG1-CB 4.39Å; V68-R75 PolarHBondContact O-N 3.37Å; V68-R75 VanDerWaalsContact O-N 3.16Å; V68-Y78 HydrophobicContact CG1-CD2 4.17Å; V68-Y78 HydrophobicContact CG1-CG 4.04Å; V68-L86 HydrophobicContact CB-CD1 4.15Å; V68-L86 HydrophobicContact CG1-CD1 3.47Å; V68-L86 VanDerWaalsContact CG1-CD1 3.47Å; V68-L86 HydrophobicContact CG1-CD2 3.9Å; V68-L86 HydrophobicContact CG1-CG 4.31Å; V68-L86 HydrophobicContact CG2-CD1 3.57Å; V68-L86 HydrophobicContact CG2-CD2 4.39Å
69	L	87.8	Confident	85.2	Confident	2 Å²	2	53.9 Å²	53.9	1%	0.01	28%	0.279	C	S	.	.	H	α-helix	trans	-77.8	-20.5	-176.4	-65.9	-178.4	0	0	0	113.1	Y16 L19 L30 A65 Y66 E67 R75 Y78	Y16-L69 HydrophobicContact CD1-CD1 3.97Å; Y16-L69 HydrophobicContact CD1-CD2 4.38Å; Y16-L69 HydrophobicContact CD2-CD2 4.39Å; Y16-L69 HydrophobicContact CE1-CD1 4.02Å; Y16-L69 HydrophobicContact CE1-CD2 3.74Å; Y16-L69 HydrophobicContact CE1-CG 4.47Å; Y16-L69 HydrophobicContact CE2-CD2 3.78Å; Y16-L69 HydrophobicContact CG-CD1 4.35Å; Y16-L69 VanDerWaalsContact CZ-CD2 3.42Å; L19-L69 HydrophobicContact CD1-CD1 3.96Å; L30-L69 HydrophobicContact CD1-CB 4.13Å; L30-L69 WeakPolarHBondContact CD1-O 3.4Å; L30-L69 HydrophobicContact CD2-CB 4.21Å; L30-L69 HydrophobicContact CD2-CD1 4.16Å; A65-L69 VanDerWaalsContact O-CB 3.31Å; A65-L69 WeakPolarHBondContact O-CB 3.23Å; A65-L69 VanDerWaalsContact O-CG 3.22Å; A65-L69 WeakPolarHBondContact O-CG 3.38Å; A65-L69 PolarHBondContact O-N 3.43Å; A65-L69 VanDerWaalsContact O-N 3.12Å; Y66-L69 PolarHBondContact O-N 2.92Å; E67-L69 PolarHBondContact O-N 3.18Å; L69-R75 HydrophobicContact CD2-CG 4.16Å; L69-R75 WeakPolarHBondContact O-CD 3.38Å; L69-Y78 HydrophobicContact CD2-CD1 3.9Å; L69-Y78 HydrophobicContact CD2-CE1 4.28Å
70	S	88.8	Confident	84.7	Confident	29 Å²	29	57.3 Å²	57.3	20%	0.203	30%	0.299	C	S	.	.	H	α-helix	trans	-78.1	-28.7	178.2	74	0	0	0	0	113	Q27 Y66 E67 V68	Q27-S70 PolarHBondContact NE2-O 3.29Å; Y66-S70 WeakPolarHBondContact O-CA 3.42Å; Y66-S70 WeakPolarHBondContact O-CB 3.36Å; Y66-S70 PolarHBondContact O-N 3.07Å; Y66-S70 PolarHBondContact O-OG 3.26Å; Y66-S70 VanDerWaalsContact O-OG 3.06Å; E67-S70 PolarHBondContact O-N 3.45Å; E67-S70 PolarHBondContact O-OG 3.24Å; V68-S70 VanDerWaalsContact C-N 3.34Å
71	E	87.1	Confident	83.7	Confident	106 Å²	106	58.9 Å²	58.9	50%	0.495	30%	0.299	S	S	.	.	S	Bend	trans	-90.3	121.2	179	-177.7	167.2	-154.8	0	0	111	E67 Q73 A74 R75	E67-E71 PolarHBondContact O-N 3.41Å; E71-Q73 VanDerWaalsContact C-N 3.26Å; E71-Q73 HydrophobicContact CG-CB 4.5Å; E71-Q73 PolarHBondContact O-N 3.36Å; E71-A74 HydrophobicContact CB-CB 4.07Å; E71-A74 HydrophobicContact CG-CB 4.3Å; E71-A74 PolarHBondContact O-N 3.37Å; E71-R75 VanDerWaalsContact O-CB 3.25Å; E71-R75 WeakPolarHBondContact O-CB 3.45Å; E71-R75 PolarHBondContact O-N 3.22Å
72	P	84.1	Confident	83.3	Confident	105 Å²	105	57.2 Å²	57.2	68%	0.682	30%	0.296	S	S	*	.	H	α-helix	trans	-59.2	-33.7	-175.7	-26.1	34.4	0	0	0	114.4	A76	P72-A76 WeakPolarHBondContact O-CB 3.42Å; P72-A76 PolarHBondContact O-N 2.96Å; P72-A76 VanDerWaalsContact O-N 3.11Å
73	Q	79.1	Confident	82.5	Confident	147 Å²	147	59.5 Å²	59.5	69%	0.687	31%	0.306	S	S	*	.	H	α-helix	trans	-74.1	-48.6	180	-66.4	-171.2	-12.8	0	0	111.5	E71 R75 A76 I77	E71-Q73 VanDerWaalsContact C-N 3.26Å; E71-Q73 HydrophobicContact CG-CB 4.5Å; E71-Q73 PolarHBondContact O-N 3.36Å; Q73-R75 VanDerWaalsContact C-N 3.34Å; Q73-R75 PolarHBondContact O-N 3.33Å; Q73-A76 PolarHBondContact O-N 3.03Å; Q73-I77 WeakPolarHBondContact O-CG1 3.39Å; Q73-I77 PolarHBondContact O-N 3.33Å
74	A	81.5	Confident	81.3	Confident	14 Å²	14	64.6 Å²	64.6	12%	0.116	32%	0.322	C	S	.	.	H	α-helix	trans	-63.8	-39	176.3	0	0	0	0	0	111.8	V68 E71 I77 Y78 L86	V68-A74 HydrophobicContact CG1-CB 4.39Å; E71-A74 HydrophobicContact CB-CB 4.07Å; E71-A74 HydrophobicContact CG-CB 4.3Å; E71-A74 PolarHBondContact O-N 3.37Å; A74-I77 PolarHBondContact O-N 2.75Å; A74-Y78 VanDerWaalsContact O-CB 3.3Å; A74-Y78 WeakPolarHBondContact O-CB 3.29Å; A74-Y78 PolarHBondContact O-N 2.83Å; A74-L86 HydrophobicContact CB-CD2 4.11Å
75	R	84.9	Confident	80.3	Confident	44 Å²	44	61.9 Å²	61.9	17%	0.166	31%	0.311	C	S	.	.	H	α-helix	trans	-60.9	-43.7	173.7	-172.9	179.3	-174.1	164.9	-5	112.2	Y16 R23 A25 V68 L69 E71 Q73 I77 Y78 D79	Y16-R75 WeakPolarHBondContact OH-CG 3.33Å; Y16-R75 PolarHBondContact OH-NE 3.06Å; R23-R75 PolarHBondContact O-NH2 3.16Å; A25-R75 PolarHBondContact O-NH1 3.31Å; A25-R75 VanDerWaalsContact O-NH1 3.14Å; A25-R75 PolarHBondContact O-NH2 2.67Å; V68-R75 PolarHBondContact O-N 3.37Å; V68-R75 VanDerWaalsContact O-N 3.16Å; L69-R75 HydrophobicContact CD2-CG 4.16Å; L69-R75 WeakPolarHBondContact O-CD 3.38Å; E71-R75 VanDerWaalsContact O-CB 3.25Å; E71-R75 WeakPolarHBondContact O-CB 3.45Å; E71-R75 PolarHBondContact O-N 3.22Å; Q73-R75 VanDerWaalsContact C-N 3.34Å; Q73-R75 PolarHBondContact O-N 3.33Å; R75-I77 PolarHBondContact O-N 3.29Å; R75-Y78 PolarHBondContact O-N 3.05Å; R75-D79 WeakPolarHBondContact O-CB 3.5Å; R75-D79 PolarHBondContact O-N 2.87Å
76	A	80.1	Confident	79.3	Confident	47 Å²	47	64.4 Å²	64.4	39%	0.388	32%	0.324	S	S	.	.	H	α-helix	trans	-64.6	-40.2	176.8	0	0	0	0	0	112.1	P72 Q73 Y78 D79 I80	P72-A76 WeakPolarHBondContact O-CB 3.42Å; P72-A76 PolarHBondContact O-N 2.96Å; P72-A76 VanDerWaalsContact O-N 3.11Å; Q73-A76 PolarHBondContact O-N 3.03Å; A76-Y78 VanDerWaalsContact C-N 3.34Å; A76-D79 PolarHBondContact O-N 2.93Å; A76-I80 WeakPolarHBondContact O-CD1 3.43Å; A76-I80 WeakPolarHBondContact O-CG1 3.33Å; A76-I80 PolarHBondContact O-N 3.13Å
77	I	77.8	Confident	78	Confident	67 Å²	67	68.3 Å²	68.3	34%	0.344	35%	0.348	S	S	.	.	H	α-helix	trans	-63.6	-43.6	174.9	-66.7	166	0	0	0	110.1	Q73 A74 R75 I80 Y81 G85 L86	Q73-I77 WeakPolarHBondContact O-CG1 3.39Å; Q73-I77 PolarHBondContact O-N 3.33Å; A74-I77 PolarHBondContact O-N 2.75Å; R75-I77 PolarHBondContact O-N 3.29Å; I77-I80 PolarHBondContact O-N 3.42Å; I77-Y81 HydrophobicContact CG2-CD2 4.25Å; I77-Y81 WeakPolarHBondContact O-CB 3.31Å; I77-Y81 PolarHBondContact O-N 3.22Å; I77-G85 VanDerWaalsContact CG2-O 3.3Å; I77-G85 WeakPolarHBondContact CG2-O 3.11Å; I77-L86 HydrophobicContact CG2-CD2 4.29Å
78	Y	81.9	Confident	76.3	Confident	12 Å²	12	66.2 Å²	66.2	5%	0.047	34%	0.343	C	S	.	.	H	α-helix	trans	-65.1	-41.9	177.7	-175	-100.8	0	0	0	113	D13 D14 Y15 Y16 V68 L69 A74 R75 A76 I80 G82 K83 L86	D13-Y78 PolarHBondContact O-OH 3.23Å; D14-Y78 VanDerWaalsContact CA-OH 3.27Å; D14-Y78 WeakPolarHBondContact CA-OH 3.37Å; Y15-Y78 HydrophobicContact CD2-CD1 4.39Å; Y15-Y78 AromaticContact CD2-CD2 3.78Å; Y15-Y78 HydrophobicContact CD2-CD2 3.78Å; Y15-Y78 AromaticContact CD2-CE1 4Å; Y15-Y78 HydrophobicContact CD2-CE1 4Å; Y15-Y78 AromaticContact CD2-CE2 3.28Å; Y15-Y78 HydrophobicContact CD2-CE2 3.28Å; Y15-Y78 HydrophobicContact CD2-CG 4.29Å; Y15-Y78 AromaticContact CD2-CZ 3.43Å; Y15-Y78 VanDerWaalsContact CD2-CZ 3.43Å; Y15-Y78 AromaticContact CE2-CD2 3.92Å; Y15-Y78 HydrophobicContact CE2-CD2 3.92Å; Y15-Y78 AromaticContact CE2-CE2 3.53Å; Y15-Y78 HydrophobicContact CE2-CE2 3.53Å; Y15-Y78 HydrophobicContact CG-CE1 4.28Å; Y15-Y78 AromaticContact CG-CE2 3.95Å; Y15-Y78 HydrophobicContact CG-CE2 3.95Å; Y15-Y78 AromaticContact CG-CZ 3.68Å; Y15-Y78 PolarHBondContact N-OH 3.13Å; Y16-Y78 HydrophobicContact CD2-CE1 4.03Å; Y16-Y78 AromaticContact CE2-CD1 3.97Å; Y16-Y78 HydrophobicContact CE2-CD1 3.97Å; Y16-Y78 AromaticContact CE2-CE1 3.91Å; Y16-Y78 HydrophobicContact CE2-CE1 3.91Å; V68-Y78 HydrophobicContact CG1-CD2 4.17Å; V68-Y78 HydrophobicContact CG1-CG 4.04Å; L69-Y78 HydrophobicContact CD2-CD1 3.9Å; L69-Y78 HydrophobicContact CD2-CE1 4.28Å; A74-Y78 VanDerWaalsContact O-CB 3.3Å; A74-Y78 WeakPolarHBondContact O-CB 3.29Å; A74-Y78 PolarHBondContact O-N 2.83Å; R75-Y78 PolarHBondContact O-N 3.05Å; A76-Y78 VanDerWaalsContact C-N 3.34Å; Y78-I80 VanDerWaalsContact C-N 3.28Å; Y78-I80 PolarHBondContact O-N 3.42Å; Y78-G82 VanDerWaalsContact CD2-C 3.42Å; Y78-G82 WeakPolarHBondContact O-CA 3.46Å; Y78-G82 PolarHBondContact O-N 2.89Å; Y78-K83 HydrophobicContact CE2-CB 3.98Å; Y78-K83 VanDerWaalsContact CE2-N 3.26Å; Y78-L86 HydrophobicContact CD2-CD1 3.73Å; Y78-L86 HydrophobicContact CD2-CG 4.45Å; Y78-L86 HydrophobicContact CE2-CD1 4.48Å
79	D	82.3	Confident	74.5	Confident	73 Å²	73	73.9 Å²	73.9	39%	0.39	38%	0.383	S	S	.	.	H	α-helix	trans	-66.5	-31.7	179.6	-71.1	-17.5	0	0	0	112	Y16 R75 A76	Y16-D79 WeakPolarHBondContact CE2-OD1 3.28Å; Y16-D79 VanDerWaalsContact CZ-OD1 3.29Å; Y16-D79 PolarHBondContact OH-OD1 3.1Å; Y16-D79 PolarHBondContact OH-OD2 3.11Å; R75-D79 WeakPolarHBondContact O-CB 3.5Å; R75-D79 PolarHBondContact O-N 2.87Å; A76-D79 PolarHBondContact O-N 2.93Å
80	I	75.8	Confident	72.5	Confident	117 Å²	117	76.9 Å²	76.9	60%	0.6	42%	0.415	S	S	*	.	H	α-helix	trans	-87.1	-41.1	179.9	-61.2	168.9	0	0	0	111.5	A76 I77 Y78	A76-I80 WeakPolarHBondContact O-CD1 3.43Å; A76-I80 WeakPolarHBondContact O-CG1 3.33Å; A76-I80 PolarHBondContact O-N 3.13Å; I77-I80 PolarHBondContact O-N 3.42Å; Y78-I80 VanDerWaalsContact C-N 3.28Å; Y78-I80 PolarHBondContact O-N 3.42Å
81	Y	64.7	Low	70.2	Confident	119 Å²	119	81 Å²	81	47%	0.467	43%	0.426	S	S	.	.	H	α-helix	trans	-122.1	-1.2	-166.2	-57.3	-64.2	0	0	0	114.7	I77 W91	I77-Y81 HydrophobicContact CG2-CD2 4.25Å; I77-Y81 WeakPolarHBondContact O-CB 3.31Å; I77-Y81 PolarHBondContact O-N 3.22Å; Y81-W91 AromaticContact CD1-CH2 3.33Å; Y81-W91 HydrophobicContact CD1-CH2 3.33Å; Y81-W91 HydrophobicContact CD1-CZ2 4.05Å; Y81-W91 HydrophobicContact CD1-CZ3 4.22Å; Y81-W91 AromaticContact CD2-CH2 3.9Å; Y81-W91 HydrophobicContact CD2-CH2 3.9Å; Y81-W91 AromaticContact CD2-CZ2 3.82Å; Y81-W91 HydrophobicContact CD2-CZ2 3.82Å; Y81-W91 AromaticContact CE1-CH2 3.24Å; Y81-W91 HydrophobicContact CE1-CH2 3.24Å; Y81-W91 HydrophobicContact CE1-CZ2 4.14Å; Y81-W91 AromaticContact CE1-CZ3 3.72Å; Y81-W91 HydrophobicContact CE1-CZ3 3.72Å; Y81-W91 AromaticContact CE2-CH2 3.83Å; Y81-W91 HydrophobicContact CE2-CH2 3.83Å; Y81-W91 AromaticContact CE2-CZ2 3.92Å; Y81-W91 HydrophobicContact CE2-CZ2 3.92Å; Y81-W91 AromaticContact CG-CH2 3.64Å; Y81-W91 HydrophobicContact CG-CH2 3.64Å; Y81-W91 AromaticContact CG-CZ2 3.87Å; Y81-W91 HydrophobicContact CG-CZ2 3.87Å; Y81-W91 AromaticContact CZ-CH2 3.49Å; Y81-W91 VanDerWaalsContact CZ-CH2 3.49Å; Y81-W91 AromaticContact CZ-CZ3 3.9Å
82	G	74.6	Confident	67.8	Low	24 Å²	24	85.3 Å²	85.3	25%	0.247	45%	0.446	C	S	.	.			trans	66.8	-167.5	-176.1	0	0	0	0	0	113.4	Y78 R84 G85	Y78-G82 VanDerWaalsContact CD2-C 3.42Å; Y78-G82 WeakPolarHBondContact O-CA 3.46Å; Y78-G82 PolarHBondContact O-N 2.89Å; G82-R84 PolarHBondContact O-N 2.93Å; G82-R84 VanDerWaalsContact O-N 3.12Å; G82-G85 PolarHBondContact O-N 3.11Å
83	K	70.7	Confident	65.7	Low	50 Å²	50	84.2 Å²	84.2	22%	0.217	44%	0.437	C	S	.	.	G	3₁₀ helix	trans	-54.2	-34.6	178.8	-173.8	168.8	177.9	139.8	0	112.2	Y15 E64 Y78 G85 L86	Y15-K83 HydrophobicContact CE1-CD 4.24Å; Y15-K83 VanDerWaalsContact OH-CD 3.24Å; Y15-K83 WeakPolarHBondContact OH-CD 3.41Å; Y15-K83 WeakPolarHBondContact OH-CE 3.43Å; Y15-K83 WeakPolarHBondContact OH-CG 3.28Å; Y15-K83 PolarHBondContact OH-NZ 3.16Å; E64-K83 VanDerWaalsContact OE1-CE 3.27Å; E64-K83 WeakPolarHBondContact OE1-CE 3.3Å; E64-K83 IonicContact OE1-NZ 3.69Å; E64-K83 PolarHBondContact OE1-NZ 3.46Å; E64-K83 IonicContact OE2-NZ 3.92Å; E64-K83 PolarHBondContact OE2-NZ 2.88Å; Y78-K83 HydrophobicContact CE2-CB 3.98Å; Y78-K83 VanDerWaalsContact CE2-N 3.26Å; K83-G85 PolarHBondContact O-N 3.19Å; K83-L86 WeakPolarHBondContact O-CB 2.89Å; K83-L86 PolarHBondContact O-N 3.28Å; K83-L86 VanDerWaalsContact O-N 3.12Å
84	R	63.9	Low	63.7	Low	172 Å²	172	83.1 Å²	83.1	65%	0.649	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-64.3	-20.8	178.8	-63.3	-179.7	69.3	169.2	1.4	113.9	G82 L86 V88 R96	G82-R84 PolarHBondContact O-N 2.93Å; G82-R84 VanDerWaalsContact O-N 3.12Å; R84-L86 VanDerWaalsContact C-N 3.31Å; R84-V88 WeakPolarHBondContact O-CG2 3.29Å; R84-R96 PolarHBondContact NH1-O 3.49Å; R84-R96 VanDerWaalsContact NH1-O 3.13Å; R84-R96 PolarHBondContact NH2-O 3.16Å
85	G	65.4	Low	61.8	Low	6 Å²	6	90 Å²	90	6%	0.062	47%	0.47	C	S	.	.	G	3₁₀ helix	trans	-75.8	-19.7	175.8	0	0	0	0	0	113.9	I77 G82 K83	I77-G85 VanDerWaalsContact CG2-O 3.3Å; I77-G85 WeakPolarHBondContact CG2-O 3.11Å; G82-G85 PolarHBondContact O-N 3.11Å; K83-G85 PolarHBondContact O-N 3.19Å
86	L	68	Low	59.7	Low	53 Å²	53	94.5 Å²	94.5	28%	0.277	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-23.3	-176.6	-58.2	165	0	0	0	112.8	Y15 V68 A74 I77 Y78 K83 R84 V88	Y15-L86 HydrophobicContact CE2-CD1 3.87Å; V68-L86 HydrophobicContact CB-CD1 4.15Å; V68-L86 HydrophobicContact CG1-CD1 3.47Å; V68-L86 VanDerWaalsContact CG1-CD1 3.47Å; V68-L86 HydrophobicContact CG1-CD2 3.9Å; V68-L86 HydrophobicContact CG1-CG 4.31Å; V68-L86 HydrophobicContact CG2-CD1 3.57Å; V68-L86 HydrophobicContact CG2-CD2 4.39Å; A74-L86 HydrophobicContact CB-CD2 4.11Å; I77-L86 HydrophobicContact CG2-CD2 4.29Å; Y78-L86 HydrophobicContact CD2-CD1 3.73Å; Y78-L86 HydrophobicContact CD2-CG 4.45Å; Y78-L86 HydrophobicContact CE2-CD1 4.48Å; K83-L86 WeakPolarHBondContact O-CB 2.89Å; K83-L86 PolarHBondContact O-N 3.28Å; K83-L86 VanDerWaalsContact O-N 3.12Å; R84-L86 VanDerWaalsContact C-N 3.31Å; L86-V88 VanDerWaalsContact C-N 3.3Å; L86-V88 PolarHBondContact O-N 3.33Å
87	D	62.4	Low	57.9	Low	125 Å²	125	99.3 Å²	99.3	67%	0.668	50%	0.499	S	S	*	.	S	Bend	trans	-83.5	0.8	-177.4	-67.5	-30	0	0	0	113.6
88	V	54.2	Low	56.6	Low	62 Å²	62	102 Å²	102	38%	0.376	51%	0.505	S	S	.	.			trans	-119.4	91.4	-165	-158.6	0	0	0	0	112.1	R84 L86 G90	R84-V88 WeakPolarHBondContact O-CG2 3.29Å; L86-V88 VanDerWaalsContact C-N 3.3Å; L86-V88 PolarHBondContact O-N 3.33Å; V88-G90 PolarHBondContact O-N 2.98Å
89	D	48.6	Very low	55.5	Low	177 Å²	177	103.7 Å²	103.7	95%	0.947	52%	0.519	S	S	*	.	S	Bend	trans	-72.5	111.2	161.6	-89.6	-26.6	0	0	0	109.9
90	G	47.3	Very low	54.5	Low	66 Å²	66	105.3 Å²	105.3	68%	0.68	53%	0.533	S	S	*	.	S	Bend	trans	83.1	107.9	175.2	0	0	0	0	0	114.3	V88	V88-G90 PolarHBondContact O-N 2.98Å
91	W	40.2	Very low	53.8	Low	115 Å²	115	102.7 Å²	102.7	44%	0.436	53%	0.529	S	S	.	.			trans	-84.8	132	-176	-78.1	46.1	0	0	0	113	Y81 V93	Y81-W91 AromaticContact CD1-CH2 3.33Å; Y81-W91 HydrophobicContact CD1-CH2 3.33Å; Y81-W91 HydrophobicContact CD1-CZ2 4.05Å; Y81-W91 HydrophobicContact CD1-CZ3 4.22Å; Y81-W91 AromaticContact CD2-CH2 3.9Å; Y81-W91 HydrophobicContact CD2-CH2 3.9Å; Y81-W91 AromaticContact CD2-CZ2 3.82Å; Y81-W91 HydrophobicContact CD2-CZ2 3.82Å; Y81-W91 AromaticContact CE1-CH2 3.24Å; Y81-W91 HydrophobicContact CE1-CH2 3.24Å; Y81-W91 HydrophobicContact CE1-CZ2 4.14Å; Y81-W91 AromaticContact CE1-CZ3 3.72Å; Y81-W91 HydrophobicContact CE1-CZ3 3.72Å; Y81-W91 AromaticContact CE2-CH2 3.83Å; Y81-W91 HydrophobicContact CE2-CH2 3.83Å; Y81-W91 AromaticContact CE2-CZ2 3.92Å; Y81-W91 HydrophobicContact CE2-CZ2 3.92Å; Y81-W91 AromaticContact CG-CH2 3.64Å; Y81-W91 HydrophobicContact CG-CH2 3.64Å; Y81-W91 AromaticContact CG-CZ2 3.87Å; Y81-W91 HydrophobicContact CG-CZ2 3.87Å; Y81-W91 AromaticContact CZ-CH2 3.49Å; Y81-W91 VanDerWaalsContact CZ-CH2 3.49Å; Y81-W91 AromaticContact CZ-CZ3 3.9Å; W91-V93 HydrophobicContact CD2-CG2 3.6Å; W91-V93 HydrophobicContact CE3-CB 3.69Å; W91-V93 HydrophobicContact CE3-CG2 3.1Å; W91-V93 HydrophobicContact CG-CG2 4.35Å; W91-V93 HydrophobicContact CH2-CG2 3.68Å; W91-V93 HydrophobicContact CZ2-CG2 4.19Å; W91-V93 HydrophobicContact CZ3-CB 3.69Å; W91-V93 HydrophobicContact CZ3-CG1 4.12Å; W91-V93 HydrophobicContact CZ3-CG2 3.17Å
92	E	35.5	Very low	53.8	Low	196 Å²	196	100.6 Å²	100.6	92%	0.916	52%	0.523	S	S	*	.				-132.8	117	118.6	-90.5	-165.4	170.5	0	0	108.6
93	V	40.8	Very low	53.5	Low	82 Å²	82	100.6 Å²	100.6	50%	0.497	52%	0.518	S	S	.	.			trans	-90.9	113.7	-174.3	160.6	0	0	0	0	110.8	W91 E95	W91-V93 HydrophobicContact CD2-CG2 3.6Å; W91-V93 HydrophobicContact CE3-CB 3.69Å; W91-V93 HydrophobicContact CE3-CG2 3.1Å; W91-V93 HydrophobicContact CG-CG2 4.35Å; W91-V93 HydrophobicContact CH2-CG2 3.68Å; W91-V93 HydrophobicContact CZ2-CG2 4.19Å; W91-V93 HydrophobicContact CZ3-CB 3.69Å; W91-V93 HydrophobicContact CZ3-CG1 4.12Å; W91-V93 HydrophobicContact CZ3-CG2 3.17Å; V93-E95 HydrophobicContact CG1-CG 4.48Å
94	V	36.8	Very low	53.5	Low	124 Å²	124	106.5 Å²	106.5	75%	0.752	54%	0.538	S	S	*	.			trans	-102.7	112.1	157	177.8	0	0	0	0	106.8	R96	V94-R96 PolarHBondContact O-N 3.45Å
95	E	40.8	Very low	54.1	Low	160 Å²	160	104.8 Å²	104.8	75%	0.748	54%	0.538	S	S	*	.			trans	-56.5	123.9	175.4	-67.5	179	156	0	0	110.9	V93	V93-E95 HydrophobicContact CG1-CG 4.48Å
96	R	42.3	Very low	54.5	Low	137 Å²	137	107 Å²	107	52%	0.517	55%	0.547	S	S	.	.			trans	-130.7	100.9	164.1	-85.6	-178.3	170.7	-171.8	1.2	109.6	R84 V94 R98 I103	R84-R96 PolarHBondContact NH1-O 3.49Å; R84-R96 VanDerWaalsContact NH1-O 3.13Å; R84-R96 PolarHBondContact NH2-O 3.16Å; V94-R96 PolarHBondContact O-N 3.45Å; R96-R98 VanDerWaalsContact C-N 3.35Å; R96-I103 HydrophobicContact CB-CD1 4.15Å; R96-I103 HydrophobicContact CG-CD1 4.2Å; R96-I103 VanDerWaalsContact CZ-CG2 3.46Å
97	K	41.4	Very low	54.8	Low	148 Å²	148	110.5 Å²	110.5	64%	0.643	56%	0.557	S	S	*	*			trans	-88	20.1	176.4	-70	-165.8	168.3	-142.1	0	113.8	E9	E9-K97 IonicContact OE2-NZ 3.63Å; E9-K97 PolarHBondContact OE2-NZ 2.96Å
98	R	51.5	Low	55.6	Low	124 Å²	124	108.6 Å²	108.6	47%	0.468	54%	0.544	S	S	.	.	S	Bend	trans	-138.3	152.1	-172	-66.6	-168.6	-166.5	174.4	19.7	112.3	R96 E102 I103 E106	R96-R98 VanDerWaalsContact C-N 3.35Å; R98-E102 HydrophobicContact CB-CB 3.98Å; R98-I103 HydrophobicContact CB-CG1 3.68Å; R98-I103 WeakPolarHBondContact O-CD1 3.46Å; R98-I103 WeakPolarHBondContact O-CG1 3.31Å; R98-E106 WeakPolarHBondContact CD-OE2 3.38Å; R98-E106 IonicContact CZ-OE1 2.82Å; R98-E106 IonicContact CZ-OE2 3.48Å; R98-E106 IonicContact NE-OE1 3.41Å; R98-E106 IonicContact NE-OE2 2.63Å; R98-E106 PolarHBondContact NE-OE2 3.44Å; R98-E106 VanDerWaalsContact NH1-CG 3.28Å; R98-E106 IonicContact NH1-OE1 3.49Å; R98-E106 PolarHBondContact NH1-OE1 3.1Å; R98-E106 IonicContact NH1-OE2 2.7Å; R98-E106 PolarHBondContact NH1-OE2 3.4Å; R98-E106 VanDerWaalsContact NH2-CD 3.3Å; R98-E106 IonicContact NH2-OE1 2.63Å; R98-E106 PolarHBondContact NH2-OE1 3.45Å; R98-E106 IonicContact NH2-OE2 2.88Å; R98-E106 PolarHBondContact NH2-OE2 3.32Å
99	S	59	Low	56.7	Low	48 Å²	48	114.6 Å²	114.6	34%	0.336	56%	0.56	S	S	.	*			trans	-62.5	157	175.4	66.7	0	0	0	0	111.5	A101 E102 I103	S99-A101 PolarHBondContact O-N 2.89Å; S99-A101 VanDerWaalsContact O-N 3.07Å; S99-E102 WeakPolarHBondContact CB-OE2 3.24Å; S99-E102 PolarHBondContact N-OE2 3.27Å; S99-E102 PolarHBondContact O-N 3.45Å; S99-E102 VanDerWaalsContact O-N 3.08Å; S99-E102 WeakPolarHBondContact OG-CB 3.48Å; S99-E102 WeakPolarHBondContact OG-CG 3.26Å; S99-E102 PolarHBondContact OG-N 3.21Å; S99-E102 PolarHBondContact OG-OE2 3.44Å; S99-I103 WeakPolarHBondContact O-CB 3.25Å; S99-I103 WeakPolarHBondContact O-CD1 3.42Å; S99-I103 VanDerWaalsContact O-CG1 3.24Å; S99-I103 WeakPolarHBondContact O-CG1 3.4Å; S99-I103 PolarHBondContact O-N 3.42Å
100	P	60.9	Low	58	Low	106 Å²	106	109.3 Å²	109.3	69%	0.688	53%	0.531	S	S	*	.	H	α-helix	trans	-55.4	-29.5	-179.5	-27	34.9	0	0	0	114.5	R104	P100-R104 WeakPolarHBondContact O-CB 3.26Å; P100-R104 PolarHBondContact O-N 2.9Å
101	A	60.4	Low	59.4	Low	62 Å²	62	110.2 Å²	110.2	51%	0.512	52%	0.518	S	S	.	.	H	α-helix	trans	-75.6	-47.6	175.2	0	0	0	0	0	111.6	S99 I103 R104 E105	S99-A101 PolarHBondContact O-N 2.89Å; S99-A101 VanDerWaalsContact O-N 3.07Å; A101-I103 VanDerWaalsContact C-N 3.33Å; A101-I103 PolarHBondContact O-N 3.02Å; A101-R104 WeakPolarHBondContact O-CB 3.33Å; A101-R104 PolarHBondContact O-N 3.25Å; A101-R104 VanDerWaalsContact O-N 3.12Å; A101-E105 PolarHBondContact O-N 3.43Å
102	E	65.6	Low	61.2	Low	75 Å²	75	112.3 Å²	112.3	35%	0.35	53%	0.526	S	S	.	.	H	α-helix	trans	-67.5	-30.8	176.8	-70	164	157.3	0	0	112.9	R98 S99 R104 E106	R98-E102 HydrophobicContact CB-CB 3.98Å; S99-E102 WeakPolarHBondContact CB-OE2 3.24Å; S99-E102 PolarHBondContact N-OE2 3.27Å; S99-E102 PolarHBondContact O-N 3.45Å; S99-E102 VanDerWaalsContact O-N 3.08Å; S99-E102 WeakPolarHBondContact OG-CB 3.48Å; S99-E102 WeakPolarHBondContact OG-CG 3.26Å; S99-E102 PolarHBondContact OG-N 3.21Å; S99-E102 PolarHBondContact OG-OE2 3.44Å; E102-R104 VanDerWaalsContact C-N 3.34Å; E102-E106 WeakPolarHBondContact O-CB 3.43Å; E102-E106 PolarHBondContact O-N 3.15Å
103	I	66.6	Low	63.1	Low	25 Å²	25	106.5 Å²	106.5	13%	0.128	50%	0.499	C	S	.	.	H	α-helix	trans	-65.8	-41.3	171.5	-67.7	159.5	0	0	0	109.8	R96 R98 S99 A101 Y107	R96-I103 HydrophobicContact CB-CD1 4.15Å; R96-I103 HydrophobicContact CG-CD1 4.2Å; R96-I103 VanDerWaalsContact CZ-CG2 3.46Å; R98-I103 HydrophobicContact CB-CG1 3.68Å; R98-I103 WeakPolarHBondContact O-CD1 3.46Å; R98-I103 WeakPolarHBondContact O-CG1 3.31Å; S99-I103 WeakPolarHBondContact O-CB 3.25Å; S99-I103 WeakPolarHBondContact O-CD1 3.42Å; S99-I103 VanDerWaalsContact O-CG1 3.24Å; S99-I103 WeakPolarHBondContact O-CG1 3.4Å; S99-I103 PolarHBondContact O-N 3.42Å; A101-I103 VanDerWaalsContact C-N 3.33Å; A101-I103 PolarHBondContact O-N 3.02Å; I103-Y107 WeakPolarHBondContact O-CA 3.38Å; I103-Y107 WeakPolarHBondContact O-CB 3.31Å; I103-Y107 PolarHBondContact O-N 3.45Å
104	R	72.6	Confident	64.5	Low	173 Å²	173	111.2 Å²	111.2	65%	0.653	51%	0.507	S	S	*	.	H	α-helix	trans	-67.2	-46	179.1	-170.6	179.6	-59.4	-174.5	0.8	110.3	P100 A101 E102 Y107 E108	P100-R104 WeakPolarHBondContact O-CB 3.26Å; P100-R104 PolarHBondContact O-N 2.9Å; A101-R104 WeakPolarHBondContact O-CB 3.33Å; A101-R104 PolarHBondContact O-N 3.25Å; A101-R104 VanDerWaalsContact O-N 3.12Å; E102-R104 VanDerWaalsContact C-N 3.34Å; R104-Y107 PolarHBondContact O-N 2.84Å; R104-E108 WeakPolarHBondContact O-CB 3.46Å; R104-E108 VanDerWaalsContact O-CG 3.3Å; R104-E108 WeakPolarHBondContact O-CG 3.34Å; R104-E108 PolarHBondContact O-N 2.92Å
105	E	76	Confident	66.3	Low	136 Å²	136	110.9 Å²	110.9	64%	0.636	50%	0.497	S	S	*	.	H	α-helix	trans	-65.3	-42	176.1	-73	-175.3	178.2	0	0	112.6	A101 E108 R109	A101-E105 PolarHBondContact O-N 3.43Å; E105-E108 PolarHBondContact O-N 3.25Å; E105-R109 WeakPolarHBondContact O-CB 3.28Å; E105-R109 PolarHBondContact O-N 3.48Å
106	E	72.5	Confident	67.7	Low	54 Å²	54	108.8 Å²	108.8	25%	0.252	49%	0.488	S	S	.	.	H	α-helix	trans	-65.3	-42.4	173.8	-177.3	-177.9	-149.7	0	0	111	R98 E102 E108 R109 L110	R98-E106 WeakPolarHBondContact CD-OE2 3.38Å; R98-E106 IonicContact CZ-OE1 2.82Å; R98-E106 IonicContact CZ-OE2 3.48Å; R98-E106 IonicContact NE-OE1 3.41Å; R98-E106 IonicContact NE-OE2 2.63Å; R98-E106 PolarHBondContact NE-OE2 3.44Å; R98-E106 VanDerWaalsContact NH1-CG 3.28Å; R98-E106 IonicContact NH1-OE1 3.49Å; R98-E106 PolarHBondContact NH1-OE1 3.1Å; R98-E106 IonicContact NH1-OE2 2.7Å; R98-E106 PolarHBondContact NH1-OE2 3.4Å; R98-E106 VanDerWaalsContact NH2-CD 3.3Å; R98-E106 IonicContact NH2-OE1 2.63Å; R98-E106 PolarHBondContact NH2-OE1 3.45Å; R98-E106 IonicContact NH2-OE2 2.88Å; R98-E106 PolarHBondContact NH2-OE2 3.32Å; E102-E106 WeakPolarHBondContact O-CB 3.43Å; E102-E106 PolarHBondContact O-N 3.15Å; E106-E108 VanDerWaalsContact C-N 3.34Å; E106-R109 CarbonylContact O-C 3.51Å; E106-R109 PolarHBondContact O-N 2.82Å; E106-L110 HydrophobicContact CG-CD1 3.74Å; E106-L110 HydrophobicContact CG-CG 4Å; E106-L110 VanDerWaalsContact O-CB 3.26Å; E106-L110 WeakPolarHBondContact O-CB 3.24Å; E106-L110 VanDerWaalsContact O-CG 3.3Å; E106-L110 WeakPolarHBondContact O-CG 3.37Å; E106-L110 PolarHBondContact O-N 3.19Å
107	Y	74.1	Confident	68.9	Low	126 Å²	126	108.4 Å²	108.4	49%	0.494	49%	0.486	S	S	.	.	H	α-helix	trans	-61.9	-45.1	177.8	-177.9	-93.6	0	0	0	110.8	I103 R104 R109 L110 Q111	I103-Y107 WeakPolarHBondContact O-CA 3.38Å; I103-Y107 WeakPolarHBondContact O-CB 3.31Å; I103-Y107 PolarHBondContact O-N 3.45Å; R104-Y107 PolarHBondContact O-N 2.84Å; Y107-R109 VanDerWaalsContact C-N 3.35Å; Y107-L110 PolarHBondContact O-N 3.14Å; Y107-Q111 HydrophobicContact CD1-CG 4.11Å; Y107-Q111 HydrophobicContact CE1-CG 3.7Å; Y107-Q111 VanDerWaalsContact O-CB 3.28Å; Y107-Q111 WeakPolarHBondContact O-CB 3.5Å; Y107-Q111 WeakPolarHBondContact O-CG 3.2Å; Y107-Q111 PolarHBondContact O-N 2.73Å; Y107-Q111 PolarHBondContact OH-NE2 2.56Å; Y107-Q111 VanDerWaalsContact OH-NE2 3.11Å
108	E	79.9	Confident	70.2	Confident	85 Å²	85	108.8 Å²	108.8	40%	0.397	48%	0.484	S	S	.	.	H	α-helix	trans	-62.3	-41.9	173.9	-75.8	178.9	-160.3	0	0	111.6	R104 E105 E106 Q111 R112	R104-E108 WeakPolarHBondContact O-CB 3.46Å; R104-E108 VanDerWaalsContact O-CG 3.3Å; R104-E108 WeakPolarHBondContact O-CG 3.34Å; R104-E108 PolarHBondContact O-N 2.92Å; E105-E108 PolarHBondContact O-N 3.25Å; E106-E108 VanDerWaalsContact C-N 3.34Å; E108-Q111 PolarHBondContact O-N 3.39Å; E108-R112 WeakPolarHBondContact O-CG 3.39Å; E108-R112 PolarHBondContact O-N 3.4Å; E108-R112 IonicContact OE2-NH2 2.66Å
109	R	77.8	Confident	70.9	Confident	188 Å²	188	108 Å²	108	71%	0.709	49%	0.488	S	S	*	.	H	α-helix	trans	-64.3	-46.7	176.5	-171.7	178.6	-177.5	-179.7	1.9	111.7	E105 E106 Y107 Q111 R112 E113	E105-R109 WeakPolarHBondContact O-CB 3.28Å; E105-R109 PolarHBondContact O-N 3.48Å; E106-R109 CarbonylContact O-C 3.51Å; E106-R109 PolarHBondContact O-N 2.82Å; Y107-R109 VanDerWaalsContact C-N 3.35Å; R109-Q111 VanDerWaalsContact C-N 3.33Å; R109-R112 PolarHBondContact O-N 3.45Å; R109-E113 VanDerWaalsContact O-CB 3.27Å; R109-E113 WeakPolarHBondContact O-CB 2.84Å; R109-E113 PolarHBondContact O-N 2.96Å
110	L	76.4	Confident	71.1	Confident	66 Å²	66	111.5 Å²	111.5	35%	0.346	50%	0.499	S	S	.	.	H	α-helix	trans	-66.4	-34.7	176.3	-75.9	174.3	0	0	0	111.5	E106 Y107 R114	E106-L110 HydrophobicContact CG-CD1 3.74Å; E106-L110 HydrophobicContact CG-CG 4Å; E106-L110 VanDerWaalsContact O-CB 3.26Å; E106-L110 WeakPolarHBondContact O-CB 3.24Å; E106-L110 VanDerWaalsContact O-CG 3.3Å; E106-L110 WeakPolarHBondContact O-CG 3.37Å; E106-L110 PolarHBondContact O-N 3.19Å; Y107-L110 PolarHBondContact O-N 3.14Å; L110-R114 WeakPolarHBondContact O-CB 3.4Å; L110-R114 WeakPolarHBondContact O-CG 3.46Å; L110-R114 PolarHBondContact O-N 3.31Å
111	Q	75.8	Confident	71.1	Confident	84 Å²	84	113.8 Å²	113.8	39%	0.393	50%	0.501	S	S	.	.	H	α-helix	trans	-66.1	-51.3	173.1	-85.5	-145.3	-28.9	0	0	110.9	Y107 E108 R109 E113 R114 E115	Y107-Q111 HydrophobicContact CD1-CG 4.11Å; Y107-Q111 HydrophobicContact CE1-CG 3.7Å; Y107-Q111 VanDerWaalsContact O-CB 3.28Å; Y107-Q111 WeakPolarHBondContact O-CB 3.5Å; Y107-Q111 WeakPolarHBondContact O-CG 3.2Å; Y107-Q111 PolarHBondContact O-N 2.73Å; Y107-Q111 PolarHBondContact OH-NE2 2.56Å; Y107-Q111 VanDerWaalsContact OH-NE2 3.11Å; E108-Q111 PolarHBondContact O-N 3.39Å; R109-Q111 VanDerWaalsContact C-N 3.33Å; Q111-E113 VanDerWaalsContact C-N 3.28Å; Q111-E113 PolarHBondContact O-N 3.25Å; Q111-R114 PolarHBondContact O-N 2.99Å; Q111-E115 WeakPolarHBondContact O-CB 3.31Å; Q111-E115 WeakPolarHBondContact O-CG 3.27Å; Q111-E115 PolarHBondContact O-N 3.39Å
112	R	79.4	Confident	71.4	Confident	160 Å²	160	117.6 Å²	117.6	60%	0.604	50%	0.502	S	S	*	.	H	α-helix	trans	-57.5	-43.5	175.1	-71.2	-177.8	-158.5	167.4	10.5	111.3	E108 R109 E115 E116	E108-R112 WeakPolarHBondContact O-CG 3.39Å; E108-R112 PolarHBondContact O-N 3.4Å; E108-R112 IonicContact OE2-NH2 2.66Å; R109-R112 PolarHBondContact O-N 3.45Å; R112-E115 PolarHBondContact O-N 3.3Å; R112-E116 WeakPolarHBondContact O-CB 3.4Å; R112-E116 WeakPolarHBondContact O-CG 3.33Å; R112-E116 PolarHBondContact O-N 3.23Å
113	E	73.6	Confident	71.3	Confident	74 Å²	74	117 Å²	117	35%	0.346	50%	0.504	S	S	.	.	H	α-helix	trans	-67.6	-37.6	178.8	-161.7	-172.2	164.6	0	0	112.3	R109 Q111 R117	R109-E113 VanDerWaalsContact O-CB 3.27Å; R109-E113 WeakPolarHBondContact O-CB 2.84Å; R109-E113 PolarHBondContact O-N 2.96Å; Q111-E113 VanDerWaalsContact C-N 3.28Å; Q111-E113 PolarHBondContact O-N 3.25Å; E113-R117 VanDerWaalsContact O-CB 3.29Å; E113-R117 WeakPolarHBondContact O-CB 3.31Å; E113-R117 VanDerWaalsContact O-CG 3.26Å; E113-R117 WeakPolarHBondContact O-CG 3.33Å; E113-R117 PolarHBondContact O-N 3.25Å; E113-R117 IonicContact OE1-CZ 3.66Å; E113-R117 IonicContact OE1-NE 3.87Å; E113-R117 PolarHBondContact OE1-NE 3.46Å; E113-R117 IonicContact OE1-NH2 2.79Å; E113-R117 PolarHBondContact OE1-NH2 3.18Å; E113-R117 IonicContact OE2-NH2 3.33Å
114	R	71.6	Confident	71.7	Confident	181 Å²	181	119 Å²	119	68%	0.683	51%	0.514	S	S	*	.	H	α-helix	trans	-67.7	-40.8	173	-81.6	178	-179	-175.3	2.1	111.6	L110 Q111 R117 R118	L110-R114 WeakPolarHBondContact O-CB 3.4Å; L110-R114 WeakPolarHBondContact O-CG 3.46Å; L110-R114 PolarHBondContact O-N 3.31Å; Q111-R114 PolarHBondContact O-N 2.99Å; R114-R117 PolarHBondContact O-N 3.45Å; R114-R118 WeakPolarHBondContact O-CB 3.18Å; R114-R118 PolarHBondContact O-N 3Å
115	E	73.3	Confident	72.2	Confident	116 Å²	116	113 Å²	113	54%	0.542	50%	0.498	S	S	.	.	H	α-helix	trans	-64.7	-46.5	175.7	-76	-175.2	167	0	0	110.8	Q111 R112 R118 L119	Q111-E115 WeakPolarHBondContact O-CB 3.31Å; Q111-E115 WeakPolarHBondContact O-CG 3.27Å; Q111-E115 PolarHBondContact O-N 3.39Å; R112-E115 PolarHBondContact O-N 3.3Å; E115-R118 WeakPolarHBondContact O-CB 3.27Å; E115-R118 PolarHBondContact O-N 3.36Å; E115-L119 WeakPolarHBondContact O-CB 3.38Å; E115-L119 VanDerWaalsContact O-CG 3.25Å; E115-L119 WeakPolarHBondContact O-CG 3.33Å; E115-L119 PolarHBondContact O-N 3.43Å
116	E	70.8	Confident	72.7	Confident	116 Å²	116	110.9 Å²	110.9	54%	0.542	49%	0.486	S	S	.	.	H	α-helix	trans	-60.3	-46.4	172.8	-77.8	-177.3	174.7	0	0	111.8	R112 R118 L119 Q120	R112-E116 WeakPolarHBondContact O-CB 3.4Å; R112-E116 WeakPolarHBondContact O-CG 3.33Å; R112-E116 PolarHBondContact O-N 3.23Å; E116-R118 VanDerWaalsContact C-N 3.32Å; E116-R118 PolarHBondContact O-N 2.97Å; E116-L119 PolarHBondContact O-N 3.04Å; E116-Q120 WeakPolarHBondContact O-CB 3.25Å; E116-Q120 VanDerWaalsContact O-CG 3.29Å; E116-Q120 WeakPolarHBondContact O-CG 3.35Å; E116-Q120 PolarHBondContact O-N 3.16Å
117	R	67.3	Low	73.6	Confident	130 Å²	130	109.1 Å²	109.1	49%	0.491	48%	0.483	S	S	.	.	H	α-helix	trans	-62	-38.9	174.2	-78.4	-173.1	-139.4	174.2	6	111.7	E113 R114 Q120 Q121	E113-R117 VanDerWaalsContact O-CB 3.29Å; E113-R117 WeakPolarHBondContact O-CB 3.31Å; E113-R117 VanDerWaalsContact O-CG 3.26Å; E113-R117 WeakPolarHBondContact O-CG 3.33Å; E113-R117 PolarHBondContact O-N 3.25Å; E113-R117 IonicContact OE1-CZ 3.66Å; E113-R117 IonicContact OE1-NE 3.87Å; E113-R117 PolarHBondContact OE1-NE 3.46Å; E113-R117 IonicContact OE1-NH2 2.79Å; E113-R117 PolarHBondContact OE1-NH2 3.18Å; E113-R117 IonicContact OE2-NH2 3.33Å; R114-R117 PolarHBondContact O-N 3.45Å; R117-Q120 CarbonylContact O-C 3.57Å; R117-Q120 PolarHBondContact O-N 3.36Å; R117-Q121 WeakPolarHBondContact O-CB 3.21Å; R117-Q121 VanDerWaalsContact O-CG 3.27Å; R117-Q121 WeakPolarHBondContact O-CG 3.27Å; R117-Q121 PolarHBondContact O-N 2.91Å
118	R	69.8	Low	74.6	Confident	155 Å²	155	104.7 Å²	104.7	59%	0.585	47%	0.471	S	S	*	.	H	α-helix	trans	-66.8	-39.8	177.6	-173	-178.7	-174.5	-165.5	1.3	110.7	R114 E115 E116 Q121 R122	R114-R118 WeakPolarHBondContact O-CB 3.18Å; R114-R118 PolarHBondContact O-N 3Å; E115-R118 WeakPolarHBondContact O-CB 3.27Å; E115-R118 PolarHBondContact O-N 3.36Å; E116-R118 VanDerWaalsContact C-N 3.32Å; E116-R118 PolarHBondContact O-N 2.97Å; R118-Q121 PolarHBondContact O-N 3.14Å; R118-R122 WeakPolarHBondContact O-CG 3.14Å; R118-R122 PolarHBondContact O-N 2.9Å
119	L	66	Low	75.3	Confident	108 Å²	108	103 Å²	103	57%	0.565	46%	0.464	S	S	*	.	H	α-helix	trans	-66.3	-44.1	173.2	-70.6	168.2	0	0	0	111	E115 E116 Q121 R122 T123	E115-L119 WeakPolarHBondContact O-CB 3.38Å; E115-L119 VanDerWaalsContact O-CG 3.25Å; E115-L119 WeakPolarHBondContact O-CG 3.33Å; E115-L119 PolarHBondContact O-N 3.43Å; E116-L119 PolarHBondContact O-N 3.04Å; L119-Q121 VanDerWaalsContact C-N 3.29Å; L119-Q121 PolarHBondContact O-N 3.42Å; L119-R122 WeakPolarHBondContact O-CB 3.45Å; L119-R122 PolarHBondContact O-N 3.14Å; L119-T123 PolarHBondContact O-N 3.47Å; L119-T123 VanDerWaalsContact O-N 3.11Å; L119-T123 PolarHBondContact O-OG1 3.3Å
120	Q	62.1	Low	76.1	Confident	122 Å²	122	94.6 Å²	94.6	57%	0.57	43%	0.434	S	S	*	.	H	α-helix	trans	-68.1	-21.1	173.6	-72.2	177.4	12.8	0	0	114	E116 R117 T123	E116-Q120 WeakPolarHBondContact O-CB 3.25Å; E116-Q120 VanDerWaalsContact O-CG 3.29Å; E116-Q120 WeakPolarHBondContact O-CG 3.35Å; E116-Q120 PolarHBondContact O-N 3.16Å; R117-Q120 CarbonylContact O-C 3.57Å; R117-Q120 PolarHBondContact O-N 3.36Å; Q120-T123 CarbonylContact C-O 3.53Å; Q120-T123 VanDerWaalsContact C-O 3.22Å; Q120-T123 WeakPolarHBondContact CA-O 3.29Å; Q120-T123 CarbonylContact O-C 3.53Å; Q120-T123 VanDerWaalsContact O-C 3.26Å
121	Q	61.9	Low	77	Confident	154 Å²	154	92.5 Å²	92.5	72%	0.72	42%	0.424	S	S	*	.	H	α-helix	trans	-81.9	-31.3	170.9	-81.1	179.6	-8.5	0	0	111.8	R117 R118 L119 T123	R117-Q121 WeakPolarHBondContact O-CB 3.21Å; R117-Q121 VanDerWaalsContact O-CG 3.27Å; R117-Q121 WeakPolarHBondContact O-CG 3.27Å; R117-Q121 PolarHBondContact O-N 2.91Å; R118-Q121 PolarHBondContact O-N 3.14Å; L119-Q121 VanDerWaalsContact C-N 3.29Å; L119-Q121 PolarHBondContact O-N 3.42Å; Q121-T123 VanDerWaalsContact C-N 3.34Å
122	R	66.1	Low	77.8	Confident	141 Å²	141	88.7 Å²	88.7	53%	0.532	41%	0.407	S	S	.	.	H	α-helix	trans	-68.4	-36.6	174.9	-77.5	179.7	-179	-147.1	2.6	111.9	R118 L119 P170	R118-R122 WeakPolarHBondContact O-CG 3.14Å; R118-R122 PolarHBondContact O-N 2.9Å; L119-R122 WeakPolarHBondContact O-CB 3.45Å; L119-R122 PolarHBondContact O-N 3.14Å; R122-P170 WeakPolarHBondContact O-CD 3.44Å
123	T	63.9	Low	78.4	Confident	64 Å²	64	83 Å²	83	39%	0.393	39%	0.388	S	S	.	.	S	Bend	trans	-128.2	112.5	172.1	48.4	0	0	0	0	106.3	L119 Q120 Q121 P125 I167	L119-T123 PolarHBondContact O-N 3.47Å; L119-T123 VanDerWaalsContact O-N 3.11Å; L119-T123 PolarHBondContact O-OG1 3.3Å; Q120-T123 CarbonylContact C-O 3.53Å; Q120-T123 VanDerWaalsContact C-O 3.22Å; Q120-T123 WeakPolarHBondContact CA-O 3.29Å; Q120-T123 CarbonylContact O-C 3.53Å; Q120-T123 VanDerWaalsContact O-C 3.26Å; Q121-T123 VanDerWaalsContact C-N 3.34Å; T123-P125 WeakPolarHBondContact O-CD 3.45Å; T123-I167 HydrophobicContact CG2-CG2 3.83Å
124	N	74.4	Confident	79.2	Confident	65 Å²	65	80.7 Å²	80.7	35%	0.348	38%	0.378	S	S	.	.			trans	-93.8	76.6	174.7	-176	15.2	0	0	0	109.1	K126 E168	N124-K126 PolarHBondContact O-N 3.26Å; N124-E168 PolarHBondContact N-O 2.91Å
125	P	82.7	Confident	80.1	Confident	47 Å²	47	72.2 Å²	72.2	31%	0.305	35%	0.347	S	S	.	.			trans	-68.7	121.9	-176.6	30.2	-36.7	0	0	0	108.6	T123 S166 I167 S370	T123-P125 WeakPolarHBondContact O-CD 3.45Å; P125-S166 CarbonylContact C-O 3.55Å; P125-S166 WeakPolarHBondContact CA-O 3.29Å; P125-I167 HydrophobicContact CB-CG1 4.44Å; P125-S370 WeakPolarHBondContact O-CB 3.3Å; P125-S370 PolarHBondContact O-OG 3.38Å
126	K	87.9	Confident	80.8	Confident	92 Å²	92	67.1 Å²	67.1	40%	0.4	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	128.5	168.4	-63.5	168.4	-175.6	156.3	0	107.7	N124 Q165 S166 E168 S370	N124-K126 PolarHBondContact O-N 3.26Å; K126-Q165 CarbonylContact O-C 3.55Å; K126-Q165 WeakPolarHBondContact O-CA 3.48Å; K126-S166 PolarHBondContact N-O 3.06Å; K126-S166 PolarHBondContact O-N 3.32Å; K126-E168 IonicContact NZ-OE1 2.78Å; K126-E168 PolarHBondContact NZ-OE1 3.07Å; K126-S370 WeakPolarHBondContact CA-O 3.49Å
127	G	91.4	Very high	81.4	Confident	18 Å²	18	63.1 Å²	63.1	19%	0.186	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	141.4	179.1	0	0	0	0	0	110.5	S164 S370 Q371 T372	G127-S164 CarbonylContact C-O 3.59Å; G127-S164 WeakPolarHBondContact CA-O 3.44Å; G127-S370 PolarHBondContact N-O 3.24Å; G127-S370 VanDerWaalsContact N-O 3.12Å; G127-Q371 CarbonylContact O-C 3.56Å; G127-Q371 VanDerWaalsContact O-CA 3.3Å; G127-Q371 WeakPolarHBondContact O-CA 3.24Å; G127-T372 PolarHBondContact O-N 2.77Å
128	S	94.3	Very high	82.2	Confident	33 Å²	33	60.9 Å²	60.9	23%	0.231	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	124.9	167.3	-172.7	0	0	0	0	109	I163 S164 T372	S128-I163 CarbonylContact O-C 3.28Å; S128-I163 WeakPolarHBondContact O-CA 3.46Å; S128-S164 WeakPolarHBondContact CB-OG 3.48Å; S128-S164 PolarHBondContact N-O 3.26Å; S128-S164 PolarHBondContact O-N 3.02Å; S128-T372 CarbonylContact C-O 3.57Å; S128-T372 VanDerWaalsContact CA-O 3.26Å; S128-T372 WeakPolarHBondContact CA-O 3.48Å
129	I	94.7	Very high	82.8	Confident	49 Å²	49	55.8 Å²	55.8	25%	0.251	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	123.1	175.2	-59.1	177.2	0	0	0	106.7	V131 M161 H162 I163 T372 Y373 F374	I129-V131 HydrophobicContact CG2-CG2 4.33Å; I129-M161 HydrophobicContact CG2-CE 4.4Å; I129-H162 CarbonylContact C-O 3.53Å; I129-I163 HydrophobicContact CG1-CG1 4.45Å; I129-I163 HydrophobicContact CG1-CG2 4.46Å; I129-I163 HydrophobicContact CG2-CG1 4.37Å; I129-T372 PolarHBondContact N-O 2.81Å; I129-Y373 HydrophobicContact CB-CD1 4.15Å; I129-Y373 HydrophobicContact CB-CE1 4.47Å; I129-Y373 HydrophobicContact CD1-CD1 4.32Å; I129-Y373 HydrophobicContact CD1-CE1 3.77Å; I129-Y373 CarbonylContact O-C 3.54Å; I129-Y373 WeakPolarHBondContact O-CA 3.45Å; I129-F374 PolarHBondContact O-N 3.12Å
130	S	94.8	Very high	83	Confident	11 Å²	11	52.3 Å²	52.3	8%	0.077	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	127.5	177.1	177.3	0	0	0	0	109.3	M161 H162 F374	S130-M161 CarbonylContact O-C 3.5Å; S130-M161 WeakPolarHBondContact O-CA 3.47Å; S130-H162 PolarHBondContact N-O 3.01Å; S130-H162 PolarHBondContact O-N 3.12Å; S130-F374 CarbonylContact C-O 3.55Å; S130-F374 WeakPolarHBondContact CA-O 3.13Å
131	V	94.7	Very high	82.9	Confident	23 Å²	23	56.7 Å²	56.7	14%	0.139	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	105.9	175.5	-175.9	0	0	0	0	107.4	I129 I133 I158 M161 F374 F375 P376	I129-V131 HydrophobicContact CG2-CG2 4.33Å; V131-I133 HydrophobicContact CG1-CG1 4.37Å; V131-I158 HydrophobicContact CG1-CD1 4.3Å; V131-I158 HydrophobicContact CG1-CG1 4.42Å; V131-I158 HydrophobicContact CG1-CG2 3.73Å; V131-M161 HydrophobicContact CG2-CE 4.47Å; V131-M161 HydrophobicContact CG2-CG 4.37Å; V131-F374 PolarHBondContact N-O 3.48Å; V131-F375 HydrophobicContact CB-CD1 3.93Å; V131-F375 HydrophobicContact CB-CE1 4.16Å; V131-F375 HydrophobicContact CG2-CD1 4.4Å; V131-F375 HydrophobicContact CG2-CE1 4.13Å; V131-F375 WeakPolarHBondContact O-CA 3.49Å; V131-P376 WeakPolarHBondContact O-CD 3.32Å
132	G	92.9	Very high	82.7	Confident	4 Å²	4	57 Å²	57	4%	0.041	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	123.1	175.7	0	0	0	0	0	110.2	N159 R160 P376	G132-N159 PolarHBondContact O-N 2.83Å; G132-N159 VanDerWaalsContact O-N 3.16Å; G132-R160 PolarHBondContact N-O 2.95Å; G132-P376 WeakPolarHBondContact CA-O 3.27Å
133	I	92.9	Very high	82	Confident	39 Å²	39	59 Å²	59	20%	0.2	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	126	-177.3	-62	166.8	0	0	0	106.8	V131 I156 E157 P376 I377 H378	V131-I133 HydrophobicContact CG1-CG1 4.37Å; I133-I156 HydrophobicContact CG2-CG2 3.32Å; I133-E157 WeakPolarHBondContact CA-O 3.46Å; I133-P376 PolarHBondContact N-O 3.08Å; I133-I377 HydrophobicContact CB-CG1 4.22Å; I133-I377 HydrophobicContact CB-CG2 4.49Å; I133-I377 HydrophobicContact CD1-CG1 4.09Å; I133-I377 HydrophobicContact CG2-CG2 4.33Å; I133-I377 CarbonylContact O-C 3.53Å; I133-I377 WeakPolarHBondContact O-CA 3.49Å; I133-H378 PolarHBondContact O-N 2.89Å
134	D	90.6	Very high	81.3	Confident	27 Å²	27	64.4 Å²	64.4	14%	0.144	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	122.4	168	-147.5	-33.7	0	0	0	108.5	T136 E157 N159 H378	D134-T136 WeakPolarHBondContact OD1-CB 3.32Å; D134-T136 PolarHBondContact OD1-N 2.94Å; D134-T136 PolarHBondContact OD1-OG1 3.43Å; D134-E157 HydrophobicContact CB-CG 3.56Å; D134-E157 PolarHBondContact N-O 3.24Å; D134-E157 PolarHBondContact O-N 3.39Å; D134-E157 VanDerWaalsContact O-N 3.09Å; D134-N159 HydrophobicContact CB-CB 4.3Å; D134-H378 IonicContact OD1-ND1 3.2Å
135	A	90.1	Very high	80	Confident	3 Å²	3	68.3 Å²	68.3	3%	0.025	33%	0.331	C	S	.	.			trans	-128.9	27.5	178.8	0	0	0	0	0	110.4	D137 L138 I377 H378 L379	A135-D137 VanDerWaalsContact C-N 3.26Å; A135-D137 PolarHBondContact O-N 3Å; A135-L138 HydrophobicContact CB-CD1 3.85Å; A135-L138 HydrophobicContact CB-CG 4.39Å; A135-L138 WeakPolarHBondContact O-CB 3.39Å; A135-L138 PolarHBondContact O-N 2.78Å; A135-L138 VanDerWaalsContact O-N 3.16Å; A135-I377 HydrophobicContact CB-CG2 4.02Å; A135-H378 CarbonylContact C-O 3.26Å; A135-H378 WeakPolarHBondContact CA-O 3.49Å; A135-H378 WeakPolarHBondContact CB-O 3.3Å; A135-H378 PolarHBondContact N-O 3.23Å; A135-L379 HydrophobicContact CB-CD2 4.35Å
136	T	87.6	Confident	78.6	Confident	9 Å²	9	75.9 Å²	75.9	6%	0.055	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-61.7	-33.6	-177.5	-54.8	0	0	0	0	112.1	D134 L138 F139 D140 H378 L379	D134-T136 WeakPolarHBondContact OD1-CB 3.32Å; D134-T136 PolarHBondContact OD1-N 2.94Å; D134-T136 PolarHBondContact OD1-OG1 3.43Å; T136-L138 PolarHBondContact O-N 3.47Å; T136-F139 PolarHBondContact O-N 3.45Å; T136-D140 HydrophobicContact CG2-CB 3.84Å; T136-D140 WeakPolarHBondContact CG2-OD2 3.34Å; T136-D140 PolarHBondContact O-N 3.49Å; T136-H378 PolarHBondContact OG1-ND1 2.82Å; T136-L379 WeakPolarHBondContact CA-O 3.45Å
137	D	84.4	Confident	76.8	Confident	32 Å²	32	79.9 Å²	79.9	17%	0.171	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-62.2	-14.8	176.5	-58.9	-48	0	0	0	114.8	A135 F139 P154 H155	A135-D137 VanDerWaalsContact C-N 3.26Å; A135-D137 PolarHBondContact O-N 3Å; D137-F139 VanDerWaalsContact C-N 3.28Å; D137-P154 HydrophobicContact CB-CB 4.4Å; D137-H155 IonicContact OD1-CE1 3.55Å; D137-H155 IonicContact OD1-NE2 3.28Å; D137-H155 IonicContact OD2-CD2 2.92Å; D137-H155 PolarHBondContact OD2-CD2 3.26Å; D137-H155 IonicContact OD2-CE1 3.64Å; D137-H155 PolarHBondContact OD2-CE1 3.1Å; D137-H155 IonicContact OD2-CG 2.83Å; D137-H155 VanDerWaalsContact OD2-CG 3.22Å; D137-H155 IonicContact OD2-ND1 2.86Å; D137-H155 PolarHBondContact OD2-ND1 3.49Å; D137-H155 VanDerWaalsContact OD2-ND1 3.14Å; D137-H155 IonicContact OD2-NE2 3.45Å; D137-H155 PolarHBondContact OD2-NE2 3.42Å; D137-H155 VanDerWaalsContact OD2-O 3.11Å
138	L	83.3	Confident	74.8	Confident	82 Å²	82	86.4 Å²	86.4	43%	0.429	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-71.2	-25.6	173.1	-66.6	176.2	0	0	0	112.4	A135 T136 P154	A135-L138 HydrophobicContact CB-CD1 3.85Å; A135-L138 HydrophobicContact CB-CG 4.39Å; A135-L138 WeakPolarHBondContact O-CB 3.39Å; A135-L138 PolarHBondContact O-N 2.78Å; A135-L138 VanDerWaalsContact O-N 3.16Å; T136-L138 PolarHBondContact O-N 3.47Å; L138-P154 HydrophobicContact CD2-CB 3.63Å; L138-P154 HydrophobicContact CD2-CG 3.5Å; L138-P154 VanDerWaalsContact CD2-CG 3.5Å; L138-P154 HydrophobicContact CG-CB 4.45Å
139	F	81.2	Confident	72.6	Confident	49 Å²	49	92.6 Å²	92.6	22%	0.215	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.8	-38.9	-170	-64.6	-78	0	0	0	113.3	T136 D137 L379 L384 A387 Y390	T136-F139 PolarHBondContact O-N 3.45Å; D137-F139 VanDerWaalsContact C-N 3.28Å; F139-L379 HydrophobicContact CD2-CB 4.06Å; F139-L379 VanDerWaalsContact CD2-O 3.29Å; F139-L379 WeakPolarHBondContact CD2-O 3.41Å; F139-L379 HydrophobicContact CE2-CB 4.09Å; F139-L379 HydrophobicContact CE2-CD2 3.91Å; F139-L379 HydrophobicContact CE2-CG 4.44Å; F139-L384 HydrophobicContact CB-CD1 4.19Å; F139-A387 HydrophobicContact CD1-CB 4.04Å; F139-A387 HydrophobicContact CD2-CB 4.47Å; F139-A387 HydrophobicContact CE1-CB 4.17Å; F139-A387 HydrophobicContact CG-CB 4.2Å; F139-A387 HydrophobicContact CZ-CB 4.44Å; F139-Y390 AromaticContact CE1-CD2 3.74Å; F139-Y390 HydrophobicContact CE1-CD2 3.74Å; F139-Y390 HydrophobicContact CE1-CE2 4.4Å; F139-Y390 HydrophobicContact CZ-CD2 4.02Å; F139-Y390 HydrophobicContact CZ-CG 4.42Å
140	D	70.3	Confident	70.2	Confident	34 Å²	34	98 Å²	98	18%	0.182	47%	0.468	C	S	.	.			trans	-101.4	87.9	176.4	-68.1	-37.2	0	0	0	108.5	T136 Y142 T380	T136-D140 HydrophobicContact CG2-CB 3.84Å; T136-D140 WeakPolarHBondContact CG2-OD2 3.34Å; T136-D140 PolarHBondContact O-N 3.49Å; D140-Y142 PolarHBondContact O-N 3.47Å; D140-T380 PolarHBondContact OD1-OG1 2.96Å; D140-T380 WeakPolarHBondContact OD2-CB 3.34Å; D140-T380 PolarHBondContact OD2-OG1 3.39Å
141	R	60.8	Low	68.3	Low	215 Å²	215	100.6 Å²	100.6	81%	0.811	50%	0.497	S	S	*	.			trans	-75.8	105.9	165.1	-73.9	-176	174.6	-179	-2.8	107	E143	R141-E143 PolarHBondContact O-N 2.82Å
142	Y	57.1	Low	66.7	Low	160 Å²	160	103.7 Å²	103.7	63%	0.627	52%	0.519	S	S	*	.			trans	-50.6	116.7	173.7	-67.8	-82.6	0	0	0	109.2	D140 E144	D140-Y142 PolarHBondContact O-N 3.47Å; Y142-E144 PolarHBondContact O-N 3.13Å
143	E	51.5	Low	65.5	Low	183 Å²	183	109.1 Å²	109.1	86%	0.855	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	1	-180	-78.6	-175.1	151.9	0	0	113.3	R141	R141-E143 PolarHBondContact O-N 2.82Å
144	E	48.8	Very low	64.5	Low	177 Å²	177	110 Å²	110	83%	0.827	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	-9	-174.7	-74.1	-172.2	166.3	0	0	115.4	Y142 Y146	Y142-E144 PolarHBondContact O-N 3.13Å; E144-Y146 PolarHBondContact O-N 3.21Å
145	D	48.8	Very low	63.9	Low	147 Å²	147	114 Å²	114	79%	0.786	58%	0.578	S	S	*	*			trans	-83.2	65.6	171.2	-71.3	-19.9	0	0	0	110.5	E147	D145-E147 PolarHBondContact O-N 3.39Å
146	Y	52.2	Low	63.6	Low	206 Å²	206	119 Å²	119	81%	0.808	60%	0.603	S	S	*	*			trans	-69.2	123.1	157.2	-88.1	-96.2	0	0	0	107.9	E144	E144-Y146 PolarHBondContact O-N 3.21Å
147	E	51.1	Low	63.6	Low	177 Å²	177	123 Å²	123	83%	0.827	62%	0.621	S	S	*	*	S	Bend	trans	75.6	66	173.1	-53.8	-177.8	166.4	0	0	116	D145	D145-E147 PolarHBondContact O-N 3.39Å
148	D	48	Very low	63.8	Low	155 Å²	155	126.9 Å²	126.9	83%	0.829	64%	0.64	S	S	*	*	S	Bend		-179.2	138.2	121.9	-91.3	-30.5	0	0	0	113.7
149	M	48.4	Very low	63.9	Low	163 Å²	163	124.9 Å²	124.9	80%	0.803	63%	0.63	S	S	*	*			trans	74.4	90.8	171.9	-67.7	-154.5	-172.1	0	0	119.9	G151	M149-G151 PolarHBondContact O-N 3.06Å
150	V	44.6	Very low	64.4	Low	161 Å²	161	128.1 Å²	128.1	98%	0.976	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.9	103.7	143.1	178.3	0	0	0	0	108.9
151	G	55	Low	65.4	Low	66 Å²	66	130.1 Å²	130.1	68%	0.68	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	129.1	5.5	170.8	0	0	0	0	0	117.7	M149 V153	M149-G151 PolarHBondContact O-N 3.06Å; G151-V153 PolarHBondContact O-N 3.32Å
152	S	61	Low	67	Low	88 Å²	88	123.1 Å²	123.1	62%	0.615	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-59	118.4	173.2	174	0	0	0	0	111.2
153	V	68.5	Low	68.7	Low	119 Å²	119	118.3 Å²	118.3	72%	0.721	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-73.7	130.4	172.7	-178.8	0	0	0	0	107	G151 H155	G151-V153 PolarHBondContact O-N 3.32Å; V153-H155 PolarHBondContact O-N 3.12Å
154	P	71.4	Confident	70.7	Confident	57 Å²	57	111.3 Å²	111.3	37%	0.37	58%	0.582	S	S	.	*	P	Polyproline II helix	trans	-54.1	132.5	179.4	22.1	-33.3	0	0	0	110.4	D137 L138	D137-P154 HydrophobicContact CB-CB 4.4Å; L138-P154 HydrophobicContact CD2-CB 3.63Å; L138-P154 HydrophobicContact CD2-CG 3.5Å; L138-P154 VanDerWaalsContact CD2-CG 3.5Å; L138-P154 HydrophobicContact CG-CB 4.45Å
155	H	77.9	Confident	72.8	Confident	111 Å²	111	108.1 Å²	108.1	51%	0.514	57%	0.567	S	S	.	*	P	Polyproline II helix	trans	-87.7	137.8	179.8	54.1	-71.7	0	0	0	109.2	D137 V153	D137-H155 IonicContact OD1-CE1 3.55Å; D137-H155 IonicContact OD1-NE2 3.28Å; D137-H155 IonicContact OD2-CD2 2.92Å; D137-H155 PolarHBondContact OD2-CD2 3.26Å; D137-H155 IonicContact OD2-CE1 3.64Å; D137-H155 PolarHBondContact OD2-CE1 3.1Å; D137-H155 IonicContact OD2-CG 2.83Å; D137-H155 VanDerWaalsContact OD2-CG 3.22Å; D137-H155 IonicContact OD2-ND1 2.86Å; D137-H155 PolarHBondContact OD2-ND1 3.49Å; D137-H155 VanDerWaalsContact OD2-ND1 3.14Å; D137-H155 IonicContact OD2-NE2 3.45Å; D137-H155 PolarHBondContact OD2-NE2 3.42Å; D137-H155 VanDerWaalsContact OD2-O 3.11Å; V153-H155 PolarHBondContact O-N 3.12Å
156	I	84.4	Confident	74.9	Confident	108 Å²	108	102.5 Å²	102.5	55%	0.554	54%	0.539	S	S	*	.			trans	-115.2	117.8	175.5	-64	175.1	0	0	0	105.5	I133	I133-I156 HydrophobicContact CG2-CG2 3.32Å
157	E	87	Confident	76.7	Confident	92 Å²	92	95.4 Å²	95.4	43%	0.43	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	153	-176.7	63.6	167.3	-156.1	0	0	112.5	I133 D134	I133-E157 WeakPolarHBondContact CA-O 3.46Å; D134-E157 HydrophobicContact CB-CG 3.56Å; D134-E157 PolarHBondContact N-O 3.24Å; D134-E157 PolarHBondContact O-N 3.39Å; D134-E157 VanDerWaalsContact O-N 3.09Å
158	I	88.8	Confident	78.6	Confident	115 Å²	115	89 Å²	89	59%	0.59	49%	0.485	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.9	96.6	173.4	-58.3	176.3	0	0	0	107.5	V131	V131-I158 HydrophobicContact CG1-CD1 4.3Å; V131-I158 HydrophobicContact CG1-CG1 4.42Å; V131-I158 HydrophobicContact CG1-CG2 3.73Å
159	N	85.8	Confident	80.6	Confident	40 Å²	40	83.1 Å²	83.1	21%	0.214	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	-34.4	-177.3	179.5	-35.2	0	0	0	112.1	G132 D134 H186 N187	G132-N159 PolarHBondContact O-N 2.83Å; G132-N159 VanDerWaalsContact O-N 3.16Å; D134-N159 HydrophobicContact CB-CB 4.3Å; N159-H186 PolarHBondContact O-ND1 2.65Å; N159-H186 PolarHBondContact OD1-CE1 3.07Å; N159-H186 PolarHBondContact OD1-ND1 3.32Å; N159-N187 PolarHBondContact O-N 3.45Å; N159-N187 VanDerWaalsContact O-N 3.08Å; N159-N187 PolarHBondContact O-OD1 3.03Å; N159-N187 PolarHBondContact OD1-OD1 3.14Å
160	R	91	Very high	82.5	Confident	117 Å²	117	79 Å²	79	44%	0.442	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	147.2	179.7	63.7	179.4	-175.6	148.5	-0.1	114.4	G132 T185 H186	G132-R160 PolarHBondContact N-O 2.95Å; R160-T185 CarbonylContact C-O 3.54Å; R160-T185 WeakPolarHBondContact CA-O 3.35Å; R160-T185 WeakPolarHBondContact CB-O 3.43Å; R160-H186 HydrophobicContact CB-CB 4.37Å
161	M	91.8	Very high	84.5	Confident	76 Å²	76	76.8 Å²	76.8	37%	0.374	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	134	169	-165.7	-178.2	-172.1	0	0	109.6	I129 S130 V131 I163 S184 T185	I129-M161 HydrophobicContact CG2-CE 4.4Å; S130-M161 CarbonylContact O-C 3.5Å; S130-M161 WeakPolarHBondContact O-CA 3.47Å; V131-M161 HydrophobicContact CG2-CE 4.47Å; V131-M161 HydrophobicContact CG2-CG 4.37Å; M161-I163 HydrophobicContact CE-CD1 3.72Å; M161-I163 HydrophobicContact CE-CG1 4.05Å; M161-I163 HydrophobicContact SD-CD1 4.32Å; M161-S184 CarbonylContact O-C 3.57Å; M161-S184 WeakPolarHBondContact O-CA 3.31Å; M161-T185 WeakPolarHBondContact CB-OG1 3.4Å; M161-T185 PolarHBondContact N-O 2.87Å; M161-T185 PolarHBondContact N-OG1 2.99Å; M161-T185 PolarHBondContact O-N 3.13Å
162	H	92.9	Very high	86.1	Confident	68 Å²	68	77.3 Å²	77.3	32%	0.315	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	116.1	176.3	172.3	-74.5	0	0	0	110.2	I129 S130 L183	I129-H162 CarbonylContact C-O 3.53Å; S130-H162 PolarHBondContact N-O 3.01Å; S130-H162 PolarHBondContact O-N 3.12Å; H162-L183 CarbonylContact C-O 3.52Å; H162-L183 VanDerWaalsContact CA-O 3.31Å; H162-L183 WeakPolarHBondContact CA-O 3.5Å
163	I	93.6	Very high	87.3	Confident	59 Å²	59	80.2 Å²	80.2	30%	0.303	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	125.4	175.1	-60.9	163.5	0	0	0	107.4	S128 I129 M161 S182 L183	S128-I163 CarbonylContact O-C 3.28Å; S128-I163 WeakPolarHBondContact O-CA 3.46Å; I129-I163 HydrophobicContact CG1-CG1 4.45Å; I129-I163 HydrophobicContact CG1-CG2 4.46Å; I129-I163 HydrophobicContact CG2-CG1 4.37Å; M161-I163 HydrophobicContact CE-CD1 3.72Å; M161-I163 HydrophobicContact CE-CG1 4.05Å; M161-I163 HydrophobicContact SD-CD1 4.32Å; I163-S182 CarbonylContact O-C 3.59Å; I163-S182 VanDerWaalsContact O-CA 3.28Å; I163-S182 WeakPolarHBondContact O-CA 3.46Å; I163-L183 PolarHBondContact N-O 2.64Å; I163-L183 PolarHBondContact O-N 2.79Å
164	S	93.7	Very high	88.3	Confident	36 Å²	36	80.8 Å²	80.8	25%	0.252	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	131.9	169.2	60.4	0	0	0	0	110.3	G127 S128 G181	G127-S164 CarbonylContact C-O 3.59Å; G127-S164 WeakPolarHBondContact CA-O 3.44Å; S128-S164 WeakPolarHBondContact CB-OG 3.48Å; S128-S164 PolarHBondContact N-O 3.26Å; S128-S164 PolarHBondContact O-N 3.02Å; S164-G181 CarbonylContact C-O 3.45Å; S164-G181 VanDerWaalsContact CA-O 3.32Å; S164-G181 WeakPolarHBondContact CA-O 3.39Å
165	Q	93.2	Very high	89.3	Confident	110 Å²	110	79.7 Å²	79.7	51%	0.514	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	137.1	178.1	-173.3	172.8	-0.3	0	0	109.4	K126 S180 G181	K126-Q165 CarbonylContact O-C 3.55Å; K126-Q165 WeakPolarHBondContact O-CA 3.48Å; Q165-S180 CarbonylContact O-C 3.59Å; Q165-S180 VanDerWaalsContact O-CA 3.25Å; Q165-S180 WeakPolarHBondContact O-CA 3.49Å; Q165-G181 PolarHBondContact N-O 2.95Å; Q165-G181 PolarHBondContact O-N 2.96Å
166	S	92.4	Very high	90	Very high	28 Å²	28	75.3 Å²	75.3	20%	0.196	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	136.9	174	65	0	0	0	0	110.5	P125 K126 L179	P125-S166 CarbonylContact C-O 3.55Å; P125-S166 WeakPolarHBondContact CA-O 3.29Å; K126-S166 PolarHBondContact N-O 3.06Å; K126-S166 PolarHBondContact O-N 3.32Å; S166-L179 CarbonylContact C-O 3.57Å; S166-L179 WeakPolarHBondContact CA-O 3.27Å
167	I	91.1	Very high	90.4	Very high	57 Å²	57	71 Å²	71	29%	0.292	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	120.8	175.9	-59.1	172.2	0	0	0	107.4	T123 P125 I178 L179	T123-I167 HydrophobicContact CG2-CG2 3.83Å; P125-I167 HydrophobicContact CB-CG1 4.44Å; I167-I178 WeakPolarHBondContact O-CA 3.2Å; I167-L179 PolarHBondContact N-O 3.05Å; I167-L179 PolarHBondContact O-N 3.04Å
168	E	89.9	Confident	90.7	Very high	42 Å²	42	67.7 Å²	67.7	20%	0.196	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	120.4	170.7	-60	-178.5	-136.9	0	0	108.4	N124 K126 I178 R199	N124-E168 PolarHBondContact N-O 2.91Å; K126-E168 IonicContact NZ-OE1 2.78Å; K126-E168 PolarHBondContact NZ-OE1 3.07Å; E168-I178 HydrophobicContact CG-CD1 4.34Å; E168-I178 HydrophobicContact CG-CG1 4.11Å; E168-I178 HydrophobicContact CG-CG2 4.17Å; E168-R199 IonicContact OE2-NH1 3.56Å; E168-R199 IonicContact OE2-NH2 3.57Å
169	A	89.3	Confident	91	Very high	33 Å²	33	66.6 Å²	66.6	27%	0.273	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	111.4	179.2	0	0	0	0	0	110.1	L171 T176 A177	A169-L171 PolarHBondContact O-N 3.47Å; A169-T176 WeakPolarHBondContact O-CG2 3.16Å; A169-A177 PolarHBondContact N-O 2.92Å; A169-A177 PolarHBondContact O-N 3.31Å
170	P	88.7	Confident	91.3	Very high	77 Å²	77	66.3 Å²	66.3	50%	0.5	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	115.5	174.2	29.3	-29.1	0	0	0	109.3	R122	R122-P170 WeakPolarHBondContact O-CD 3.44Å
171	L	88.1	Confident	91.4	Very high	114 Å²	114	62.1 Å²	62.1	60%	0.597	35%	0.349	S	S	*	.			trans	-82.5	-42.3	177.5	-64	178	0	0	0	110.7	A169 D175 A177 L198	A169-L171 PolarHBondContact O-N 3.47Å; L171-D175 PolarHBondContact N-O 2.94Å; L171-A177 HydrophobicContact CD1-CB 3.84Å; L171-A177 HydrophobicContact CD2-CB 4.4Å; L171-A177 HydrophobicContact CG-CB 3.98Å; L171-L198 HydrophobicContact CD1-CD2 4.48Å
172	T	88.4	Confident	91.4	Very high	77 Å²	77	60.1 Å²	60.1	47%	0.472	34%	0.343	S	S	.	.	S	Bend	trans	-138.7	-179.9	176.4	70.7	0	0	0	0	110.2	K174 D175	T172-K174 PolarHBondContact O-N 3.37Å; T172-K174 PolarHBondContact OG1-N 3.32Å; T172-D175 PolarHBondContact N-O 3.36Å; T172-D175 VanDerWaalsContact N-O 3.08Å; T172-D175 VanDerWaalsContact OG1-CB 3.31Å; T172-D175 WeakPolarHBondContact OG1-CB 3.41Å; T172-D175 PolarHBondContact OG1-N 2.63Å
173	T	85.5	Confident	91.4	Very high	148 Å²	148	61.1 Å²	61.1	91%	0.908	35%	0.35	S	S	*	.	S	Bend	trans	-63.6	-19.3	175	53.6	0	0	0	0	113.5
174	K	89.9	Confident	91.3	Very high	132 Å²	132	60.8 Å²	60.8	57%	0.574	35%	0.353	S	S	*	.	S	Bend	trans	-113.7	-25.5	179.6	-65.4	-175.8	-179.2	178.8	0	113.7	T172 V201	T172-K174 PolarHBondContact O-N 3.37Å; T172-K174 PolarHBondContact OG1-N 3.32Å; K174-V201 PolarHBondContact O-N 3.27Å
175	D	93	Very high	91.1	Very high	34 Å²	34	61.8 Å²	61.8	18%	0.182	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	127.4	-173.2	-60.7	-25.2	0	0	0	111.1	L171 T172 R199 R200	L171-D175 PolarHBondContact N-O 2.94Å; T172-D175 PolarHBondContact N-O 3.36Å; T172-D175 VanDerWaalsContact N-O 3.08Å; T172-D175 VanDerWaalsContact OG1-CB 3.31Å; T172-D175 WeakPolarHBondContact OG1-CB 3.41Å; T172-D175 PolarHBondContact OG1-N 2.63Å; D175-R199 CarbonylContact C-O 3.54Å; D175-R199 WeakPolarHBondContact CA-O 3.18Å; D175-R200 WeakPolarHBondContact OD1-CB 3.3Å; D175-R200 VanDerWaalsContact OD1-CG 3.28Å; D175-R200 WeakPolarHBondContact OD1-CG 3.43Å; D175-R200 IonicContact OD1-CZ 3.61Å; D175-R200 IonicContact OD1-NE 2.96Å; D175-R200 PolarHBondContact OD1-NE 3.08Å; D175-R200 IonicContact OD1-NH2 3.21Å; D175-R200 IonicContact OD2-CZ 3.64Å; D175-R200 IonicContact OD2-NE 3.48Å; D175-R200 IonicContact OD2-NH2 3.01Å; D175-R200 PolarHBondContact OD2-NH2 3.44Å
176	T	92.3	Very high	90.9	Very high	18 Å²	18	61.3 Å²	61.3	11%	0.11	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	129.7	172.9	-41.8	0	0	0	0	109.6	A169 I178 R199	A169-T176 WeakPolarHBondContact O-CG2 3.16Å; T176-I178 HydrophobicContact CG2-CG1 4.43Å; T176-R199 PolarHBondContact N-O 3.26Å; T176-R199 PolarHBondContact O-N 2.86Å; T176-R199 PolarHBondContact OG1-NH2 2.92Å; T176-R199 VanDerWaalsContact OG1-NH2 3.14Å
177	A	92.9	Very high	90.4	Very high	17 Å²	17	65 Å²	65	14%	0.14	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	136.3	165.9	0	0	0	0	0	109.8	A169 L171 A197 L198	A169-A177 PolarHBondContact N-O 2.92Å; A169-A177 PolarHBondContact O-N 3.31Å; L171-A177 HydrophobicContact CD1-CB 3.84Å; L171-A177 HydrophobicContact CD2-CB 4.4Å; L171-A177 HydrophobicContact CG-CB 3.98Å; A177-A197 CarbonylContact C-O 3.53Å; A177-A197 WeakPolarHBondContact CA-O 3.27Å; A177-L198 HydrophobicContact CB-CD2 3.99Å
178	I	93.2	Very high	89.8	Confident	23 Å²	23	66 Å²	66	12%	0.118	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	118.7	176.6	-52	179	0	0	0	106.9	I167 E168 T176 L196 A197	I167-I178 WeakPolarHBondContact O-CA 3.2Å; E168-I178 HydrophobicContact CG-CD1 4.34Å; E168-I178 HydrophobicContact CG-CG1 4.11Å; E168-I178 HydrophobicContact CG-CG2 4.17Å; T176-I178 HydrophobicContact CG2-CG1 4.43Å; I178-L196 CarbonylContact O-C 3.54Å; I178-L196 WeakPolarHBondContact O-CA 3.08Å; I178-A197 HydrophobicContact CB-CB 4.22Å; I178-A197 PolarHBondContact N-O 3.41Å; I178-A197 PolarHBondContact O-N 3.26Å
179	L	93.7	Very high	89.5	Confident	93 Å²	93	70.4 Å²	70.4	49%	0.487	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	124.5	171.6	-178.1	65	0	0	0	107.8	S166 I167 I194 L196	S166-L179 CarbonylContact C-O 3.57Å; S166-L179 WeakPolarHBondContact CA-O 3.27Å; I167-L179 PolarHBondContact N-O 3.05Å; I167-L179 PolarHBondContact O-N 3.04Å; L179-I194 HydrophobicContact CD1-CG2 4.12Å; L179-L196 HydrophobicContact CD1-CD1 4.41Å
180	S	93.1	Very high	89.3	Confident	34 Å²	34	71 Å²	71	24%	0.238	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	144.9	176.5	61.8	0	0	0	0	111	Q165 I194 N195	Q165-S180 CarbonylContact O-C 3.59Å; Q165-S180 VanDerWaalsContact O-CA 3.25Å; Q165-S180 WeakPolarHBondContact O-CA 3.49Å; S180-I194 CarbonylContact O-C 3.54Å; S180-I194 WeakPolarHBondContact O-CA 3.43Å; S180-N195 PolarHBondContact N-O 3.45Å; S180-N195 PolarHBondContact O-N 3.36Å; S180-N195 PolarHBondContact OG-O 2.91Å
181	G	92.7	Very high	89.3	Confident	28 Å²	28	67.6 Å²	67.6	29%	0.289	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	138.8	173.8	0	0	0	0	0	109.5	S164 Q165 T193	S164-G181 CarbonylContact C-O 3.45Å; S164-G181 VanDerWaalsContact CA-O 3.32Å; S164-G181 WeakPolarHBondContact CA-O 3.39Å; Q165-G181 PolarHBondContact N-O 2.95Å; Q165-G181 PolarHBondContact O-N 2.96Å; G181-T193 CarbonylContact C-O 3.57Å; G181-T193 VanDerWaalsContact CA-O 3.26Å; G181-T193 WeakPolarHBondContact CA-O 3.48Å
182	S	92.9	Very high	89.4	Confident	35 Å²	35	63.4 Å²	63.4	25%	0.245	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	139.3	167.3	64.2	0	0	0	0	110	I163 G192 T193	I163-S182 CarbonylContact O-C 3.59Å; I163-S182 VanDerWaalsContact O-CA 3.28Å; I163-S182 WeakPolarHBondContact O-CA 3.46Å; S182-G192 CarbonylContact O-C 3.5Å; S182-G192 VanDerWaalsContact O-CA 3.27Å; S182-G192 WeakPolarHBondContact O-CA 3.39Å; S182-T193 PolarHBondContact N-O 3.03Å; S182-T193 PolarHBondContact O-N 2.94Å; S182-T193 PolarHBondContact OG-OG1 3.22Å
183	L	91.9	Very high	89.5	Confident	89 Å²	89	60.9 Å²	60.9	47%	0.466	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	126.5	173.5	-180	68.6	0	0	0	106.8	H162 I163	H162-L183 CarbonylContact C-O 3.52Å; H162-L183 VanDerWaalsContact CA-O 3.31Å; H162-L183 WeakPolarHBondContact CA-O 3.5Å; I163-L183 PolarHBondContact N-O 2.64Å; I163-L183 PolarHBondContact O-N 2.79Å
184	S	91.1	Very high	89.8	Confident	51 Å²	51	59.1 Å²	59.1	36%	0.357	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	130.5	176	59.6	0	0	0	0	109.8	M161 G190 G191	M161-S184 CarbonylContact O-C 3.57Å; M161-S184 WeakPolarHBondContact O-CA 3.31Å; S184-G190 CarbonylContact O-C 3.56Å; S184-G190 WeakPolarHBondContact O-CA 3.44Å; S184-G191 PolarHBondContact N-O 2.93Å; S184-G191 PolarHBondContact O-N 2.86Å; S184-G191 PolarHBondContact OG-O 2.91Å
185	T	90.4	Very high	90	Very high	57 Å²	57	55.2 Å²	55.2	35%	0.35	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	138.2	169.4	61.6	0	0	0	0	108.8	R160 M161 N189	R160-T185 CarbonylContact C-O 3.54Å; R160-T185 WeakPolarHBondContact CA-O 3.35Å; R160-T185 WeakPolarHBondContact CB-O 3.43Å; M161-T185 WeakPolarHBondContact CB-OG1 3.4Å; M161-T185 PolarHBondContact N-O 2.87Å; M161-T185 PolarHBondContact N-OG1 2.99Å; M161-T185 PolarHBondContact O-N 3.13Å; T185-N189 WeakPolarHBondContact CA-O 3.38Å
186	H	87.9	Confident	90	Very high	101 Å²	101	57.3 Å²	57.3	47%	0.468	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	122.9	175.5	-179.3	49.1	0	0	0	108.5	N159 R160 G188 N189	N159-H186 PolarHBondContact O-ND1 2.65Å; N159-H186 PolarHBondContact OD1-CE1 3.07Å; N159-H186 PolarHBondContact OD1-ND1 3.32Å; R160-H186 HydrophobicContact CB-CB 4.37Å; H186-G188 VanDerWaalsContact C-N 3.3Å; H186-G188 PolarHBondContact O-N 3.42Å; H186-N189 PolarHBondContact N-O 3.28Å; H186-N189 PolarHBondContact O-N 3.31Å
187	N	82.5	Confident	90.1	Very high	105 Å²	105	56.8 Å²	56.8	56%	0.561	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	47	50.1	178.9	-65.9	-8.8	0	0	0	113.5	N159 N189	N159-N187 PolarHBondContact O-N 3.45Å; N159-N187 VanDerWaalsContact O-N 3.08Å; N159-N187 PolarHBondContact O-OD1 3.03Å; N159-N187 PolarHBondContact OD1-OD1 3.14Å; N187-N189 PolarHBondContact O-N 2.67Å; N187-N189 VanDerWaalsContact O-N 3.17Å
188	G	77.9	Confident	90.2	Very high	79 Å²	79	60.3 Å²	60.3	81%	0.814	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.9	-15.9	178.7	0	0	0	0	0	115.6	H186	H186-G188 VanDerWaalsContact C-N 3.3Å; H186-G188 PolarHBondContact O-N 3.42Å
189	N	85.1	Confident	90.3	Very high	133 Å²	133	62.1 Å²	62.1	71%	0.711	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.8	119.4	175.3	-75.8	10.7	0	0	0	110.6	T185 H186 N187	T185-N189 WeakPolarHBondContact CA-O 3.38Å; H186-N189 PolarHBondContact N-O 3.28Å; H186-N189 PolarHBondContact O-N 3.31Å; N187-N189 PolarHBondContact O-N 2.67Å; N187-N189 VanDerWaalsContact O-N 3.17Å
190	G	84.6	Confident	90.4	Very high	47 Å²	47	64.6 Å²	64.6	49%	0.485	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	147.7	177	0	0	0	0	0	112.4	S184	S184-G190 CarbonylContact O-C 3.56Å; S184-G190 WeakPolarHBondContact O-CA 3.44Å
191	G	88.6	Confident	90.4	Very high	5 Å²	5	65.9 Å²	65.9	5%	0.052	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	138.7	170.9	0	0	0	0	0	110.3	S184	S184-G191 PolarHBondContact N-O 2.93Å; S184-G191 PolarHBondContact O-N 2.86Å; S184-G191 PolarHBondContact OG-O 2.91Å
192	G	89.8	Confident	90.2	Very high	26 Å²	26	69.4 Å²	69.4	27%	0.268	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	146.8	176.6	0	0	0	0	0	111.3	S182 G215 D216	S182-G192 CarbonylContact O-C 3.5Å; S182-G192 VanDerWaalsContact O-CA 3.27Å; S182-G192 WeakPolarHBondContact O-CA 3.39Å; G192-G215 CarbonylContact O-C 3.58Å; G192-G215 WeakPolarHBondContact O-CA 3.28Å; G192-D216 PolarHBondContact O-N 3.35Å
193	T	90.9	Very high	90.1	Very high	24 Å²	24	70.7 Å²	70.7	15%	0.147	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	141.1	168.2	75.7	0	0	0	0	109.6	G181 S182 A214	G181-T193 CarbonylContact C-O 3.57Å; G181-T193 VanDerWaalsContact CA-O 3.26Å; G181-T193 WeakPolarHBondContact CA-O 3.48Å; S182-T193 PolarHBondContact N-O 3.03Å; S182-T193 PolarHBondContact O-N 2.94Å; S182-T193 PolarHBondContact OG-OG1 3.22Å; T193-A214 WeakPolarHBondContact CA-O 3.45Å
194	I	92.4	Very high	89.8	Confident	110 Å²	110	73.1 Å²	73.1	56%	0.564	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.8	126.8	172.8	-61	174.8	0	0	0	106.6	L179 S180 G213 A214	L179-I194 HydrophobicContact CD1-CG2 4.12Å; S180-I194 CarbonylContact O-C 3.54Å; S180-I194 WeakPolarHBondContact O-CA 3.43Å; I194-G213 CarbonylContact O-C 3.51Å; I194-G213 WeakPolarHBondContact O-CA 3.4Å; I194-A214 PolarHBondContact N-O 3.36Å; I194-A214 PolarHBondContact O-N 3.43Å
195	N	92.3	Very high	89.6	Confident	51 Å²	51	77 Å²	77	27%	0.273	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	128.9	177.2	-51.5	-56.5	0	0	0	110.1	S180 L212 G213	S180-N195 PolarHBondContact N-O 3.45Å; S180-N195 PolarHBondContact O-N 3.36Å; S180-N195 PolarHBondContact OG-O 2.91Å; N195-L212 CarbonylContact C-O 3.57Å; N195-L212 WeakPolarHBondContact CA-O 3.37Å; N195-G213 WeakPolarHBondContact OD1-CA 3.49Å
196	L	93.7	Very high	89.7	Confident	77 Å²	77	74.7 Å²	74.7	40%	0.403	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	124.8	169.1	178	68.4	0	0	0	108.3	I178 L179 L212	I178-L196 CarbonylContact O-C 3.54Å; I178-L196 WeakPolarHBondContact O-CA 3.08Å; L179-L196 HydrophobicContact CD1-CD1 4.41Å; L196-L212 PolarHBondContact N-O 2.92Å; L196-L212 PolarHBondContact O-N 2.97Å
197	A	94.4	Very high	90	Very high	8 Å²	8	72.8 Å²	72.8	7%	0.066	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	136.4	174.2	0	0	0	0	0	111.5	A177 I178 E209 V210 E211	A177-A197 CarbonylContact C-O 3.53Å; A177-A197 WeakPolarHBondContact CA-O 3.27Å; I178-A197 HydrophobicContact CB-CB 4.22Å; I178-A197 PolarHBondContact N-O 3.41Å; I178-A197 PolarHBondContact O-N 3.26Å; A197-E209 HydrophobicContact CB-CG 3.96Å; A197-E209 WeakPolarHBondContact CB-OE1 3.39Å; A197-V210 CarbonylContact C-O 3.48Å; A197-V210 WeakPolarHBondContact CA-O 3.42Å; A197-E211 HydrophobicContact CB-CG 3.89Å
198	L	95.6	Very high	90.7	Very high	91 Å²	91	68.8 Å²	68.8	48%	0.476	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	107.8	174.9	-69.3	174.3	0	0	0	108.7	L171 A177 E209 V210	L171-L198 HydrophobicContact CD1-CD2 4.48Å; A177-L198 HydrophobicContact CB-CD2 3.99Å; L198-E209 VanDerWaalsContact O-CA 3.31Å; L198-E209 WeakPolarHBondContact O-CA 3.4Å; L198-V210 PolarHBondContact N-O 3.47Å; L198-V210 PolarHBondContact O-N 3.04Å
199	R	95.1	Very high	91.5	Very high	60 Å²	60	65.7 Å²	65.7	23%	0.226	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	126.9	178.6	-177.7	177.5	65.5	-158.9	-2	110.1	E168 D175 T176 W207 G208 E209	E168-R199 IonicContact OE2-NH1 3.56Å; E168-R199 IonicContact OE2-NH2 3.57Å; D175-R199 CarbonylContact C-O 3.54Å; D175-R199 WeakPolarHBondContact CA-O 3.18Å; T176-R199 PolarHBondContact N-O 3.26Å; T176-R199 PolarHBondContact O-N 2.86Å; T176-R199 PolarHBondContact OG1-NH2 2.92Å; T176-R199 VanDerWaalsContact OG1-NH2 3.14Å; R199-W207 HydrophobicContact CG-CD2 4.39Å; R199-W207 HydrophobicContact CG-CE3 3.93Å; R199-W207 HydrophobicContact CG-CZ3 4.48Å; R199-G208 CarbonylContact C-O 3.5Å; R199-G208 WeakPolarHBondContact CA-O 3.39Å; R199-E209 HydrophobicContact CB-CB 4.24Å; R199-E209 HydrophobicContact CB-CG 4.25Å; R199-E209 HydrophobicContact CG-CB 4.39Å
200	R	94.9	Very high	92.1	Very high	146 Å²	146	62.3 Å²	62.3	55%	0.551	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120	123.4	174.2	174.5	166	-73.3	174	-0.9	110.8	D175 T202 W207 G208	D175-R200 WeakPolarHBondContact OD1-CB 3.3Å; D175-R200 VanDerWaalsContact OD1-CG 3.28Å; D175-R200 WeakPolarHBondContact OD1-CG 3.43Å; D175-R200 IonicContact OD1-CZ 3.61Å; D175-R200 IonicContact OD1-NE 2.96Å; D175-R200 PolarHBondContact OD1-NE 3.08Å; D175-R200 IonicContact OD1-NH2 3.21Å; D175-R200 IonicContact OD2-CZ 3.64Å; D175-R200 IonicContact OD2-NE 3.48Å; D175-R200 IonicContact OD2-NH2 3.01Å; D175-R200 PolarHBondContact OD2-NH2 3.44Å; R200-T202 HydrophobicContact CG-CG2 4.27Å; R200-T202 PolarHBondContact O-N 3.43Å; R200-W207 WeakPolarHBondContact O-CA 3.45Å; R200-W207 WeakPolarHBondContact O-CB 3.41Å; R200-G208 PolarHBondContact N-O 3.29Å; R200-G208 PolarHBondContact O-N 3.47Å
201	V	94.1	Very high	92.5	Very high	60 Å²	60	61.6 Å²	61.6	36%	0.364	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	106.7	170.3	-177	0	0	0	0	108.6	K174 W207	K174-V201 PolarHBondContact O-N 3.27Å; V201-W207 HydrophobicContact CG2-CB 4.35Å
202	T	88.6	Confident	92.7	Very high	102 Å²	102	65.5 Å²	65.5	63%	0.626	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.1	-31.3	-176.5	52.9	0	0	0	0	112.4	R200 G206	R200-T202 HydrophobicContact CG-CG2 4.27Å; R200-T202 PolarHBondContact O-N 3.43Å; T202-G206 PolarHBondContact N-O 3.33Å; T202-G206 PolarHBondContact OG1-O 2.98Å
203	S	89.9	Confident	92.7	Very high	63 Å²	63	64.7 Å²	64.7	44%	0.441	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	165.1	-178.2	-177.7	0	0	0	0	110.9	K205 G206	S203-K205 PolarHBondContact O-N 2.89Å; S203-K205 VanDerWaalsContact O-N 3.1Å; S203-K205 PolarHBondContact OG-N 3.47Å; S203-G206 PolarHBondContact N-O 3.39Å; S203-G206 VanDerWaalsContact N-O 3.13Å; S203-G206 PolarHBondContact O-N 3.41Å
204	T	85.3	Confident	92.5	Very high	139 Å²	139	66.4 Å²	66.4	85%	0.853	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-19.1	169.5	56.1	0	0	0	0	112.7
205	K	88.4	Confident	92.1	Very high	134 Å²	134	62 Å²	62	58%	0.583	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.2	0.6	-179.1	-62.6	-177.5	-178.9	178.4	0	114.2	S203 R228 N229	S203-K205 PolarHBondContact O-N 2.89Å; S203-K205 VanDerWaalsContact O-N 3.1Å; S203-K205 PolarHBondContact OG-N 3.47Å; K205-R228 WeakPolarHBondContact O-CA 3.45Å; K205-N229 HydrophobicContact CB-CB 4.4Å; K205-N229 PolarHBondContact O-N 3.1Å
206	G	91.8	Very high	91.2	Very high	8 Å²	8	66.4 Å²	66.4	8%	0.082	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.6	161.4	-174.4	0	0	0	0	0	115.8	T202 S203 F227	T202-G206 PolarHBondContact N-O 3.33Å; T202-G206 PolarHBondContact OG1-O 2.98Å; S203-G206 PolarHBondContact N-O 3.39Å; S203-G206 VanDerWaalsContact N-O 3.13Å; S203-G206 PolarHBondContact O-N 3.41Å; G206-F227 CarbonylContact C-O 3.53Å; G206-F227 WeakPolarHBondContact CA-O 3.39Å
207	W	95.4	Very high	89.9	Confident	60 Å²	60	66.6 Å²	66.6	23%	0.227	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	154.7	177.1	55.7	-97.8	0	0	0	110.2	R199 R200 V201 E209 K225 F227	R199-W207 HydrophobicContact CG-CD2 4.39Å; R199-W207 HydrophobicContact CG-CE3 3.93Å; R199-W207 HydrophobicContact CG-CZ3 4.48Å; R200-W207 WeakPolarHBondContact O-CA 3.45Å; R200-W207 WeakPolarHBondContact O-CB 3.41Å; V201-W207 HydrophobicContact CG2-CB 4.35Å; W207-E209 HydrophobicContact CE3-CB 4.08Å; W207-E209 HydrophobicContact CZ3-CB 3.69Å; W207-E209 VanDerWaalsContact CZ3-OE2 3.27Å; W207-E209 WeakPolarHBondContact CZ3-OE2 3.39Å; W207-K225 HydrophobicContact CH2-CD 3.97Å; W207-K225 HydrophobicContact CH2-CG 4.29Å; W207-K225 HydrophobicContact CZ3-CD 4.14Å; W207-K225 HydrophobicContact CZ3-CG 4.2Å; W207-F227 AromaticContact CD1-CD1 3.44Å; W207-F227 VanDerWaalsContact CD1-CD1 3.44Å; W207-F227 AromaticContact CD1-CG 3.92Å; W207-F227 HydrophobicContact CD2-CB 3.62Å; W207-F227 HydrophobicContact CD2-CG 4.34Å; W207-F227 AromaticContact CE2-CD1 3.98Å; W207-F227 AromaticContact CE2-CG 3.62Å; W207-F227 HydrophobicContact CE3-CB 4.18Å; W207-F227 HydrophobicContact CG-CB 4.05Å; W207-F227 HydrophobicContact CG-CD1 4.27Å; W207-F227 HydrophobicContact CH2-CB 4.14Å; W207-F227 HydrophobicContact CZ2-CB 3.55Å; W207-F227 HydrophobicContact CZ2-CD2 4.32Å; W207-F227 AromaticContact CZ2-CG 3.98Å; W207-F227 HydrophobicContact CZ2-CG 3.98Å; W207-F227 HydrophobicContact CZ3-CB 4.4Å; W207-F227 PolarHBondContact N-O 2.91Å; W207-F227 AromaticContact NE1-CD1 3.21Å; W207-F227 AromaticContact NE1-CE1 3.97Å; W207-F227 AromaticContact NE1-CG 3.31Å; W207-F227 VanDerWaalsContact NE1-CG 3.31Å; W207-F227 PolarHBondContact O-N 3Å
208	G	95.8	Very high	88.7	Confident	21 Å²	21	71.1 Å²	71.1	22%	0.216	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	150.7	173.4	0	0	0	0	0	110.3	R199 R200 K225	R199-G208 CarbonylContact C-O 3.5Å; R199-G208 WeakPolarHBondContact CA-O 3.39Å; R200-G208 PolarHBondContact N-O 3.29Å; R200-G208 PolarHBondContact O-N 3.47Å; G208-K225 CarbonylContact C-O 3.52Å; G208-K225 WeakPolarHBondContact CA-O 3.47Å
209	E	96	Very high	88	Confident	15 Å²	15	67.8 Å²	67.8	7%	0.07	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	132.8	-179.4	176.7	175.3	-163.7	0	0	108.9	A197 L198 R199 W207 E211 M224 K225	A197-E209 HydrophobicContact CB-CG 3.96Å; A197-E209 WeakPolarHBondContact CB-OE1 3.39Å; L198-E209 VanDerWaalsContact O-CA 3.31Å; L198-E209 WeakPolarHBondContact O-CA 3.4Å; R199-E209 HydrophobicContact CB-CB 4.24Å; R199-E209 HydrophobicContact CB-CG 4.25Å; R199-E209 HydrophobicContact CG-CB 4.39Å; W207-E209 HydrophobicContact CE3-CB 4.08Å; W207-E209 HydrophobicContact CZ3-CB 3.69Å; W207-E209 VanDerWaalsContact CZ3-OE2 3.27Å; W207-E209 WeakPolarHBondContact CZ3-OE2 3.39Å; E209-E211 HydrophobicContact CG-CG 4.22Å; E209-M224 CarbonylContact O-C 3.53Å; E209-M224 WeakPolarHBondContact O-CA 3.36Å; E209-K225 HydrophobicContact CB-CB 4.23Å; E209-K225 PolarHBondContact N-O 2.9Å; E209-K225 PolarHBondContact O-N 2.79Å; E209-K225 IonicContact OE2-NZ 2.98Å
210	V	95.9	Very high	87.7	Confident	61 Å²	61	68.6 Å²	68.6	37%	0.37	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	126.8	173.8	178.3	0	0	0	0	107.6	A197 L198 F222 G223	A197-V210 CarbonylContact C-O 3.48Å; A197-V210 WeakPolarHBondContact CA-O 3.42Å; L198-V210 PolarHBondContact N-O 3.47Å; L198-V210 PolarHBondContact O-N 3.04Å; V210-F222 HydrophobicContact CG1-CE2 4.08Å; V210-F222 HydrophobicContact CG1-CZ 4.27Å; V210-G223 CarbonylContact C-O 3.55Å; V210-G223 WeakPolarHBondContact CA-O 3.43Å
211	E	92.7	Very high	87.4	Confident	32 Å²	32	64 Å²	64	15%	0.15	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	130.4	-176	-63.6	172.4	177.7	0	0	109.3	A197 E209 G223 Q239	A197-E211 HydrophobicContact CB-CG 3.89Å; E209-E211 HydrophobicContact CG-CG 4.22Å; E211-G223 PolarHBondContact N-O 3.14Å; E211-G223 PolarHBondContact O-N 3.09Å; E211-Q239 PolarHBondContact OE2-NE2 2.92Å
212	L	93.4	Very high	87.3	Confident	88 Å²	88	65.7 Å²	65.7	46%	0.461	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	113.3	173.1	-64.9	176	0	0	0	107.7	N195 L196 L221 F222	N195-L212 CarbonylContact C-O 3.57Å; N195-L212 WeakPolarHBondContact CA-O 3.37Å; L196-L212 PolarHBondContact N-O 2.92Å; L196-L212 PolarHBondContact O-N 2.97Å; L212-L221 CarbonylContact C-O 3.51Å; L212-L221 WeakPolarHBondContact CA-O 3.41Å; L212-F222 HydrophobicContact CD2-CD2 3.46Å; L212-F222 VanDerWaalsContact CD2-CD2 3.46Å; L212-F222 HydrophobicContact CD2-CE2 3.99Å; L212-F222 HydrophobicContact CD2-CG 4.49Å
213	G	90.1	Very high	87.5	Confident	8 Å²	8	60.8 Å²	60.8	8%	0.082	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	148.3	179.5	0	0	0	0	0	111.7	I194 N195 P220 L221	I194-G213 CarbonylContact O-C 3.51Å; I194-G213 WeakPolarHBondContact O-CA 3.4Å; N195-G213 WeakPolarHBondContact OD1-CA 3.49Å; G213-P220 CarbonylContact O-C 3.54Å; G213-P220 WeakPolarHBondContact O-CA 3.47Å; G213-L221 PolarHBondContact N-O 3.42Å; G213-L221 PolarHBondContact O-N 3.02Å
214	A	87.6	Confident	87.7	Confident	60 Å²	60	61.8 Å²	61.8	50%	0.496	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	138.5	164.3	0	0	0	0	0	108.8	T193 I194	T193-A214 WeakPolarHBondContact CA-O 3.45Å; I194-A214 PolarHBondContact N-O 3.36Å; I194-A214 PolarHBondContact O-N 3.43Å
215	G	82.6	Confident	88.2	Confident	19 Å²	19	57.9 Å²	57.9	20%	0.196	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.9	155.5	178.3	0	0	0	0	0	112.8	G192 T217 H218 G219	G192-G215 CarbonylContact O-C 3.58Å; G192-G215 WeakPolarHBondContact O-CA 3.28Å; G215-T217 VanDerWaalsContact C-N 3.32Å; G215-T217 PolarHBondContact O-N 2.97Å; G215-H218 PolarHBondContact O-N 3.41Å; G215-G219 WeakPolarHBondContact O-CA 3.35Å; G215-G219 PolarHBondContact O-N 3.43Å
216	D	74.9	Confident	88.5	Confident	143 Å²	143	55.3 Å²	55.3	77%	0.765	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-35.8	-170.4	-151.6	4.5	0	0	0	112	G192	G192-D216 PolarHBondContact O-N 3.35Å
217	T	66.4	Low	88.8	Confident	81 Å²	81	56.8 Å²	56.8	50%	0.497	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-20.1	-178.6	44.5	0	0	0	0	114.5	G215	G215-T217 VanDerWaalsContact C-N 3.32Å; G215-T217 PolarHBondContact O-N 2.97Å
218	H	67.4	Low	88.7	Confident	102 Å²	102	61.9 Å²	61.9	47%	0.472	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.9	-5.8	-166	-73.8	-33.3	0	0	0	114.5	G215 Q243	G215-H218 PolarHBondContact O-N 3.41Å; H218-Q243 VanDerWaalsContact CA-NE2 3.31Å; H218-Q243 PolarHBondContact ND1-NE2 2.97Å; H218-Q243 WeakPolarHBondContact O-CG 3.22Å; H218-Q243 PolarHBondContact O-NE2 3.37Å
219	G	81.5	Confident	88.7	Confident	22 Å²	22	64 Å²	64	23%	0.227	34%	0.342	C	S	.	.			trans	63.5	-170.5	-178.1	0	0	0	0	0	112.9	G215 F244	G215-G219 WeakPolarHBondContact O-CA 3.35Å; G215-G219 PolarHBondContact O-N 3.43Å; G219-F244 WeakPolarHBondContact CA-O 3.5Å
220	P	88.6	Confident	88.5	Confident	76 Å²	76	68.1 Å²	68.1	49%	0.494	36%	0.364	S	S	.	.			trans	-63.1	135.9	175.2	-21.4	33	0	0	0	111.7	G213 F244	G213-P220 CarbonylContact O-C 3.54Å; G213-P220 WeakPolarHBondContact O-CA 3.47Å; P220-F244 HydrophobicContact CB-CB 4.36Å; P220-F244 WeakPolarHBondContact CD-O 3.4Å; P220-F244 PolarHBondContact O-N 3.09Å
221	L	88.3	Confident	88.3	Confident	49 Å²	49	68.6 Å²	68.6	26%	0.257	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	128.1	176.6	-172.7	123.7	0	0	0	109.4	L212 G213 L242 Q243	L212-L221 CarbonylContact C-O 3.51Å; L212-L221 WeakPolarHBondContact CA-O 3.41Å; G213-L221 PolarHBondContact N-O 3.42Å; G213-L221 PolarHBondContact O-N 3.02Å; L221-L242 WeakPolarHBondContact CA-O 3.38Å; L221-Q243 HydrophobicContact CD1-CB 4.15Å; L221-Q243 HydrophobicContact CD1-CG 4.33Å
222	F	92.2	Very high	88.1	Confident	96 Å²	96	73.8 Å²	73.8	42%	0.421	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	119.6	170.9	-179.9	-90.6	0	0	0	108.5	V210 L212 G241 L242	V210-F222 HydrophobicContact CG1-CE2 4.08Å; V210-F222 HydrophobicContact CG1-CZ 4.27Å; L212-F222 HydrophobicContact CD2-CD2 3.46Å; L212-F222 VanDerWaalsContact CD2-CD2 3.46Å; L212-F222 HydrophobicContact CD2-CE2 3.99Å; L212-F222 HydrophobicContact CD2-CG 4.49Å; F222-G241 CarbonylContact O-C 3.57Å; F222-G241 VanDerWaalsContact O-CA 3.24Å; F222-G241 WeakPolarHBondContact O-CA 3.32Å; F222-L242 PolarHBondContact N-O 3.25Å; F222-L242 PolarHBondContact O-N 2.86Å
223	G	92.8	Very high	88	Confident	0 Å²	0	77.5 Å²	77.5	0%	0	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	149.1	-179.7	0	0	0	0	0	112	V210 E211 C240	V210-G223 CarbonylContact C-O 3.55Å; V210-G223 WeakPolarHBondContact CA-O 3.43Å; E211-G223 PolarHBondContact N-O 3.14Å; E211-G223 PolarHBondContact O-N 3.09Å; G223-C240 CarbonylContact C-O 3.56Å; G223-C240 WeakPolarHBondContact CA-O 3.16Å
224	M	94.7	Very high	88.2	Confident	84 Å²	84	78.1 Å²	78.1	41%	0.414	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	128.8	167.3	-176.5	177.4	63.4	0	0	108.4	E209 I226 Q239 C240	E209-M224 CarbonylContact O-C 3.53Å; E209-M224 WeakPolarHBondContact O-CA 3.36Å; M224-I226 HydrophobicContact CE-CD1 4.01Å; M224-I226 HydrophobicContact CG-CG1 4.39Å; M224-I226 HydrophobicContact SD-CD1 4.36Å; M224-Q239 CarbonylContact O-C 3.46Å; M224-Q239 VanDerWaalsContact O-CA 3.28Å; M224-Q239 WeakPolarHBondContact O-CA 3.49Å; M224-C240 PolarHBondContact N-O 2.92Å; M224-C240 PolarHBondContact O-N 2.83Å
225	K	95.3	Very high	88.6	Confident	56 Å²	56	77.5 Å²	77.5	24%	0.243	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	131.2	-179.7	-177	-179.2	-178.6	-172.1	0	109.7	W207 G208 E209 T237 A238 Q239	W207-K225 HydrophobicContact CH2-CD 3.97Å; W207-K225 HydrophobicContact CH2-CG 4.29Å; W207-K225 HydrophobicContact CZ3-CD 4.14Å; W207-K225 HydrophobicContact CZ3-CG 4.2Å; G208-K225 CarbonylContact C-O 3.52Å; G208-K225 WeakPolarHBondContact CA-O 3.47Å; E209-K225 HydrophobicContact CB-CB 4.23Å; E209-K225 PolarHBondContact N-O 2.9Å; E209-K225 PolarHBondContact O-N 2.79Å; E209-K225 IonicContact OE2-NZ 2.98Å; K225-T237 HydrophobicContact CG-CG2 3.93Å; K225-A238 CarbonylContact C-O 3.58Å; K225-A238 WeakPolarHBondContact CA-O 3.3Å; K225-Q239 HydrophobicContact CB-CB 4.35Å; K225-Q239 HydrophobicContact CB-CG 4.2Å; K225-Q239 HydrophobicContact CG-CB 4.28Å
226	I	95.8	Very high	89.2	Confident	80 Å²	80	77.7 Å²	77.7	41%	0.41	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	125.8	-177.1	-60.5	172.9	0	0	0	107.6	M224 T237 A238	M224-I226 HydrophobicContact CE-CD1 4.01Å; M224-I226 HydrophobicContact CG-CG1 4.39Å; M224-I226 HydrophobicContact SD-CD1 4.36Å; I226-T237 CarbonylContact O-C 3.58Å; I226-T237 VanDerWaalsContact O-CA 3.23Å; I226-T237 WeakPolarHBondContact O-CA 3.41Å; I226-A238 PolarHBondContact N-O 3.15Å; I226-A238 PolarHBondContact O-N 3.35Å
227	F	96.4	Very high	90.3	Very high	39 Å²	39	71.9 Å²	71.9	17%	0.171	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	133.5	173.7	173	-88.6	0	0	0	110	G206 W207 N229 F235 T237	G206-F227 CarbonylContact C-O 3.53Å; G206-F227 WeakPolarHBondContact CA-O 3.39Å; W207-F227 AromaticContact CD1-CD1 3.44Å; W207-F227 VanDerWaalsContact CD1-CD1 3.44Å; W207-F227 AromaticContact CD1-CG 3.92Å; W207-F227 HydrophobicContact CD2-CB 3.62Å; W207-F227 HydrophobicContact CD2-CG 4.34Å; W207-F227 AromaticContact CE2-CD1 3.98Å; W207-F227 AromaticContact CE2-CG 3.62Å; W207-F227 HydrophobicContact CE3-CB 4.18Å; W207-F227 HydrophobicContact CG-CB 4.05Å; W207-F227 HydrophobicContact CG-CD1 4.27Å; W207-F227 HydrophobicContact CH2-CB 4.14Å; W207-F227 HydrophobicContact CZ2-CB 3.55Å; W207-F227 HydrophobicContact CZ2-CD2 4.32Å; W207-F227 AromaticContact CZ2-CG 3.98Å; W207-F227 HydrophobicContact CZ2-CG 3.98Å; W207-F227 HydrophobicContact CZ3-CB 4.4Å; W207-F227 PolarHBondContact N-O 2.91Å; W207-F227 AromaticContact NE1-CD1 3.21Å; W207-F227 AromaticContact NE1-CE1 3.97Å; W207-F227 AromaticContact NE1-CG 3.31Å; W207-F227 VanDerWaalsContact NE1-CG 3.31Å; W207-F227 PolarHBondContact O-N 3Å; F227-N229 WeakPolarHBondContact CE1-OD1 3.25Å; F227-N229 VanDerWaalsContact CZ-OD1 3.26Å; F227-N229 WeakPolarHBondContact CZ-OD1 3.18Å; F227-F235 HydrophobicContact CD2-CD2 4.23Å; F227-F235 HydrophobicContact CE2-CB 3.95Å; F227-F235 AromaticContact CE2-CD2 3.46Å; F227-F235 HydrophobicContact CE2-CD2 3.46Å; F227-F235 VanDerWaalsContact CE2-CD2 3.46Å; F227-F235 HydrophobicContact CE2-CE2 4.07Å; F227-F235 AromaticContact CE2-CG 3.82Å; F227-F235 HydrophobicContact CE2-CG 3.82Å; F227-F235 HydrophobicContact CZ-CB 3.96Å; F227-F235 HydrophobicContact CZ-CD2 4.27Å; F227-F235 HydrophobicContact CZ-CG 4.17Å; F227-T237 WeakPolarHBondContact CD2-OG1 3.27Å
228	R	95	Very high	91.7	Very high	167 Å²	167	69.9 Å²	69.9	63%	0.63	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.7	131.9	176.1	-166.9	169.9	-178.3	168.9	-0.1	112.1	K205 L230 F235 A236	K205-R228 WeakPolarHBondContact O-CA 3.45Å; R228-L230 PolarHBondContact O-N 3.32Å; R228-F235 WeakPolarHBondContact O-CA 3.28Å; R228-A236 PolarHBondContact N-O 2.74Å; R228-A236 PolarHBondContact O-N 3.17Å
229	N	94.4	Very high	92.9	Very high	65 Å²	65	68 Å²	68	35%	0.348	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	111.7	165.4	-68.2	-25.4	0	0	0	108.5	K205 F227 F235	K205-N229 HydrophobicContact CB-CB 4.4Å; K205-N229 PolarHBondContact O-N 3.1Å; F227-N229 WeakPolarHBondContact CE1-OD1 3.25Å; F227-N229 VanDerWaalsContact CZ-OD1 3.26Å; F227-N229 WeakPolarHBondContact CZ-OD1 3.18Å; N229-F235 WeakPolarHBondContact OD1-CB 3.43Å
230	L	92.5	Very high	93.5	Very high	103 Å²	103	69.6 Å²	69.6	54%	0.539	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	-43.2	179.2	-63.8	176.4	0	0	0	110.6	R228 C234 A236 L257	R228-L230 PolarHBondContact O-N 3.32Å; L230-C234 PolarHBondContact N-O 3.33Å; L230-A236 HydrophobicContact CD1-CB 3.7Å; L230-A236 HydrophobicContact CG-CB 4.1Å; L230-L257 HydrophobicContact CD1-CD1 3.97Å
231	T	92.1	Very high	93.7	Very high	71 Å²	71	66.7 Å²	66.7	44%	0.436	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	169.3	175	71.5	0	0	0	0	109.1	R233 C234	T231-R233 PolarHBondContact O-N 3.43Å; T231-R233 PolarHBondContact OG1-N 2.92Å; T231-C234 PolarHBondContact N-O 2.86Å; T231-C234 VanDerWaalsContact N-O 3.09Å; T231-C234 PolarHBondContact O-N 3.48Å; T231-C234 VanDerWaalsContact O-N 3.16Å; T231-C234 VanDerWaalsContact OG1-CB 3.26Å; T231-C234 WeakPolarHBondContact OG1-CB 3.45Å; T231-C234 PolarHBondContact OG1-N 3.21Å; T231-C234 PolarHBondContact OG1-SG 3.04Å; T231-C234 VanDerWaalsContact OG1-SG 3.41Å
232	P	88.7	Confident	93.8	Very high	140 Å²	140	67.6 Å²	67.6	91%	0.909	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-17.5	175.6	-25.2	35.3	0	0	0	114.5
233	R	91.8	Very high	93.6	Very high	167 Å²	167	63.5 Å²	63.5	63%	0.63	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.9	-5.3	179.8	-66.7	-171.5	-177.8	179.4	2.8	113.4	T231 R259 H260	T231-R233 PolarHBondContact O-N 3.43Å; T231-R233 PolarHBondContact OG1-N 2.92Å; R233-R259 CarbonylContact O-C 3.54Å; R233-R259 VanDerWaalsContact O-CA 3.31Å; R233-R259 WeakPolarHBondContact O-CA 3.44Å; R233-H260 HydrophobicContact CB-CB 4.11Å; R233-H260 HydrophobicContact CG-CB 4.37Å; R233-H260 PolarHBondContact O-N 3.47Å
234	C	94.1	Very high	93.3	Very high	20 Å²	20	67.9 Å²	67.9	14%	0.135	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	131.9	-175.2	-57	0	0	0	0	111.4	L230 T231 A258 R259	L230-C234 PolarHBondContact N-O 3.33Å; T231-C234 PolarHBondContact N-O 2.86Å; T231-C234 VanDerWaalsContact N-O 3.09Å; T231-C234 PolarHBondContact O-N 3.48Å; T231-C234 VanDerWaalsContact O-N 3.16Å; T231-C234 VanDerWaalsContact OG1-CB 3.26Å; T231-C234 WeakPolarHBondContact OG1-CB 3.45Å; T231-C234 PolarHBondContact OG1-N 3.21Å; T231-C234 PolarHBondContact OG1-SG 3.04Å; T231-C234 VanDerWaalsContact OG1-SG 3.41Å; C234-A258 VanDerWaalsContact CA-O 3.29Å; C234-A258 WeakPolarHBondContact CA-O 3.25Å; C234-R259 VanDerWaalsContact SG-CG 3.5Å
235	F	95.4	Very high	92.8	Very high	48 Å²	48	65.5 Å²	65.5	21%	0.211	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	150.2	169.4	69.1	-99.1	0	0	0	110.6	F227 R228 N229 A258 M266 Y268	F227-F235 HydrophobicContact CD2-CD2 4.23Å; F227-F235 HydrophobicContact CE2-CB 3.95Å; F227-F235 AromaticContact CE2-CD2 3.46Å; F227-F235 HydrophobicContact CE2-CD2 3.46Å; F227-F235 VanDerWaalsContact CE2-CD2 3.46Å; F227-F235 HydrophobicContact CE2-CE2 4.07Å; F227-F235 AromaticContact CE2-CG 3.82Å; F227-F235 HydrophobicContact CE2-CG 3.82Å; F227-F235 HydrophobicContact CZ-CB 3.96Å; F227-F235 HydrophobicContact CZ-CD2 4.27Å; F227-F235 HydrophobicContact CZ-CG 4.17Å; R228-F235 WeakPolarHBondContact O-CA 3.28Å; N229-F235 WeakPolarHBondContact OD1-CB 3.43Å; F235-A258 HydrophobicContact CD1-CB 3.97Å; F235-A258 HydrophobicContact CD2-CB 4.02Å; F235-A258 HydrophobicContact CE1-CB 3.47Å; F235-A258 VanDerWaalsContact CE1-CB 3.47Å; F235-A258 HydrophobicContact CE2-CB 3.54Å; F235-A258 HydrophobicContact CG-CB 4.23Å; F235-A258 HydrophobicContact CZ-CB 3.25Å; F235-A258 PolarHBondContact N-O 3.16Å; F235-A258 PolarHBondContact O-N 3.12Å; F235-M266 HydrophobicContact CE1-CE 3.85Å; F235-Y268 HydrophobicContact CZ-CE1 4.31Å
236	A	96.1	Very high	92	Very high	23 Å²	23	68.9 Å²	68.9	19%	0.19	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	139.9	175.1	0	0	0	0	0	109.9	R228 L230 V256 L257	R228-A236 PolarHBondContact N-O 2.74Å; R228-A236 PolarHBondContact O-N 3.17Å; L230-A236 HydrophobicContact CD1-CB 3.7Å; L230-A236 HydrophobicContact CG-CB 4.1Å; A236-V256 CarbonylContact C-O 3.58Å; A236-V256 VanDerWaalsContact CA-O 3.3Å; A236-V256 WeakPolarHBondContact CA-O 3.14Å; A236-L257 HydrophobicContact CB-CD1 4.13Å
237	T	96.3	Very high	91.3	Very high	21 Å²	21	75.1 Å²	75.1	13%	0.129	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	128.4	169.8	-49.7	0	0	0	0	108.1	K225 I226 F227 T255 V256	K225-T237 HydrophobicContact CG-CG2 3.93Å; I226-T237 CarbonylContact O-C 3.58Å; I226-T237 VanDerWaalsContact O-CA 3.23Å; I226-T237 WeakPolarHBondContact O-CA 3.41Å; F227-T237 WeakPolarHBondContact CD2-OG1 3.27Å; T237-T255 CarbonylContact O-C 3.59Å; T237-T255 WeakPolarHBondContact O-CA 3.25Å; T237-V256 PolarHBondContact N-O 3.42Å; T237-V256 PolarHBondContact O-N 3.47Å
238	A	95.6	Very high	90.7	Very high	38 Å²	38	74.9 Å²	74.9	31%	0.314	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	126.9	172.7	0	0	0	0	0	108.5	K225 I226 T254	K225-A238 CarbonylContact C-O 3.58Å; K225-A238 WeakPolarHBondContact CA-O 3.3Å; I226-A238 PolarHBondContact N-O 3.15Å; I226-A238 PolarHBondContact O-N 3.35Å; A238-T254 CarbonylContact C-O 3.52Å
239	Q	94.6	Very high	90.4	Very high	63 Å²	63	70.9 Å²	70.9	29%	0.294	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	125.7	175.9	-175.6	179.5	3.3	0	0	108.5	E211 M224 K225 V253 T254	E211-Q239 PolarHBondContact OE2-NE2 2.92Å; M224-Q239 CarbonylContact O-C 3.46Å; M224-Q239 VanDerWaalsContact O-CA 3.28Å; M224-Q239 WeakPolarHBondContact O-CA 3.49Å; K225-Q239 HydrophobicContact CB-CB 4.35Å; K225-Q239 HydrophobicContact CB-CG 4.2Å; K225-Q239 HydrophobicContact CG-CB 4.28Å; Q239-V253 CarbonylContact O-C 3.51Å; Q239-V253 WeakPolarHBondContact O-CA 3.48Å; Q239-T254 PolarHBondContact N-O 2.97Å; Q239-T254 PolarHBondContact O-N 3.35Å
240	C	94	Very high	90.2	Very high	55 Å²	55	72.7 Å²	72.7	37%	0.372	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	132.5	173.8	-60.2	0	0	0	0	107.8	G223 M224 G252	G223-C240 CarbonylContact C-O 3.56Å; G223-C240 WeakPolarHBondContact CA-O 3.16Å; M224-C240 PolarHBondContact N-O 2.92Å; M224-C240 PolarHBondContact O-N 2.83Å; C240-G252 CarbonylContact C-O 3.55Å; C240-G252 WeakPolarHBondContact CA-O 3.5Å
241	G	91.3	Very high	90.1	Very high	16 Å²	16	70.5 Å²	70.5	17%	0.165	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	145.4	-178.9	0	0	0	0	0	112	F222 P251 G252	F222-G241 CarbonylContact O-C 3.57Å; F222-G241 VanDerWaalsContact O-CA 3.24Å; F222-G241 WeakPolarHBondContact O-CA 3.32Å; G241-P251 CarbonylContact O-C 3.49Å; G241-P251 WeakPolarHBondContact O-CA 3.03Å; G241-G252 PolarHBondContact N-O 2.61Å; G241-G252 PolarHBondContact O-N 3.28Å
242	L	90.6	Very high	90.1	Very high	67 Å²	67	67.6 Å²	67.6	35%	0.351	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	117	171.3	-67.2	172.6	0	0	0	107.6	L221 F222 F244 V249 P251	L221-L242 WeakPolarHBondContact CA-O 3.38Å; F222-L242 PolarHBondContact N-O 3.25Å; F222-L242 PolarHBondContact O-N 2.86Å; L242-F244 HydrophobicContact CB-CE2 3.94Å; L242-F244 HydrophobicContact CB-CZ 4.3Å; L242-V249 HydrophobicContact CB-CG1 4.47Å; L242-V249 HydrophobicContact CD2-CG1 4.02Å; L242-P251 HydrophobicContact CD2-CB 3.89Å
243	Q	88.9	Confident	90.4	Very high	11 Å²	11	62.7 Å²	62.7	5%	0.051	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	122.1	175.3	-174.9	-178.9	8.3	0	0	109.5	H218 L221 V249 R250 I275	H218-Q243 VanDerWaalsContact CA-NE2 3.31Å; H218-Q243 PolarHBondContact ND1-NE2 2.97Å; H218-Q243 WeakPolarHBondContact O-CG 3.22Å; H218-Q243 PolarHBondContact O-NE2 3.37Å; L221-Q243 HydrophobicContact CD1-CB 4.15Å; L221-Q243 HydrophobicContact CD1-CG 4.33Å; Q243-V249 WeakPolarHBondContact O-CA 3.38Å; Q243-R250 HydrophobicContact CB-CB 4.33Å; Q243-R250 PolarHBondContact N-O 3.08Å; Q243-R250 PolarHBondContact O-N 3.25Å; Q243-I275 HydrophobicContact CB-CD1 4.08Å
244	F	86.8	Confident	90.5	Very high	92 Å²	92	56.3 Å²	56.3	40%	0.404	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	103.7	178.7	-63.7	-93.2	0	0	0	108.7	G219 P220 L242 V249	G219-F244 WeakPolarHBondContact CA-O 3.5Å; P220-F244 HydrophobicContact CB-CB 4.36Å; P220-F244 WeakPolarHBondContact CD-O 3.4Å; P220-F244 PolarHBondContact O-N 3.09Å; L242-F244 HydrophobicContact CB-CE2 3.94Å; L242-F244 HydrophobicContact CB-CZ 4.3Å; F244-V249 HydrophobicContact CD1-CG1 4.44Å; F244-V249 HydrophobicContact CD1-CG2 3.69Å; F244-V249 HydrophobicContact CE1-CG1 4.18Å; F244-V249 HydrophobicContact CE1-CG2 3.71Å; F244-V249 HydrophobicContact CZ-CG1 4.49Å
245	S	82.4	Confident	90.5	Very high	34 Å²	34	57.8 Å²	57.8	24%	0.238	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	163.6	176.1	-176	0	0	0	0	110.1	R247 G248	S245-R247 PolarHBondContact O-N 3.36Å; S245-R247 VanDerWaalsContact O-N 3.09Å; S245-G248 PolarHBondContact N-O 2.91Å; S245-G248 VanDerWaalsContact N-O 3.14Å; S245-G248 PolarHBondContact O-N 3.28Å
246	S	78.6	Confident	90.6	Very high	127 Å²	127	56.9 Å²	56.9	89%	0.888	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-22.3	171.5	55.3	0	0	0	0	113.1	G248	S246-G248 VanDerWaalsContact C-N 3.32Å
247	R	81	Confident	90.7	Very high	210 Å²	210	59.3 Å²	59.3	79%	0.792	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	7.1	175.4	-63.1	-177.8	178	167.2	2.3	114.1	S245	S245-R247 PolarHBondContact O-N 3.36Å; S245-R247 VanDerWaalsContact O-N 3.09Å
248	G	84.8	Confident	90.7	Very high	35 Å²	35	58.3 Å²	58.3	36%	0.361	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	108.9	-177.2	-179.8	0	0	0	0	0	114.4	S245 S246	S245-G248 PolarHBondContact N-O 2.91Å; S245-G248 VanDerWaalsContact N-O 3.14Å; S245-G248 PolarHBondContact O-N 3.28Å; S246-G248 VanDerWaalsContact C-N 3.32Å
249	V	88.7	Confident	90.7	Very high	83 Å²	83	63.6 Å²	63.6	50%	0.503	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	125	-179.7	-173.5	0	0	0	0	109.9	L242 Q243 F244 P251	L242-V249 HydrophobicContact CB-CG1 4.47Å; L242-V249 HydrophobicContact CD2-CG1 4.02Å; Q243-V249 WeakPolarHBondContact O-CA 3.38Å; F244-V249 HydrophobicContact CD1-CG1 4.44Å; F244-V249 HydrophobicContact CD1-CG2 3.69Å; F244-V249 HydrophobicContact CE1-CG1 4.18Å; F244-V249 HydrophobicContact CE1-CG2 3.71Å; F244-V249 HydrophobicContact CZ-CG1 4.49Å; V249-P251 WeakPolarHBondContact O-CD 3.31Å
250	R	89.3	Confident	90.7	Very high	102 Å²	102	64.3 Å²	64.3	39%	0.385	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	104.1	177.7	-65.8	179.4	176.3	174.2	-4.9	110	Q243 I275	Q243-R250 HydrophobicContact CB-CB 4.33Å; Q243-R250 PolarHBondContact N-O 3.08Å; Q243-R250 PolarHBondContact O-N 3.25Å; R250-I275 HydrophobicContact CB-CG1 4.17Å
251	P	91.8	Very high	90.7	Very high	58 Å²	58	66.4 Å²	66.4	38%	0.377	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	147.2	172.8	30.8	-33.4	0	0	0	110.7	G241 L242 V249 W273 G274 I275	G241-P251 CarbonylContact O-C 3.49Å; G241-P251 WeakPolarHBondContact O-CA 3.03Å; L242-P251 HydrophobicContact CD2-CB 3.89Å; V249-P251 WeakPolarHBondContact O-CD 3.31Å; P251-W273 HydrophobicContact CB-CZ3 4.27Å; P251-W273 HydrophobicContact CG-CH2 4.28Å; P251-W273 HydrophobicContact CG-CZ3 4.44Å; P251-G274 VanDerWaalsContact O-CA 3.22Å; P251-G274 WeakPolarHBondContact O-CA 3.34Å; P251-I275 PolarHBondContact O-N 3.36Å
252	G	91.6	Very high	90.8	Very high	10 Å²	10	69.5 Å²	69.5	10%	0.103	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	139.1	173.4	0	0	0	0	0	110.6	C240 G241 W273	C240-G252 CarbonylContact C-O 3.55Å; C240-G252 WeakPolarHBondContact CA-O 3.5Å; G241-G252 PolarHBondContact N-O 2.61Å; G241-G252 PolarHBondContact O-N 3.28Å; G252-W273 CarbonylContact C-O 3.58Å; G252-W273 VanDerWaalsContact CA-O 3.27Å; G252-W273 WeakPolarHBondContact CA-O 3.39Å
253	V	94	Very high	90.8	Very high	36 Å²	36	75.6 Å²	75.6	22%	0.218	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	128.5	173.3	-179.9	0	0	0	0	108.3	Q239 R272 W273	Q239-V253 CarbonylContact O-C 3.51Å; Q239-V253 WeakPolarHBondContact O-CA 3.48Å; V253-R272 CarbonylContact O-C 3.57Å; V253-R272 WeakPolarHBondContact O-CA 3.43Å; V253-W273 HydrophobicContact CB-CE3 3.96Å; V253-W273 HydrophobicContact CG2-CE3 3.77Å; V253-W273 HydrophobicContact CG2-CZ3 3.98Å; V253-W273 PolarHBondContact N-O 2.92Å; V253-W273 PolarHBondContact O-N 3.5Å
254	T	94.3	Very high	91.1	Very high	34 Å²	34	78.7 Å²	78.7	21%	0.209	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	119	173.8	-63.8	0	0	0	0	109.5	A238 Q239 V256 Q270 W271 R272	A238-T254 CarbonylContact C-O 3.52Å; Q239-T254 PolarHBondContact N-O 2.97Å; Q239-T254 PolarHBondContact O-N 3.35Å; T254-V256 HydrophobicContact CG2-CG2 4.33Å; T254-Q270 HydrophobicContact CG2-CG 4.25Å; T254-W271 CarbonylContact C-O 3.57Å; T254-W271 VanDerWaalsContact CA-O 3.3Å; T254-W271 WeakPolarHBondContact CA-O 3.41Å; T254-R272 HydrophobicContact CG2-CG 3.97Å
255	T	95.6	Very high	91.5	Very high	50 Å²	50	75 Å²	75	31%	0.307	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	126.2	176.6	-56.4	0	0	0	0	109.1	T237 Q270 W271	T237-T255 CarbonylContact O-C 3.59Å; T237-T255 WeakPolarHBondContact O-CA 3.25Å; T255-Q270 CarbonylContact O-C 3.59Å; T255-Q270 WeakPolarHBondContact O-CA 3.2Å; T255-W271 PolarHBondContact N-O 3.32Å; T255-W271 PolarHBondContact O-N 3.14Å
256	V	96.8	Very high	92.1	Very high	30 Å²	30	74.6 Å²	74.6	18%	0.182	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	118	175.2	-178.2	0	0	0	0	108.2	A236 T237 T254 L269 Q270	A236-V256 CarbonylContact C-O 3.58Å; A236-V256 VanDerWaalsContact CA-O 3.3Å; A236-V256 WeakPolarHBondContact CA-O 3.14Å; T237-V256 PolarHBondContact N-O 3.42Å; T237-V256 PolarHBondContact O-N 3.47Å; T254-V256 HydrophobicContact CG2-CG2 4.33Å; V256-L269 CarbonylContact C-O 3.53Å; V256-L269 WeakPolarHBondContact CA-O 3.46Å; V256-Q270 HydrophobicContact CG2-CB 4.16Å; V256-Q270 HydrophobicContact CG2-CG 3.9Å
257	L	97	Very high	93	Very high	73 Å²	73	69.1 Å²	69.1	38%	0.382	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	122.1	169	-178.1	71.5	0	0	0	108.3	L230 A236 L269	L230-L257 HydrophobicContact CD1-CD1 3.97Å; A236-L257 HydrophobicContact CB-CD1 4.13Å; L257-L269 HydrophobicContact CB-CB 4.38Å; L257-L269 PolarHBondContact N-O 3.01Å; L257-L269 PolarHBondContact O-N 2.94Å
258	A	96.2	Very high	93.7	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	141.7	176.5	0	0	0	0	0	110.8	C234 F235 M266 G267 Y268	C234-A258 VanDerWaalsContact CA-O 3.29Å; C234-A258 WeakPolarHBondContact CA-O 3.25Å; F235-A258 HydrophobicContact CD1-CB 3.97Å; F235-A258 HydrophobicContact CD2-CB 4.02Å; F235-A258 HydrophobicContact CE1-CB 3.47Å; F235-A258 VanDerWaalsContact CE1-CB 3.47Å; F235-A258 HydrophobicContact CE2-CB 3.54Å; F235-A258 HydrophobicContact CG-CB 4.23Å; F235-A258 HydrophobicContact CZ-CB 3.25Å; F235-A258 PolarHBondContact N-O 3.16Å; F235-A258 PolarHBondContact O-N 3.12Å; A258-M266 HydrophobicContact CB-CE 4.34Å; A258-G267 CarbonylContact C-O 3.51Å; A258-G267 VanDerWaalsContact CA-O 3.27Å; A258-G267 WeakPolarHBondContact CA-O 3.4Å; A258-Y268 HydrophobicContact CB-CD1 3.55Å; A258-Y268 HydrophobicContact CB-CE1 3.72Å; A258-Y268 HydrophobicContact CB-CG 4.47Å
259	R	95.9	Very high	94.3	Very high	149 Å²	149	64.3 Å²	64.3	56%	0.562	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.9	129.9	-178.3	179.4	168.7	-174.7	175.7	1.1	111.4	R233 C234 L261 G267	R233-R259 CarbonylContact O-C 3.54Å; R233-R259 VanDerWaalsContact O-CA 3.31Å; R233-R259 WeakPolarHBondContact O-CA 3.44Å; C234-R259 VanDerWaalsContact SG-CG 3.5Å; R259-L261 HydrophobicContact CG-CD2 4.41Å; R259-L261 PolarHBondContact O-N 3.3Å; R259-G267 PolarHBondContact N-O 3.38Å; R259-G267 PolarHBondContact O-N 3.19Å
260	H	95.5	Very high	94.6	Very high	78 Å²	78	62.2 Å²	62.2	36%	0.361	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	109.8	163.6	-71.3	-89.7	0	0	0	108.8	R233 M266	R233-H260 HydrophobicContact CB-CB 4.11Å; R233-H260 HydrophobicContact CG-CB 4.37Å; R233-H260 PolarHBondContact O-N 3.47Å; H260-M266 VanDerWaalsContact CA-SD 3.6Å; H260-M266 HydrophobicContact CB-SD 4Å; H260-M266 VanDerWaalsContact CD2-SD 3.59Å; H260-M266 PolarHBondContact CE1-SD 3.02Å; H260-M266 PolarHBondContact ND1-SD 3.24Å
261	L	93.9	Very high	94.9	Very high	99 Å²	99	63.6 Å²	63.6	52%	0.518	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	-35.6	173.5	-64	176.3	0	0	0	110.6	R259 T265 V283	R259-L261 HydrophobicContact CG-CD2 4.41Å; R259-L261 PolarHBondContact O-N 3.3Å; L261-T265 HydrophobicContact CB-CG2 4.24Å; L261-T265 HydrophobicContact CD1-CG2 4.23Å; L261-T265 PolarHBondContact N-O 3.06Å; L261-V283 HydrophobicContact CD1-CG1 4.43Å
262	D	93.1	Very high	95	Very high	81 Å²	81	64.1 Å²	64.1	43%	0.433	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	174.2	177.7	-173.5	18.1	0	0	0	109	N264 T265 R285	D262-N264 PolarHBondContact O-N 2.88Å; D262-N264 VanDerWaalsContact O-N 3.16Å; D262-T265 PolarHBondContact N-O 2.83Å; D262-T265 PolarHBondContact O-N 3.33Å; D262-R285 IonicContact OD2-NH1 3.01Å; D262-R285 PolarHBondContact OD2-NH1 2.97Å
263	K	90.7	Very high	95	Very high	195 Å²	195	69.6 Å²	69.6	85%	0.848	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-35.8	177.2	-69.5	-176.9	179.9	178.7	0	112.5
264	N	94.3	Very high	94.7	Very high	77 Å²	77	69.5 Å²	69.5	41%	0.412	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.1	3.5	-174.8	-67	-7.5	0	0	0	113.1	D262 R285 D286 T287	D262-N264 PolarHBondContact O-N 2.88Å; D262-N264 VanDerWaalsContact O-N 3.16Å; N264-R285 CarbonylContact O-C 3.55Å; N264-R285 VanDerWaalsContact O-CA 3.29Å; N264-R285 WeakPolarHBondContact O-CA 3.47Å; N264-D286 VanDerWaalsContact CB-O 3.3Å; N264-D286 WeakPolarHBondContact CB-O 3.24Å; N264-D286 PolarHBondContact O-N 2.96Å; N264-T287 HydrophobicContact CB-CG2 4.43Å
265	T	95.8	Very high	93.9	Very high	13 Å²	13	71.8 Å²	71.8	8%	0.08	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	126.7	-172.8	-50.2	0	0	0	0	111.9	L261 D262 V283 V284 R285	L261-T265 HydrophobicContact CB-CG2 4.24Å; L261-T265 HydrophobicContact CD1-CG2 4.23Å; L261-T265 PolarHBondContact N-O 3.06Å; D262-T265 PolarHBondContact N-O 2.83Å; D262-T265 PolarHBondContact O-N 3.33Å; T265-V283 HydrophobicContact CG2-CG1 3.68Å; T265-V284 CarbonylContact C-O 3.5Å; T265-V284 WeakPolarHBondContact CA-O 3.44Å; T265-R285 HydrophobicContact CG2-CB 4.41Å; T265-R285 PolarHBondContact OG1-NH1 3.28Å
266	M	95.8	Very high	93.2	Very high	26 Å²	26	75.2 Å²	75.2	13%	0.128	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	126.8	178.4	-71.1	-62.6	-78.9	0	0	110.3	F235 A258 H260 Y268 V283 V284	F235-M266 HydrophobicContact CE1-CE 3.85Å; A258-M266 HydrophobicContact CB-CE 4.34Å; H260-M266 VanDerWaalsContact CA-SD 3.6Å; H260-M266 HydrophobicContact CB-SD 4Å; H260-M266 VanDerWaalsContact CD2-SD 3.59Å; H260-M266 PolarHBondContact CE1-SD 3.02Å; H260-M266 PolarHBondContact ND1-SD 3.24Å; M266-Y268 HydrophobicContact CB-CD2 4.43Å; M266-Y268 HydrophobicContact CB-CE2 3.61Å; M266-V283 WeakPolarHBondContact O-CA 3.47Å; M266-V284 PolarHBondContact N-O 3.15Å; M266-V284 PolarHBondContact O-N 3.4Å
267	G	96.9	Very high	92.9	Very high	13 Å²	13	76.5 Å²	76.5	13%	0.134	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	139.1	166.1	0	0	0	0	0	110.3	A258 R259 S282	A258-G267 CarbonylContact C-O 3.51Å; A258-G267 VanDerWaalsContact CA-O 3.27Å; A258-G267 WeakPolarHBondContact CA-O 3.4Å; R259-G267 PolarHBondContact N-O 3.38Å; R259-G267 PolarHBondContact O-N 3.19Å; G267-S282 CarbonylContact C-O 3.48Å; G267-S282 WeakPolarHBondContact CA-O 3.45Å
268	Y	96.7	Very high	92.8	Very high	79 Å²	79	73.5 Å²	73.5	31%	0.31	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	136	174.1	-58.1	-90.6	0	0	0	109.9	F235 A258 M266 T281 S282 V284	F235-Y268 HydrophobicContact CZ-CE1 4.31Å; A258-Y268 HydrophobicContact CB-CD1 3.55Å; A258-Y268 HydrophobicContact CB-CE1 3.72Å; A258-Y268 HydrophobicContact CB-CG 4.47Å; M266-Y268 HydrophobicContact CB-CD2 4.43Å; M266-Y268 HydrophobicContact CB-CE2 3.61Å; Y268-T281 WeakPolarHBondContact O-CA 3.27Å; Y268-S282 PolarHBondContact N-O 3.27Å; Y268-S282 PolarHBondContact O-N 3.34Å; Y268-V284 HydrophobicContact CD2-CG2 4.16Å; Y268-V284 HydrophobicContact CE2-CB 4.23Å; Y268-V284 HydrophobicContact CE2-CG2 3.87Å
269	L	96.6	Very high	92.7	Very high	65 Å²	65	76.7 Å²	76.7	34%	0.34	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	110	171.2	-171.9	67.1	0	0	0	107.6	V256 L257 M279 T281	V256-L269 CarbonylContact C-O 3.53Å; V256-L269 WeakPolarHBondContact CA-O 3.46Å; L257-L269 HydrophobicContact CB-CB 4.38Å; L257-L269 PolarHBondContact N-O 3.01Å; L257-L269 PolarHBondContact O-N 2.94Å; L269-M279 HydrophobicContact CD1-CE 3.43Å; L269-M279 VanDerWaalsContact CD1-CE 3.43Å; L269-M279 HydrophobicContact CD1-SD 4.24Å; L269-M279 HydrophobicContact CD2-CE 3.99Å; L269-M279 HydrophobicContact CG-CE 3.77Å; L269-T281 HydrophobicContact CD1-CG2 4.44Å; L269-T281 VanDerWaalsContact CD1-OG1 3.29Å; L269-T281 WeakPolarHBondContact CD1-OG1 3.32Å
270	Q	95.2	Very high	92.7	Very high	39 Å²	39	70.9 Å²	70.9	18%	0.182	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	119.1	179.4	175.4	171.6	39.9	0	0	109.7	T254 T255 V256 R272 M279 N280	T254-Q270 HydrophobicContact CG2-CG 4.25Å; T255-Q270 CarbonylContact O-C 3.59Å; T255-Q270 WeakPolarHBondContact O-CA 3.2Å; V256-Q270 HydrophobicContact CG2-CB 4.16Å; V256-Q270 HydrophobicContact CG2-CG 3.9Å; Q270-R272 HydrophobicContact CG-CG 4.16Å; Q270-M279 CarbonylContact O-C 3.55Å; Q270-M279 WeakPolarHBondContact O-CA 3.39Å; Q270-N280 HydrophobicContact CB-CB 4.31Å; Q270-N280 PolarHBondContact N-O 3.41Å; Q270-N280 PolarHBondContact O-N 3.41Å
271	W	95.1	Very high	92.7	Very high	131 Å²	131	70.5 Å²	70.5	50%	0.496	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	126.8	172.4	-178.3	49.8	0	0	0	109.6	T254 T255 W273 M279	T254-W271 CarbonylContact C-O 3.57Å; T254-W271 VanDerWaalsContact CA-O 3.3Å; T254-W271 WeakPolarHBondContact CA-O 3.41Å; T255-W271 PolarHBondContact N-O 3.32Å; T255-W271 PolarHBondContact O-N 3.14Å; W271-W273 HydrophobicContact CH2-CB 4.32Å; W271-W273 HydrophobicContact CZ2-CB 3.94Å; W271-W273 HydrophobicContact CZ2-CG 4.33Å; W271-M279 HydrophobicContact CB-SD 3.69Å; W271-M279 HydrophobicContact CG-SD 4.09Å
272	R	94	Very high	92.8	Very high	69 Å²	69	66.6 Å²	66.6	26%	0.26	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	131.3	174.5	-55.6	-174.6	-174	169.2	6.3	108.7	V253 T254 Q270 Q276 S277 S278	V253-R272 CarbonylContact O-C 3.57Å; V253-R272 WeakPolarHBondContact O-CA 3.43Å; T254-R272 HydrophobicContact CG2-CG 3.97Å; Q270-R272 HydrophobicContact CG-CG 4.16Å; R272-Q276 CarbonylContact C-O 3.55Å; R272-Q276 VanDerWaalsContact C-O 3.28Å; R272-Q276 VanDerWaalsContact CB-O 3.3Å; R272-Q276 WeakPolarHBondContact CB-O 3.48Å; R272-S277 WeakPolarHBondContact O-CA 3.23Å; R272-S278 PolarHBondContact N-O 3.38Å; R272-S278 PolarHBondContact O-N 3.01Å
273	W	92.3	Very high	93.1	Very high	125 Å²	125	65.6 Å²	65.6	47%	0.473	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	144.8	178	172.8	82.9	0	0	0	109.6	P251 G252 V253 W271 Q276	P251-W273 HydrophobicContact CB-CZ3 4.27Å; P251-W273 HydrophobicContact CG-CH2 4.28Å; P251-W273 HydrophobicContact CG-CZ3 4.44Å; G252-W273 CarbonylContact C-O 3.58Å; G252-W273 VanDerWaalsContact CA-O 3.27Å; G252-W273 WeakPolarHBondContact CA-O 3.39Å; V253-W273 HydrophobicContact CB-CE3 3.96Å; V253-W273 HydrophobicContact CG2-CE3 3.77Å; V253-W273 HydrophobicContact CG2-CZ3 3.98Å; V253-W273 PolarHBondContact N-O 2.92Å; V253-W273 PolarHBondContact O-N 3.5Å; W271-W273 HydrophobicContact CH2-CB 4.32Å; W271-W273 HydrophobicContact CZ2-CB 3.94Å; W271-W273 HydrophobicContact CZ2-CG 4.33Å; W273-Q276 PolarHBondContact N-O 3.48Å
274	G	87.4	Confident	93.4	Very high	33 Å²	33	57.6 Å²	57.6	34%	0.34	29%	0.294	S	S	.	.	S	Bend	trans	100.1	-112	177.4	0	0	0	0	0	112.6	P251 Q276	P251-G274 VanDerWaalsContact O-CA 3.22Å; P251-G274 WeakPolarHBondContact O-CA 3.34Å; G274-Q276 PolarHBondContact O-N 3.45Å
275	I	78	Confident	93.4	Very high	83 Å²	83	58.9 Å²	58.9	43%	0.426	29%	0.293	S	S	.	.	S	Bend	trans	-54	-39	-176.2	-56.9	167.2	0	0	0	112.2	Q243 R250 P251	Q243-I275 HydrophobicContact CB-CD1 4.08Å; R250-I275 HydrophobicContact CB-CG1 4.17Å; P251-I275 PolarHBondContact O-N 3.36Å
276	Q	80.6	Confident	93.4	Very high	121 Å²	121	61.6 Å²	61.6	57%	0.565	31%	0.307	S	S	*	.	S	Bend	trans	-134	132.1	168.3	-69.1	-175.6	-22.6	0	0	108.4	R272 W273 G274	R272-Q276 CarbonylContact C-O 3.55Å; R272-Q276 VanDerWaalsContact C-O 3.28Å; R272-Q276 VanDerWaalsContact CB-O 3.3Å; R272-Q276 WeakPolarHBondContact CB-O 3.48Å; W273-Q276 PolarHBondContact N-O 3.48Å; G274-Q276 PolarHBondContact O-N 3.45Å
277	S	90.3	Very high	93.3	Very high	57 Å²	57	61.8 Å²	61.8	40%	0.399	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	106.2	178.9	-69	0	0	0	0	109.7	R272 G299 I300	R272-S277 WeakPolarHBondContact O-CA 3.23Å; S277-G299 WeakPolarHBondContact O-CA 3.29Å; S277-I300 PolarHBondContact O-N 3.01Å; S277-I300 VanDerWaalsContact O-N 3.16Å
278	S	93.8	Very high	93	Very high	11 Å²	11	69.9 Å²	69.9	8%	0.077	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	145.8	-179.5	66.4	0	0	0	0	112.2	R272 L298	R272-S278 PolarHBondContact N-O 3.38Å; R272-S278 PolarHBondContact O-N 3.01Å; S278-L298 CarbonylContact C-O 3.59Å; S278-L298 VanDerWaalsContact CA-O 3.31Å; S278-L298 WeakPolarHBondContact CA-O 3.33Å
279	M	94.8	Very high	92.7	Very high	67 Å²	67	68.5 Å²	68.5	33%	0.33	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	121.5	170.4	-172.2	66.2	156.3	0	0	108.5	L269 Q270 W271 Q297 L298	L269-M279 HydrophobicContact CD1-CE 3.43Å; L269-M279 VanDerWaalsContact CD1-CE 3.43Å; L269-M279 HydrophobicContact CD1-SD 4.24Å; L269-M279 HydrophobicContact CD2-CE 3.99Å; L269-M279 HydrophobicContact CG-CE 3.77Å; Q270-M279 CarbonylContact O-C 3.55Å; Q270-M279 WeakPolarHBondContact O-CA 3.39Å; W271-M279 HydrophobicContact CB-SD 3.69Å; W271-M279 HydrophobicContact CG-SD 4.09Å; M279-Q297 CarbonylContact O-C 3.52Å; M279-Q297 WeakPolarHBondContact O-CA 3.41Å; M279-L298 PolarHBondContact N-O 2.92Å; M279-L298 PolarHBondContact O-N 3.06Å
280	N	95.1	Very high	92.6	Very high	26 Å²	26	66.5 Å²	66.5	14%	0.139	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	120.5	177.2	-180	-0.2	0	0	0	109.9	Q270 V296 Q297	Q270-N280 HydrophobicContact CB-CB 4.31Å; Q270-N280 PolarHBondContact N-O 3.41Å; Q270-N280 PolarHBondContact O-N 3.41Å; N280-V296 CarbonylContact C-O 3.42Å; N280-V296 WeakPolarHBondContact CA-O 3.42Å; N280-V296 PolarHBondContact OD1-O 2.85Å; N280-Q297 HydrophobicContact CB-CB 4.42Å; N280-Q297 HydrophobicContact CB-CG 4.31Å
281	T	96.7	Very high	92.6	Very high	70 Å²	70	66.9 Å²	66.9	43%	0.429	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	118.3	172.3	-57.3	0	0	0	0	108	Y268 L269 A295 V296	Y268-T281 WeakPolarHBondContact O-CA 3.27Å; L269-T281 HydrophobicContact CD1-CG2 4.44Å; L269-T281 VanDerWaalsContact CD1-OG1 3.29Å; L269-T281 WeakPolarHBondContact CD1-OG1 3.32Å; T281-A295 CarbonylContact O-C 3.53Å; T281-A295 WeakPolarHBondContact O-CA 3.21Å; T281-V296 PolarHBondContact N-O 2.93Å; T281-V296 PolarHBondContact O-N 2.99Å
282	S	96.6	Very high	92.6	Very high	18 Å²	18	64 Å²	64	13%	0.126	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	147.2	178.6	61.2	0	0	0	0	113.1	G267 Y268 V294	G267-S282 CarbonylContact C-O 3.48Å; G267-S282 WeakPolarHBondContact CA-O 3.45Å; Y268-S282 PolarHBondContact N-O 3.27Å; Y268-S282 PolarHBondContact O-N 3.34Å; S282-V294 CarbonylContact C-O 3.54Å; S282-V294 WeakPolarHBondContact CA-O 3.37Å; S282-V294 WeakPolarHBondContact CB-O 3.3Å
283	V	97.4	Very high	92.8	Very high	60 Å²	60	61.8 Å²	61.8	36%	0.364	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	122.8	174.9	-178.9	0	0	0	0	107.5	L261 T265 M266 T293 V294	L261-V283 HydrophobicContact CD1-CG1 4.43Å; T265-V283 HydrophobicContact CG2-CG1 3.68Å; M266-V283 WeakPolarHBondContact O-CA 3.47Å; V283-T293 WeakPolarHBondContact O-CA 3.44Å; V283-V294 PolarHBondContact N-O 2.91Å; V283-V294 PolarHBondContact O-N 3.36Å
284	V	97	Very high	93	Very high	27 Å²	27	57.7 Å²	57.7	16%	0.164	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	122.3	179.5	-177.7	0	0	0	0	108.1	T265 M266 Y268 H291 F292 T293	T265-V284 CarbonylContact C-O 3.5Å; T265-V284 WeakPolarHBondContact CA-O 3.44Å; M266-V284 PolarHBondContact N-O 3.15Å; M266-V284 PolarHBondContact O-N 3.4Å; Y268-V284 HydrophobicContact CD2-CG2 4.16Å; Y268-V284 HydrophobicContact CE2-CB 4.23Å; Y268-V284 HydrophobicContact CE2-CG2 3.87Å; V284-H291 VanDerWaalsContact CG1-CE1 3.41Å; V284-H291 WeakPolarHBondContact CG1-CE1 3.14Å; V284-F292 CarbonylContact C-O 3.55Å; V284-F292 WeakPolarHBondContact CA-O 3.11Å; V284-T293 HydrophobicContact CG2-CG2 4.04Å
285	R	96.1	Very high	93.4	Very high	103 Å²	103	56.5 Å²	56.5	39%	0.389	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	112.8	172.8	-175.2	169.4	179.3	89.1	-3.4	109.2	D262 N264 T265 T287 F292	D262-R285 IonicContact OD2-NH1 3.01Å; D262-R285 PolarHBondContact OD2-NH1 2.97Å; N264-R285 CarbonylContact O-C 3.55Å; N264-R285 VanDerWaalsContact O-CA 3.29Å; N264-R285 WeakPolarHBondContact O-CA 3.47Å; T265-R285 HydrophobicContact CG2-CB 4.41Å; T265-R285 PolarHBondContact OG1-NH1 3.28Å; R285-T287 HydrophobicContact CG-CG2 4.41Å; R285-F292 PolarHBondContact N-O 2.9Å; R285-F292 PolarHBondContact O-N 3.28Å
286	D	95.2	Very high	94.2	Very high	71 Å²	71	55.2 Å²	55.2	38%	0.38	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	120.8	-179.8	-160.9	38.2	0	0	0	110.7	N264 H291 K312	N264-D286 VanDerWaalsContact CB-O 3.3Å; N264-D286 WeakPolarHBondContact CB-O 3.24Å; N264-D286 PolarHBondContact O-N 2.96Å; D286-H291 WeakPolarHBondContact OD1-CB 3.27Å; D286-H291 IonicContact OD1-CE1 2.84Å; D286-H291 IonicContact OD1-CG 3.14Å; D286-H291 IonicContact OD1-ND1 3.51Å; D286-H291 PolarHBondContact OD1-ND1 3.4Å; D286-K312 IonicContact OD1-NZ 3.22Å; D286-K312 PolarHBondContact OD1-NZ 2.83Å; D286-K312 IonicContact OD2-NZ 3.11Å; D286-K312 PolarHBondContact OD2-NZ 3.38Å
287	T	93.3	Very high	94.9	Very high	29 Å²	29	50.8 Å²	50.8	18%	0.178	27%	0.272	C	S	.	.			trans	-122.9	174.9	176.7	70.5	0	0	0	0	109.8	N264 R285 S289 S290 K312	N264-T287 HydrophobicContact CB-CG2 4.43Å; R285-T287 HydrophobicContact CG-CG2 4.41Å; T287-S289 VanDerWaalsContact C-N 3.28Å; T287-S289 PolarHBondContact O-N 3.28Å; T287-S290 WeakPolarHBondContact CA-O 3.49Å; T287-S290 PolarHBondContact N-O 2.87Å; T287-S290 PolarHBondContact OG1-N 2.88Å; T287-S290 PolarHBondContact OG1-O 3.45Å; T287-S290 PolarHBondContact OG1-OG 2.91Å; T287-S290 VanDerWaalsContact OG1-OG 3.05Å; T287-K312 PolarHBondContact O-NZ 3.44Å
288	K	90.4	Very high	95.1	Very high	184 Å²	184	53 Å²	53	80%	0.8	28%	0.279	S	S	*	.	S	Bend	trans	-61.2	-37.6	177.5	-66.8	-173.3	178.6	-176.5	0	112.2
289	S	91.1	Very high	94.8	Very high	49 Å²	49	53 Å²	53	34%	0.343	28%	0.28	S	S	.	.	S	Bend	trans	-102.2	-22.3	-175.3	52.9	0	0	0	0	114.2	T287 K312	T287-S289 VanDerWaalsContact C-N 3.28Å; T287-S289 PolarHBondContact O-N 3.28Å; S289-K312 PolarHBondContact O-N 2.96Å
290	S	93.7	Very high	94.4	Very high	23 Å²	23	57 Å²	57	16%	0.161	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	148.1	-177.3	71.5	0	0	0	0	113.1	T287 Q310	T287-S290 WeakPolarHBondContact CA-O 3.49Å; T287-S290 PolarHBondContact N-O 2.87Å; T287-S290 PolarHBondContact OG1-N 2.88Å; T287-S290 PolarHBondContact OG1-O 3.45Å; T287-S290 PolarHBondContact OG1-OG 2.91Å; T287-S290 VanDerWaalsContact OG1-OG 3.05Å; S290-Q310 CarbonylContact C-O 3.59Å; S290-Q310 VanDerWaalsContact CA-O 3.3Å; S290-Q310 WeakPolarHBondContact CA-O 3.35Å
291	H	95.2	Very high	93.4	Very high	47 Å²	47	59.5 Å²	59.5	22%	0.218	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	116.9	171.9	-178.4	82.1	0	0	0	108.8	V284 D286 T293 Q310	V284-H291 VanDerWaalsContact CG1-CE1 3.41Å; V284-H291 WeakPolarHBondContact CG1-CE1 3.14Å; D286-H291 WeakPolarHBondContact OD1-CB 3.27Å; D286-H291 IonicContact OD1-CE1 2.84Å; D286-H291 IonicContact OD1-CG 3.14Å; D286-H291 IonicContact OD1-ND1 3.51Å; D286-H291 PolarHBondContact OD1-ND1 3.4Å; H291-T293 PolarHBondContact NE2-OG1 3.2Å; H291-Q310 HydrophobicContact CB-CB 4.12Å; H291-Q310 PolarHBondContact N-O 3.22Å; H291-Q310 PolarHBondContact O-N 3.12Å
292	F	96.5	Very high	92.7	Very high	70 Å²	70	61.2 Å²	61.2	31%	0.307	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	133.3	-176.6	178.8	-110.2	0	0	0	109.9	V284 R285 V294 M307 S308 Y309	V284-F292 CarbonylContact C-O 3.55Å; V284-F292 WeakPolarHBondContact CA-O 3.11Å; R285-F292 PolarHBondContact N-O 2.9Å; R285-F292 PolarHBondContact O-N 3.28Å; F292-V294 HydrophobicContact CD1-CG2 4.34Å; F292-V294 HydrophobicContact CE1-CG2 3.37Å; F292-V294 HydrophobicContact CE2-CG2 4.1Å; F292-V294 HydrophobicContact CZ-CG2 3.23Å; F292-M307 HydrophobicContact CE2-CG 3.77Å; F292-M307 HydrophobicContact CE2-SD 4.17Å; F292-M307 HydrophobicContact CZ-CG 4.17Å; F292-M307 HydrophobicContact CZ-SD 4.35Å; F292-S308 CarbonylContact C-O 3.55Å; F292-S308 WeakPolarHBondContact CA-O 3.33Å; F292-S308 WeakPolarHBondContact CD2-O 3.17Å; F292-Y309 HydrophobicContact CB-CD2 4.45Å; F292-Y309 HydrophobicContact CD2-CD2 4.07Å
293	T	96.6	Very high	92.4	Very high	24 Å²	24	63 Å²	63	15%	0.147	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	129.2	179.2	-63.6	0	0	0	0	109.6	V283 V284 H291 M307 S308	V283-T293 WeakPolarHBondContact O-CA 3.44Å; V284-T293 HydrophobicContact CG2-CG2 4.04Å; H291-T293 PolarHBondContact NE2-OG1 3.2Å; T293-M307 CarbonylContact O-C 3.49Å; T293-M307 WeakPolarHBondContact O-CA 3.33Å; T293-S308 PolarHBondContact N-O 3.12Å; T293-S308 PolarHBondContact O-N 2.76Å
294	V	97.1	Very high	92.2	Very high	38 Å²	38	61.7 Å²	61.7	23%	0.23	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	130.1	167.6	176	0	0	0	0	107.7	S282 V283 F292 M305 M306 M307	S282-V294 CarbonylContact C-O 3.54Å; S282-V294 WeakPolarHBondContact CA-O 3.37Å; S282-V294 WeakPolarHBondContact CB-O 3.3Å; V283-V294 PolarHBondContact N-O 2.91Å; V283-V294 PolarHBondContact O-N 3.36Å; F292-V294 HydrophobicContact CD1-CG2 4.34Å; F292-V294 HydrophobicContact CE1-CG2 3.37Å; F292-V294 HydrophobicContact CE2-CG2 4.1Å; F292-V294 HydrophobicContact CZ-CG2 3.23Å; V294-M305 HydrophobicContact CG1-CE 4.32Å; V294-M306 CarbonylContact C-O 3.52Å; V294-M306 WeakPolarHBondContact CA-O 3.23Å; V294-M307 HydrophobicContact CG2-CG 4.27Å
295	A	95.9	Very high	92.1	Very high	8 Å²	8	65.6 Å²	65.6	7%	0.066	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	139.7	178.7	0	0	0	0	0	110.7	T281 M305 M306	T281-A295 CarbonylContact O-C 3.53Å; T281-A295 WeakPolarHBondContact O-CA 3.21Å; A295-M305 CarbonylContact O-C 3.57Å; A295-M305 WeakPolarHBondContact O-CA 3.18Å; A295-M306 HydrophobicContact CB-CB 4.44Å; A295-M306 PolarHBondContact N-O 3.43Å; A295-M306 PolarHBondContact O-N 2.83Å
296	V	96	Very high	92.1	Very high	56 Å²	56	63.1 Å²	63.1	34%	0.339	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	116.3	172.4	179.2	0	0	0	0	107	N280 T281 L298 M305	N280-V296 CarbonylContact C-O 3.42Å; N280-V296 WeakPolarHBondContact CA-O 3.42Å; N280-V296 PolarHBondContact OD1-O 2.85Å; T281-V296 PolarHBondContact N-O 2.93Å; T281-V296 PolarHBondContact O-N 2.99Å; V296-L298 HydrophobicContact CG1-CD2 4.31Å; V296-L298 HydrophobicContact CG1-CG 4.38Å; V296-M305 HydrophobicContact CG2-CG 4.17Å
297	Q	93.8	Very high	92.2	Very high	29 Å²	29	64.5 Å²	64.5	14%	0.136	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	122.2	174.7	-173.7	176	-57.1	0	0	109.2	M279 N280 H302 T303 F304	M279-Q297 CarbonylContact O-C 3.52Å; M279-Q297 WeakPolarHBondContact O-CA 3.41Å; N280-Q297 HydrophobicContact CB-CB 4.42Å; N280-Q297 HydrophobicContact CB-CG 4.31Å; Q297-H302 PolarHBondContact NE2-O 2.94Å; Q297-T303 CarbonylContact O-C 3.54Å; Q297-T303 VanDerWaalsContact O-CA 3.24Å; Q297-T303 WeakPolarHBondContact O-CA 3.46Å; Q297-F304 HydrophobicContact CB-CD1 4.1Å; Q297-F304 HydrophobicContact CB-CE1 3.76Å; Q297-F304 HydrophobicContact CB-CE2 4.23Å; Q297-F304 HydrophobicContact CB-CG 4.49Å; Q297-F304 HydrophobicContact CB-CZ 3.82Å; Q297-F304 VanDerWaalsContact CD-CE1 3.49Å; Q297-F304 HydrophobicContact CG-CE1 4.14Å; Q297-F304 HydrophobicContact CG-CZ 4.48Å; Q297-F304 PolarHBondContact N-O 2.81Å; Q297-F304 PolarHBondContact O-N 2.66Å
298	L	94.1	Very high	92.3	Very high	103 Å²	103	64.2 Å²	64.2	54%	0.539	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	113.2	172	-58.5	177.8	0	0	0	107.7	S278 M279 V296 T303	S278-L298 CarbonylContact C-O 3.59Å; S278-L298 VanDerWaalsContact CA-O 3.31Å; S278-L298 WeakPolarHBondContact CA-O 3.33Å; M279-L298 PolarHBondContact N-O 2.92Å; M279-L298 PolarHBondContact O-N 3.06Å; V296-L298 HydrophobicContact CG1-CD2 4.31Å; V296-L298 HydrophobicContact CG1-CG 4.38Å; L298-T303 HydrophobicContact CD2-CG2 3.83Å
299	G	88.9	Confident	92.6	Very high	10 Å²	10	60.6 Å²	60.6	10%	0.103	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.1	164.8	-176.3	0	0	0	0	0	113.3	S277 P301 H302 T303	S277-G299 WeakPolarHBondContact O-CA 3.29Å; G299-P301 CarbonylContact O-C 3.5Å; G299-P301 VanDerWaalsContact O-C 3.27Å; G299-H302 PolarHBondContact N-O 2.85Å; G299-H302 CarbonylContact O-C 3.56Å; G299-H302 PolarHBondContact O-N 2.97Å; G299-T303 PolarHBondContact N-OG1 3.45Å; G299-T303 VanDerWaalsContact N-OG1 3.08Å; G299-T303 PolarHBondContact O-N 3.4Å; G299-T303 PolarHBondContact O-OG1 3.2Å
300	I	84.8	Confident	92.8	Very high	153 Å²	153	59.3 Å²	59.3	79%	0.785	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.7	120.2	179.3	-55.6	171.9	0	0	0	107.3	S277	S277-I300 PolarHBondContact O-N 3.01Å; S277-I300 VanDerWaalsContact O-N 3.16Å
301	P	76.2	Confident	92.8	Very high	78 Å²	78	62.8 Å²	62.8	51%	0.506	32%	0.319	S	S	.	.	S	Bend	cis	-84	-23.2	4.6	32.2	-33.7	0	0	0	114.1	G299 T303 F330	G299-P301 CarbonylContact O-C 3.5Å; G299-P301 VanDerWaalsContact O-C 3.27Å; P301-T303 PolarHBondContact O-N 3.39Å; P301-F330 HydrophobicContact CB-CE2 4.06Å; P301-F330 HydrophobicContact CB-CZ 4.26Å; P301-F330 WeakPolarHBondContact O-CE2 3.16Å
302	H	80.1	Confident	92.7	Very high	106 Å²	106	62.4 Å²	62.4	49%	0.491	32%	0.316	S	S	.	.			trans	-89.9	106.4	-166.1	-59.2	-62.8	0	0	0	114.2	Q297 G299 F304 F330	Q297-H302 PolarHBondContact NE2-O 2.94Å; G299-H302 PolarHBondContact N-O 2.85Å; G299-H302 CarbonylContact O-C 3.56Å; G299-H302 PolarHBondContact O-N 2.97Å; H302-F304 HydrophobicContact CB-CD1 4.37Å; H302-F330 AromaticContact ND1-CD2 3.98Å
303	T	91.8	Very high	92.4	Very high	56 Å²	56	62.6 Å²	62.6	34%	0.344	32%	0.317	S	S	.	.			trans	-110.6	121.2	165.5	-67	0	0	0	0	110.4	Q297 L298 G299 P301 G328 F329	Q297-T303 CarbonylContact O-C 3.54Å; Q297-T303 VanDerWaalsContact O-CA 3.24Å; Q297-T303 WeakPolarHBondContact O-CA 3.46Å; L298-T303 HydrophobicContact CD2-CG2 3.83Å; G299-T303 PolarHBondContact N-OG1 3.45Å; G299-T303 VanDerWaalsContact N-OG1 3.08Å; G299-T303 PolarHBondContact O-N 3.4Å; G299-T303 PolarHBondContact O-OG1 3.2Å; P301-T303 PolarHBondContact O-N 3.39Å; T303-G328 VanDerWaalsContact O-CA 3.26Å; T303-G328 WeakPolarHBondContact O-CA 3.3Å; T303-F329 PolarHBondContact O-N 2.94Å
304	F	93.4	Very high	91.9	Very high	31 Å²	31	68.6 Å²	68.6	14%	0.136	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	157.3	-179.1	67.1	-95	0	0	0	113.2	Q297 H302 M306 K326 S327	Q297-F304 HydrophobicContact CB-CD1 4.1Å; Q297-F304 HydrophobicContact CB-CE1 3.76Å; Q297-F304 HydrophobicContact CB-CE2 4.23Å; Q297-F304 HydrophobicContact CB-CG 4.49Å; Q297-F304 HydrophobicContact CB-CZ 3.82Å; Q297-F304 VanDerWaalsContact CD-CE1 3.49Å; Q297-F304 HydrophobicContact CG-CE1 4.14Å; Q297-F304 HydrophobicContact CG-CZ 4.48Å; Q297-F304 PolarHBondContact N-O 2.81Å; Q297-F304 PolarHBondContact O-N 2.66Å; H302-F304 HydrophobicContact CB-CD1 4.37Å; F304-M306 HydrophobicContact CD2-CB 4.1Å; F304-M306 HydrophobicContact CE2-CB 4.02Å; F304-K326 HydrophobicContact CB-CG 4.36Å; F304-K326 HydrophobicContact CD2-CD 4.13Å; F304-K326 VanDerWaalsContact CD2-CE 3.44Å; F304-K326 HydrophobicContact CD2-CG 3.83Å; F304-K326 HydrophobicContact CE2-CD 4.35Å; F304-K326 HydrophobicContact CE2-CG 4.44Å; F304-K326 HydrophobicContact CG-CD 4.43Å; F304-K326 VanDerWaalsContact CG-CE 3.41Å; F304-K326 HydrophobicContact CG-CG 4.21Å; F304-S327 CarbonylContact C-O 3.48Å; F304-S327 WeakPolarHBondContact CA-O 3.35Å
305	M	95	Very high	91.1	Very high	109 Å²	109	71.3 Å²	71.3	54%	0.537	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	136.8	165.1	-174.2	174.5	-166	0	0	109.2	V294 A295 V296 K326 S327	V294-M305 HydrophobicContact CG1-CE 4.32Å; A295-M305 CarbonylContact O-C 3.57Å; A295-M305 WeakPolarHBondContact O-CA 3.18Å; V296-M305 HydrophobicContact CG2-CG 4.17Å; M305-K326 CarbonylContact O-C 3.27Å; M305-K326 WeakPolarHBondContact O-CA 3.43Å; M305-S327 PolarHBondContact N-O 3.49Å; M305-S327 PolarHBondContact O-N 3.19Å; M305-S327 VanDerWaalsContact O-O 3.14Å
306	M	94.8	Very high	90.3	Very high	51 Å²	51	80.1 Å²	80.1	25%	0.251	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	133.7	178.6	179.8	-179.2	177.2	0	0	109.8	V294 A295 F304 V325 K326	V294-M306 CarbonylContact C-O 3.52Å; V294-M306 WeakPolarHBondContact CA-O 3.23Å; A295-M306 HydrophobicContact CB-CB 4.44Å; A295-M306 PolarHBondContact N-O 3.43Å; A295-M306 PolarHBondContact O-N 2.83Å; F304-M306 HydrophobicContact CD2-CB 4.1Å; F304-M306 HydrophobicContact CE2-CB 4.02Å; M306-V325 CarbonylContact C-O 3.58Å; M306-V325 WeakPolarHBondContact CA-O 3.11Å; M306-K326 HydrophobicContact CB-CB 4.5Å; M306-K326 HydrophobicContact CB-CG 4.38Å; M306-K326 HydrophobicContact CG-CB 4.42Å
307	M	96.8	Very high	89.4	Confident	101 Å²	101	80.5 Å²	80.5	50%	0.498	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	123.7	170.8	-176.7	173.6	67.5	0	0	108.3	F292 T293 V294 S324 V325	F292-M307 HydrophobicContact CE2-CG 3.77Å; F292-M307 HydrophobicContact CE2-SD 4.17Å; F292-M307 HydrophobicContact CZ-CG 4.17Å; F292-M307 HydrophobicContact CZ-SD 4.35Å; T293-M307 CarbonylContact O-C 3.49Å; T293-M307 WeakPolarHBondContact O-CA 3.33Å; V294-M307 HydrophobicContact CG2-CG 4.27Å; M307-S324 CarbonylContact O-C 3.16Å; M307-S324 WeakPolarHBondContact O-CA 3.42Å; M307-V325 PolarHBondContact N-O 3.34Å; M307-V325 PolarHBondContact O-N 2.87Å
308	S	96.3	Very high	89	Confident	23 Å²	23	84.1 Å²	84.1	16%	0.161	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	129.3	-179.3	-179	0	0	0	0	109.9	F292 T293 G323	F292-S308 CarbonylContact C-O 3.55Å; F292-S308 WeakPolarHBondContact CA-O 3.33Å; F292-S308 WeakPolarHBondContact CD2-O 3.17Å; T293-S308 PolarHBondContact N-O 3.12Å; T293-S308 PolarHBondContact O-N 2.76Å; S308-G323 WeakPolarHBondContact CA-O 3.33Å
309	Y	96.4	Very high	88.8	Confident	108 Å²	108	80.5 Å²	80.5	42%	0.424	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	128.3	175.2	-177.6	-100.4	0	0	0	109.6	F292 Y311 G323	F292-Y309 HydrophobicContact CB-CD2 4.45Å; F292-Y309 HydrophobicContact CD2-CD2 4.07Å; Y309-Y311 HydrophobicContact CE1-CD2 4.5Å; Y309-G323 PolarHBondContact N-O 3.48Å; Y309-G323 PolarHBondContact O-N 3.11Å
310	Q	95	Very high	89	Confident	22 Å²	22	83.2 Å²	83.2	10%	0.103	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	121.2	176.1	171.6	176.8	16	0	0	109.3	S290 H291 K320 I321 K322	S290-Q310 CarbonylContact C-O 3.59Å; S290-Q310 VanDerWaalsContact CA-O 3.3Å; S290-Q310 WeakPolarHBondContact CA-O 3.35Å; H291-Q310 HydrophobicContact CB-CB 4.12Å; H291-Q310 PolarHBondContact N-O 3.22Å; H291-Q310 PolarHBondContact O-N 3.12Å; Q310-K320 HydrophobicContact CG-CB 4.19Å; Q310-I321 CarbonylContact C-O 3.57Å; Q310-I321 WeakPolarHBondContact CA-O 2.96Å; Q310-K322 HydrophobicContact CB-CG 4.01Å; Q310-K322 HydrophobicContact CG-CG 3.75Å
311	Y	94.7	Very high	89.4	Confident	95 Å²	95	80 Å²	80	37%	0.373	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	132.5	173	-167.6	-102.1	0	0	0	109.8	Y309 F313 K320 I321	Y309-Y311 HydrophobicContact CE1-CD2 4.5Å; Y311-F313 HydrophobicContact CD1-CD1 4.43Å; Y311-F313 AromaticContact CD1-CD2 3.86Å; Y311-F313 HydrophobicContact CD1-CD2 3.86Å; Y311-F313 HydrophobicContact CD1-CE1 4.18Å; Y311-F313 AromaticContact CD1-CE2 3.57Å; Y311-F313 HydrophobicContact CD1-CE2 3.57Å; Y311-F313 HydrophobicContact CD1-CG 4.28Å; Y311-F313 AromaticContact CD1-CZ 3.75Å; Y311-F313 HydrophobicContact CD1-CZ 3.75Å; Y311-F313 AromaticContact CE1-CD1 3.96Å; Y311-F313 HydrophobicContact CE1-CD1 3.96Å; Y311-F313 HydrophobicContact CE1-CD2 4.2Å; Y311-F313 AromaticContact CE1-CE1 3.79Å; Y311-F313 HydrophobicContact CE1-CE1 3.79Å; Y311-F313 HydrophobicContact CE1-CE2 4.03Å; Y311-F313 HydrophobicContact CE1-CG 4.16Å; Y311-F313 AromaticContact CE1-CZ 3.82Å; Y311-F313 HydrophobicContact CE1-CZ 3.82Å; Y311-K320 CarbonylContact O-C 3.5Å; Y311-K320 WeakPolarHBondContact O-CA 3.32Å; Y311-I321 PolarHBondContact N-O 3.06Å; Y311-I321 PolarHBondContact O-N 3.29Å
312	K	93.1	Very high	90.3	Very high	39 Å²	39	78.9 Å²	78.9	17%	0.17	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	110.9	-179.5	-61.6	172.6	-176.1	166.6	0	108.1	D286 T287 S289 K320	D286-K312 IonicContact OD1-NZ 3.22Å; D286-K312 PolarHBondContact OD1-NZ 2.83Å; D286-K312 IonicContact OD2-NZ 3.11Å; D286-K312 PolarHBondContact OD2-NZ 3.38Å; T287-K312 PolarHBondContact O-NZ 3.44Å; S289-K312 PolarHBondContact O-N 2.96Å; K312-K320 HydrophobicContact CG-CD 4.24Å; K312-K320 HydrophobicContact CG-CG 4.24Å
313	F	90.6	Very high	91.1	Very high	74 Å²	74	75.3 Å²	75.3	33%	0.325	37%	0.367	S	S	.	.			trans	-71.9	143.8	171	-69.6	-92.7	0	0	0	109.7	Y311 D315 T319 I321	Y311-F313 HydrophobicContact CD1-CD1 4.43Å; Y311-F313 AromaticContact CD1-CD2 3.86Å; Y311-F313 HydrophobicContact CD1-CD2 3.86Å; Y311-F313 HydrophobicContact CD1-CE1 4.18Å; Y311-F313 AromaticContact CD1-CE2 3.57Å; Y311-F313 HydrophobicContact CD1-CE2 3.57Å; Y311-F313 HydrophobicContact CD1-CG 4.28Å; Y311-F313 AromaticContact CD1-CZ 3.75Å; Y311-F313 HydrophobicContact CD1-CZ 3.75Å; Y311-F313 AromaticContact CE1-CD1 3.96Å; Y311-F313 HydrophobicContact CE1-CD1 3.96Å; Y311-F313 HydrophobicContact CE1-CD2 4.2Å; Y311-F313 AromaticContact CE1-CE1 3.79Å; Y311-F313 HydrophobicContact CE1-CE1 3.79Å; Y311-F313 HydrophobicContact CE1-CE2 4.03Å; Y311-F313 HydrophobicContact CE1-CG 4.16Å; Y311-F313 AromaticContact CE1-CZ 3.82Å; Y311-F313 HydrophobicContact CE1-CZ 3.82Å; F313-D315 PolarHBondContact O-N 3.18Å; F313-T319 WeakPolarHBondContact CB-O 2.88Å; F313-T319 HydrophobicContact CD2-CG2 4.26Å; F313-T319 PolarHBondContact N-O 2.84Å; F313-I321 HydrophobicContact CE2-CD1 3.54Å; F313-I321 HydrophobicContact CE2-CG1 3.83Å; F313-I321 HydrophobicContact CZ-CD1 4.02Å
314	Q	84.3	Confident	91.3	Very high	151 Å²	151	73 Å²	73	71%	0.706	35%	0.354	S	S	*	.			trans	-94	30.5	176.4	-64	-169.4	6.2	0	0	112
315	D	81.8	Confident	91.4	Very high	94 Å²	94	74.4 Å²	74.4	50%	0.503	36%	0.364	S	S	.	.	S	Bend	trans	-79	162.7	175.6	-54.4	-25.5	0	0	0	110.5	F313 D317 Q318	F313-D315 PolarHBondContact O-N 3.18Å; D315-D317 PolarHBondContact O-N 2.8Å; D315-D317 VanDerWaalsContact O-N 3.11Å; D315-Q318 PolarHBondContact O-N 3.49Å
316	E	78.4	Confident	91.3	Very high	193 Å²	193	73.2 Å²	73.2	90%	0.902	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-34.3	175.2	-67.2	-172.2	159.1	0	0	112.7	Q318	E316-Q318 VanDerWaalsContact C-N 3.33Å; E316-Q318 PolarHBondContact O-N 3.28Å
317	D	76.6	Confident	91.3	Very high	64 Å²	64	73.4 Å²	73.4	34%	0.342	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	0.3	-178.7	-69.5	-20.9	0	0	0	114.6	D315 T319 R340 K341	D315-D317 PolarHBondContact O-N 2.8Å; D315-D317 VanDerWaalsContact O-N 3.11Å; D317-T319 PolarHBondContact O-N 3.49Å; D317-T319 VanDerWaalsContact O-N 3.12Å; D317-R340 HydrophobicContact CB-CG 4.21Å; D317-R340 IonicContact OD2-CZ 2.65Å; D317-R340 IonicContact OD2-NE 3.45Å; D317-R340 PolarHBondContact OD2-NE 2.77Å; D317-R340 IonicContact OD2-NH2 3.5Å; D317-R340 PolarHBondContact OD2-NH2 3.12Å; D317-K341 WeakPolarHBondContact O-CB 3.34Å; D317-K341 PolarHBondContact O-N 2.96Å
318	Q	85.6	Confident	90.9	Very high	105 Å²	105	69.9 Å²	69.9	49%	0.491	35%	0.352	S	S	.	.			trans	45.5	44.8	178.3	-61.6	-173.2	-14.9	0	0	114	D315 E316 K320	D315-Q318 PolarHBondContact O-N 3.49Å; E316-Q318 VanDerWaalsContact C-N 3.33Å; E316-Q318 PolarHBondContact O-N 3.28Å; Q318-K320 WeakPolarHBondContact O-CG 3.38Å
319	T	89.6	Confident	90.4	Very high	27 Å²	27	76.8 Å²	76.8	17%	0.166	38%	0.38	C	S	.	.			trans	-62.2	138.3	-179.7	-55.3	0	0	0	0	110.7	F313 D317 E339	F313-T319 WeakPolarHBondContact CB-O 2.88Å; F313-T319 HydrophobicContact CD2-CG2 4.26Å; F313-T319 PolarHBondContact N-O 2.84Å; D317-T319 PolarHBondContact O-N 3.49Å; D317-T319 VanDerWaalsContact O-N 3.12Å; T319-E339 CarbonylContact C-O 3.55Å; T319-E339 WeakPolarHBondContact CA-O 3.48Å
320	K	93.3	Very high	89.6	Confident	68 Å²	68	77 Å²	77	30%	0.296	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	125.6	177.1	-47.6	178.8	-171.8	168.2	0	110.2	Q310 Y311 K312 Q318 A338 E339	Q310-K320 HydrophobicContact CG-CB 4.19Å; Y311-K320 CarbonylContact O-C 3.5Å; Y311-K320 WeakPolarHBondContact O-CA 3.32Å; K312-K320 HydrophobicContact CG-CD 4.24Å; K312-K320 HydrophobicContact CG-CG 4.24Å; Q318-K320 WeakPolarHBondContact O-CG 3.38Å; K320-A338 CarbonylContact O-C 3.53Å; K320-A338 WeakPolarHBondContact O-CA 3.34Å; K320-E339 HydrophobicContact CB-CB 4.49Å; K320-E339 PolarHBondContact N-O 3.48Å; K320-E339 PolarHBondContact O-N 2.88Å
321	I	94.7	Very high	89.2	Confident	84 Å²	84	77.3 Å²	77.3	43%	0.431	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	134.3	174	-64.2	178.2	0	0	0	108	Q310 Y311 F313	Q310-I321 CarbonylContact C-O 3.57Å; Q310-I321 WeakPolarHBondContact CA-O 2.96Å; Y311-I321 PolarHBondContact N-O 3.06Å; Y311-I321 PolarHBondContact O-N 3.29Å; F313-I321 HydrophobicContact CE2-CD1 3.54Å; F313-I321 HydrophobicContact CE2-CG1 3.83Å; F313-I321 HydrophobicContact CZ-CD1 4.02Å
322	K	94	Very high	89.1	Confident	55 Å²	55	75.8 Å²	75.8	24%	0.239	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	136.2	-178.6	-64.6	-179	175.3	-178.3	0	109.4	Q310 Y336 G337 E339	Q310-K322 HydrophobicContact CB-CG 4.01Å; Q310-K322 HydrophobicContact CG-CG 3.75Å; K322-Y336 CarbonylContact O-C 3.55Å; K322-Y336 VanDerWaalsContact O-CA 3.27Å; K322-Y336 WeakPolarHBondContact O-CA 3.38Å; K322-G337 PolarHBondContact N-O 3.49Å; K322-G337 PolarHBondContact O-N 3.37Å; K322-E339 WeakPolarHBondContact CE-OE2 3.34Å; K322-E339 IonicContact NZ-OE1 3.93Å; K322-E339 PolarHBondContact NZ-OE1 3.25Å; K322-E339 IonicContact NZ-OE2 2.95Å; K322-E339 PolarHBondContact NZ-OE2 3.28Å
323	G	96.7	Very high	89.1	Confident	31 Å²	31	74.7 Å²	74.7	32%	0.32	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	129.4	165.8	0	0	0	0	0	108.8	S308 Y309 E335	S308-G323 WeakPolarHBondContact CA-O 3.33Å; Y309-G323 PolarHBondContact N-O 3.48Å; Y309-G323 PolarHBondContact O-N 3.11Å; G323-E335 CarbonylContact C-O 3.54Å; G323-E335 WeakPolarHBondContact CA-O 3.44Å
324	S	95.6	Very high	89.3	Confident	8 Å²	8	74.1 Å²	74.1	6%	0.056	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	144.8	178.3	96.4	0	0	0	0	110.1	M307 V334 E335	M307-S324 CarbonylContact O-C 3.16Å; M307-S324 WeakPolarHBondContact O-CA 3.42Å; S324-V334 CarbonylContact O-C 3.55Å; S324-V334 WeakPolarHBondContact O-CA 3.43Å; S324-E335 PolarHBondContact N-O 3.2Å; S324-E335 PolarHBondContact O-N 3.21Å; S324-E335 WeakPolarHBondContact OG-CB 3.39Å; S324-E335 PolarHBondContact OG-OE2 2.98Å
325	V	95.9	Very high	89.8	Confident	60 Å²	60	69.4 Å²	69.4	36%	0.364	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	124.8	173.5	-178.9	0	0	0	0	106.8	M306 M307 T332 V334	M306-V325 CarbonylContact C-O 3.58Å; M306-V325 WeakPolarHBondContact CA-O 3.11Å; M307-V325 PolarHBondContact N-O 3.34Å; M307-V325 PolarHBondContact O-N 2.87Å; V325-T332 HydrophobicContact CG1-CG2 4.38Å; V325-V334 HydrophobicContact CG2-CG1 4.48Å; V325-V334 HydrophobicContact CG2-CG2 4.41Å
326	K	93.8	Very high	90.5	Very high	84 Å²	84	68.9 Å²	68.9	37%	0.365	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	115.1	176.6	-177.3	-180	177.7	-176.5	0	108.2	F304 M305 M306 T332 V333	F304-K326 HydrophobicContact CB-CG 4.36Å; F304-K326 HydrophobicContact CD2-CD 4.13Å; F304-K326 VanDerWaalsContact CD2-CE 3.44Å; F304-K326 HydrophobicContact CD2-CG 3.83Å; F304-K326 HydrophobicContact CE2-CD 4.35Å; F304-K326 HydrophobicContact CE2-CG 4.44Å; F304-K326 HydrophobicContact CG-CD 4.43Å; F304-K326 VanDerWaalsContact CG-CE 3.41Å; F304-K326 HydrophobicContact CG-CG 4.21Å; M305-K326 CarbonylContact O-C 3.27Å; M305-K326 WeakPolarHBondContact O-CA 3.43Å; M306-K326 HydrophobicContact CB-CB 4.5Å; M306-K326 HydrophobicContact CB-CG 4.38Å; M306-K326 HydrophobicContact CG-CB 4.42Å; K326-T332 CarbonylContact O-C 3.22Å; K326-T332 WeakPolarHBondContact O-CA 3.35Å; K326-V333 PolarHBondContact N-O 3.24Å; K326-V333 PolarHBondContact O-N 3.16Å
327	S	94.4	Very high	91.3	Very high	55 Å²	55	60.3 Å²	60.3	39%	0.385	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	128.5	178.6	-168.8	0	0	0	0	109.9	F304 M305 T332	F304-S327 CarbonylContact C-O 3.48Å; F304-S327 WeakPolarHBondContact CA-O 3.35Å; M305-S327 PolarHBondContact N-O 3.49Å; M305-S327 PolarHBondContact O-N 3.19Å; M305-S327 VanDerWaalsContact O-O 3.14Å; S327-T332 PolarHBondContact OG-OG1 3.02Å; S327-T332 VanDerWaalsContact OG-OG1 3.07Å
328	G	89.4	Confident	92.1	Very high	27 Å²	27	59.5 Å²	59.5	28%	0.278	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	-171.2	-179	0	0	0	0	0	112.8	T303 F330 G331	T303-G328 VanDerWaalsContact O-CA 3.26Å; T303-G328 WeakPolarHBondContact O-CA 3.3Å; G328-F330 PolarHBondContact O-N 3.3Å; G328-F330 VanDerWaalsContact O-N 3.15Å; G328-G331 PolarHBondContact N-O 2.94Å; G328-G331 PolarHBondContact O-N 3.05Å
329	F	84.4	Confident	92.4	Very high	168 Å²	168	55.5 Å²	55.5	74%	0.737	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-30.8	-176.2	-172.5	-100.6	0	0	0	113.3	T303	T303-F329 PolarHBondContact O-N 2.94Å
330	F	79.6	Confident	92.4	Very high	113 Å²	113	57.9 Å²	57.9	50%	0.496	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	8.8	179.6	-70.1	-74.7	0	0	0	114.1	P301 H302 G328 P357	P301-F330 HydrophobicContact CB-CE2 4.06Å; P301-F330 HydrophobicContact CB-CZ 4.26Å; P301-F330 WeakPolarHBondContact O-CE2 3.16Å; H302-F330 AromaticContact ND1-CD2 3.98Å; G328-F330 PolarHBondContact O-N 3.3Å; G328-F330 VanDerWaalsContact O-N 3.15Å; F330-P357 VanDerWaalsContact O-CD 3.25Å; F330-P357 WeakPolarHBondContact O-CD 3.5Å
331	G	87.1	Confident	92.2	Very high	28 Å²	28	57.6 Å²	57.6	29%	0.289	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	118	-171.2	177	0	0	0	0	0	113.8	G328 V356	G328-G331 PolarHBondContact N-O 2.94Å; G328-G331 PolarHBondContact O-N 3.05Å; G331-V356 CarbonylContact C-O 3.5Å; G331-V356 WeakPolarHBondContact CA-O 3.38Å
332	T	91.9	Very high	91.7	Very high	63 Å²	63	56.9 Å²	56.9	39%	0.387	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	128.7	-174.3	-53.4	0	0	0	0	110	V325 K326 S327 G355 V356	V325-T332 HydrophobicContact CG1-CG2 4.38Å; K326-T332 CarbonylContact O-C 3.22Å; K326-T332 WeakPolarHBondContact O-CA 3.35Å; S327-T332 PolarHBondContact OG-OG1 3.02Å; S327-T332 VanDerWaalsContact OG-OG1 3.07Å; T332-G355 CarbonylContact O-C 3.51Å; T332-G355 WeakPolarHBondContact O-CA 3.45Å; T332-V356 PolarHBondContact N-O 3.05Å; T332-V356 PolarHBondContact O-N 3.44Å
333	V	92.9	Very high	91.2	Very high	17 Å²	17	57.3 Å²	57.3	10%	0.103	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	127	176.5	-177	0	0	0	0	109.2	K326 E335 S353	K326-V333 PolarHBondContact N-O 3.24Å; K326-V333 PolarHBondContact O-N 3.16Å; V333-E335 HydrophobicContact CG1-CG 4.18Å; V333-S353 VanDerWaalsContact CG1-OG 3.31Å; V333-S353 WeakPolarHBondContact CG1-OG 3.45Å
334	V	95.2	Very high	90.3	Very high	62 Å²	62	66 Å²	66	38%	0.376	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	126.6	173.1	-179.6	0	0	0	0	107.6	S324 V325 S353 V354	S324-V334 CarbonylContact O-C 3.55Å; S324-V334 WeakPolarHBondContact O-CA 3.43Å; V325-V334 HydrophobicContact CG2-CG1 4.48Å; V325-V334 HydrophobicContact CG2-CG2 4.41Å; V334-S353 WeakPolarHBondContact O-CA 3.48Å; V334-V354 PolarHBondContact N-O 3.44Å; V334-V354 PolarHBondContact O-N 3.11Å
335	E	95	Very high	89.7	Confident	51 Å²	51	71.9 Å²	71.9	24%	0.238	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	139.8	173.2	-49.7	-178.7	135.2	0	0	110	G323 S324 V333 T351 V352 K363	G323-E335 CarbonylContact C-O 3.54Å; G323-E335 WeakPolarHBondContact CA-O 3.44Å; S324-E335 PolarHBondContact N-O 3.2Å; S324-E335 PolarHBondContact O-N 3.21Å; S324-E335 WeakPolarHBondContact OG-CB 3.39Å; S324-E335 PolarHBondContact OG-OE2 2.98Å; V333-E335 HydrophobicContact CG1-CG 4.18Å; E335-T351 HydrophobicContact CB-CG2 3.97Å; E335-V352 CarbonylContact C-O 3.55Å; E335-V352 VanDerWaalsContact CA-O 3.23Å; E335-V352 WeakPolarHBondContact CA-O 3.35Å; E335-K363 IonicContact OE1-NZ 2.81Å; E335-K363 PolarHBondContact OE1-NZ 3.47Å
336	Y	96.1	Very high	89.3	Confident	83 Å²	83	70 Å²	70	33%	0.325	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	146.9	170.5	60.8	-83.1	0	0	0	109.5	K322 T351 V352 V354 I388 T392	K322-Y336 CarbonylContact O-C 3.55Å; K322-Y336 VanDerWaalsContact O-CA 3.27Å; K322-Y336 WeakPolarHBondContact O-CA 3.38Å; Y336-T351 CarbonylContact O-C 3.52Å; Y336-T351 WeakPolarHBondContact O-CA 3.48Å; Y336-V352 HydrophobicContact CE1-CB 4.03Å; Y336-V352 HydrophobicContact CE1-CG1 4.11Å; Y336-V352 HydrophobicContact CE2-CB 4.07Å; Y336-V352 HydrophobicContact CE2-CG2 4.31Å; Y336-V352 PolarHBondContact N-O 3.44Å; Y336-V352 PolarHBondContact O-N 2.98Å; Y336-V354 HydrophobicContact CE1-CG2 4.31Å; Y336-I388 WeakPolarHBondContact OH-CG2 3.42Å; Y336-T392 HydrophobicContact CE2-CG2 3.38Å; Y336-T392 WeakPolarHBondContact OH-CG2 3.3Å
337	G	94.9	Very high	89.2	Confident	14 Å²	14	68 Å²	68	14%	0.144	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.8	174	-173.5	0	0	0	0	0	113.6	K322 A350	K322-G337 PolarHBondContact N-O 3.49Å; K322-G337 PolarHBondContact O-N 3.37Å; G337-A350 CarbonylContact C-O 3.54Å; G337-A350 WeakPolarHBondContact CA-O 3.44Å
338	A	93.8	Very high	89.2	Confident	47 Å²	47	67.6 Å²	67.6	39%	0.388	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	143.9	175.9	0	0	0	0	0	110.2	K320 G349 A350	K320-A338 CarbonylContact O-C 3.53Å; K320-A338 WeakPolarHBondContact O-CA 3.34Å; A338-G349 CarbonylContact O-C 3.6Å; A338-G349 WeakPolarHBondContact O-CA 3.29Å; A338-A350 PolarHBondContact N-O 2.86Å; A338-A350 PolarHBondContact O-N 2.89Å
339	E	92.6	Very high	89.4	Confident	20 Å²	20	66.4 Å²	66.4	9%	0.093	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	134	169	-66.4	-177.9	163.3	0	0	108.6	T319 K320 K322 V347 V348	T319-E339 CarbonylContact C-O 3.55Å; T319-E339 WeakPolarHBondContact CA-O 3.48Å; K320-E339 HydrophobicContact CB-CB 4.49Å; K320-E339 PolarHBondContact N-O 3.48Å; K320-E339 PolarHBondContact O-N 2.88Å; K322-E339 WeakPolarHBondContact CE-OE2 3.34Å; K322-E339 IonicContact NZ-OE1 3.93Å; K322-E339 PolarHBondContact NZ-OE1 3.25Å; K322-E339 IonicContact NZ-OE2 2.95Å; K322-E339 PolarHBondContact NZ-OE2 3.28Å; E339-V347 HydrophobicContact CB-CG1 4.4Å; E339-V348 CarbonylContact C-O 3.5Å; E339-V348 WeakPolarHBondContact CA-O 3.22Å
340	R	90.1	Very high	89.9	Confident	78 Å²	78	60 Å²	60	29%	0.294	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	139	177.4	-170.8	171.2	-179.7	170.9	5.3	110.3	D317 V348 Y399	D317-R340 HydrophobicContact CB-CG 4.21Å; D317-R340 IonicContact OD2-CZ 2.65Å; D317-R340 IonicContact OD2-NE 3.45Å; D317-R340 PolarHBondContact OD2-NE 2.77Å; D317-R340 IonicContact OD2-NH2 3.5Å; D317-R340 PolarHBondContact OD2-NH2 3.12Å; R340-V348 PolarHBondContact N-O 3.13Å; R340-V348 PolarHBondContact O-N 3.41Å; R340-Y399 WeakPolarHBondContact CD-OH 3.39Å; R340-Y399 PolarHBondContact NE-OH 3.09Å; R340-Y399 PolarHBondContact NH1-OH 3.05Å
341	K	89.2	Confident	90.7	Very high	61 Å²	61	55.7 Å²	55.7	27%	0.265	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	122.2	171.9	-167.3	177.5	179.2	-176	0	108.1	D317 S343 V347	D317-K341 WeakPolarHBondContact O-CB 3.34Å; D317-K341 PolarHBondContact O-N 2.96Å; K341-S343 VanDerWaalsContact CE-O 3.3Å; K341-S343 WeakPolarHBondContact CE-O 3.39Å; K341-S343 VanDerWaalsContact CG-O 3.24Å; K341-S343 WeakPolarHBondContact CG-O 3.45Å; K341-V347 HydrophobicContact CB-CG2 4.42Å; K341-V347 HydrophobicContact CG-CG2 4.24Å
342	I	84.1	Confident	91.1	Very high	70 Å²	70	54.7 Å²	54.7	36%	0.359	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	-32.9	178.4	-60	-174.2	0	0	0	110.6	S346 V348 Y399 I407	I342-S346 PolarHBondContact N-O 3.24Å; I342-V348 HydrophobicContact CD1-CB 3.66Å; I342-V348 HydrophobicContact CD1-CG1 4.47Å; I342-V348 HydrophobicContact CD1-CG2 3.35Å; I342-V348 HydrophobicContact CG1-CB 4.26Å; I342-V348 HydrophobicContact CG1-CG2 4.17Å; I342-Y399 HydrophobicContact CD1-CE2 4.16Å; I342-I407 HydrophobicContact CG2-CD1 4.28Å
343	S	81.8	Confident	91.2	Very high	64 Å²	64	51.7 Å²	51.7	45%	0.448	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	170.4	-177.4	176.4	0	0	0	0	110.3	K341 H345 S346	K341-S343 VanDerWaalsContact CE-O 3.3Å; K341-S343 WeakPolarHBondContact CE-O 3.39Å; K341-S343 VanDerWaalsContact CG-O 3.24Å; K341-S343 WeakPolarHBondContact CG-O 3.45Å; S343-H345 PolarHBondContact O-N 2.8Å; S343-S346 PolarHBondContact N-O 3.01Å; S343-S346 PolarHBondContact O-N 2.77Å
344	R	79.1	Confident	91.3	Very high	214 Å²	214	52 Å²	52	81%	0.808	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.1	-34.7	177.7	-69	-175.5	178.3	-178.7	0.3	112.9
345	H	82.7	Confident	91.1	Very high	131 Å²	131	49.3 Å²	49.3	61%	0.606	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.3	3.2	-177.2	-54.1	-65	0	0	0	114.6	S343 R368 A369	S343-H345 PolarHBondContact O-N 2.8Å; H345-R368 CarbonylContact O-C 3.53Å; H345-R368 WeakPolarHBondContact O-CA 3.14Å; H345-A369 PolarHBondContact O-N 2.99Å
346	S	87.7	Confident	90.8	Very high	20 Å²	20	50.9 Å²	50.9	14%	0.14	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	126.3	-174.1	-53.2	0	0	0	0	112	I342 S343 N367	I342-S346 PolarHBondContact N-O 3.24Å; S343-S346 PolarHBondContact N-O 3.01Å; S343-S346 PolarHBondContact O-N 2.77Å; S346-N367 CarbonylContact C-O 3.58Å; S346-N367 VanDerWaalsContact CA-O 3.27Å; S346-N367 WeakPolarHBondContact CA-O 3.2Å
347	V	91.7	Very high	90.2	Very high	43 Å²	43	51.1 Å²	51.1	26%	0.261	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	125.9	175.4	-178.8	0	0	0	0	108.2	E339 K341 L366 N367	E339-V347 HydrophobicContact CB-CG1 4.4Å; K341-V347 HydrophobicContact CB-CG2 4.42Å; K341-V347 HydrophobicContact CG-CG2 4.24Å; V347-L366 WeakPolarHBondContact O-CA 3.24Å; V347-N367 HydrophobicContact CB-CB 4.34Å; V347-N367 PolarHBondContact N-O 3.07Å; V347-N367 PolarHBondContact O-N 3.12Å
348	V	92.9	Very high	89.6	Confident	45 Å²	45	55.3 Å²	55.3	27%	0.273	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	140.2	175.7	172.3	0	0	0	0	109.1	E339 R340 I342 K365 L366	E339-V348 CarbonylContact C-O 3.5Å; E339-V348 WeakPolarHBondContact CA-O 3.22Å; R340-V348 PolarHBondContact N-O 3.13Å; R340-V348 PolarHBondContact O-N 3.41Å; I342-V348 HydrophobicContact CD1-CB 3.66Å; I342-V348 HydrophobicContact CD1-CG1 4.47Å; I342-V348 HydrophobicContact CD1-CG2 3.35Å; I342-V348 HydrophobicContact CG1-CB 4.26Å; I342-V348 HydrophobicContact CG1-CG2 4.17Å; V348-K365 CarbonylContact C-O 3.55Å; V348-K365 WeakPolarHBondContact CA-O 3.27Å; V348-L366 HydrophobicContact CG2-CD1 3.48Å; V348-L366 VanDerWaalsContact CG2-CD1 3.48Å
349	G	93.7	Very high	89.5	Confident	3 Å²	3	53.1 Å²	53.1	3%	0.031	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	145	174.7	0	0	0	0	0	111.7	A338 I364 K365	A338-G349 CarbonylContact O-C 3.6Å; A338-G349 WeakPolarHBondContact O-CA 3.29Å; G349-I364 WeakPolarHBondContact O-CA 3.32Å; G349-K365 PolarHBondContact N-O 3.05Å; G349-K365 PolarHBondContact O-N 2.99Å
350	A	95.5	Very high	89.5	Confident	32 Å²	32	52.2 Å²	52.2	26%	0.264	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	125.1	168.8	0	0	0	0	0	108	G337 A338 L362 K363 P395	G337-A350 CarbonylContact C-O 3.54Å; G337-A350 WeakPolarHBondContact CA-O 3.44Å; A338-A350 PolarHBondContact N-O 2.86Å; A338-A350 PolarHBondContact O-N 2.89Å; A350-L362 HydrophobicContact CB-CD1 4.49Å; A350-K363 WeakPolarHBondContact CA-O 3.34Å; A350-P395 HydrophobicContact CB-CB 4.21Å
351	T	95.8	Very high	89.7	Confident	23 Å²	23	49.1 Å²	49.1	14%	0.141	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	123.1	178.2	-56.3	0	0	0	0	109.2	E335 Y336 K363	E335-T351 HydrophobicContact CB-CG2 3.97Å; Y336-T351 CarbonylContact O-C 3.52Å; Y336-T351 WeakPolarHBondContact O-CA 3.48Å; T351-K363 PolarHBondContact N-O 2.69Å; T351-K363 WeakPolarHBondContact O-CB 3.26Å; T351-K363 PolarHBondContact O-N 2.88Å
352	V	96.2	Very high	90	Very high	7 Å²	7	46.9 Å²	46.9	4%	0.042	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	134.1	171.8	-175.3	0	0	0	0	108.2	E335 Y336 V354 L362 A391 T392	E335-V352 CarbonylContact C-O 3.55Å; E335-V352 VanDerWaalsContact CA-O 3.23Å; E335-V352 WeakPolarHBondContact CA-O 3.35Å; Y336-V352 HydrophobicContact CE1-CB 4.03Å; Y336-V352 HydrophobicContact CE1-CG1 4.11Å; Y336-V352 HydrophobicContact CE2-CB 4.07Å; Y336-V352 HydrophobicContact CE2-CG2 4.31Å; Y336-V352 PolarHBondContact N-O 3.44Å; Y336-V352 PolarHBondContact O-N 2.98Å; V352-V354 HydrophobicContact CG1-CG2 3.92Å; V352-L362 HydrophobicContact CG2-CD1 4.15Å; V352-A391 HydrophobicContact CG1-CB 3.84Å; V352-A391 HydrophobicContact CG2-CB 3.92Å; V352-A391 WeakPolarHBondContact CG2-O 3.2Å; V352-T392 HydrophobicContact CG2-CG2 3.85Å
353	S	94.7	Very high	90.5	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.007	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	123.3	178.8	177	0	0	0	0	108	V333 V334 V360 S361	V333-S353 VanDerWaalsContact CG1-OG 3.31Å; V333-S353 WeakPolarHBondContact CG1-OG 3.45Å; V334-S353 WeakPolarHBondContact O-CA 3.48Å; S353-V360 WeakPolarHBondContact O-CA 3.06Å; S353-S361 WeakPolarHBondContact CB-OG 3.2Å; S353-S361 PolarHBondContact N-O 2.86Å; S353-S361 PolarHBondContact O-N 3.36Å
354	V	94.9	Very high	91.1	Very high	24 Å²	24	45.1 Å²	45.1	15%	0.145	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	124	-175.6	-177.4	0	0	0	0	108.5	V334 Y336 V352 G359 V360 L383 I388	V334-V354 PolarHBondContact N-O 3.44Å; V334-V354 PolarHBondContact O-N 3.11Å; Y336-V354 HydrophobicContact CE1-CG2 4.31Å; V352-V354 HydrophobicContact CG1-CG2 3.92Å; V354-G359 CarbonylContact C-O 3.58Å; V354-G359 WeakPolarHBondContact CA-O 3.43Å; V354-V360 HydrophobicContact CG1-CG2 4.42Å; V354-V360 HydrophobicContact CG2-CG1 4.45Å; V354-L383 HydrophobicContact CG1-CD2 3.57Å; V354-I388 HydrophobicContact CG1-CD1 3.8Å; V354-I388 HydrophobicContact CG1-CG1 4.34Å; V354-I388 HydrophobicContact CG2-CD1 4.18Å; V354-I388 HydrophobicContact CG2-CG1 3.98Å
355	G	91.6	Very high	91.9	Very high	5 Å²	5	38.4 Å²	38.4	5%	0.052	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	166.7	162	175	0	0	0	0	0	115.8	T332 Q358 G359	T332-G355 CarbonylContact O-C 3.51Å; T332-G355 WeakPolarHBondContact O-CA 3.45Å; G355-Q358 CarbonylContact O-C 3.5Å; G355-Q358 PolarHBondContact O-N 3.14Å; G355-G359 PolarHBondContact N-O 3.01Å; G355-G359 PolarHBondContact O-N 3.11Å
356	V	87.9	Confident	92.4	Very high	84 Å²	84	34.7 Å²	34.7	51%	0.509	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	130.5	177.7	-175.9	0	0	0	0	108.7	G331 T332 L383	G331-V356 CarbonylContact C-O 3.5Å; G331-V356 WeakPolarHBondContact CA-O 3.38Å; T332-V356 PolarHBondContact N-O 3.05Å; T332-V356 PolarHBondContact O-N 3.44Å; V356-L383 HydrophobicContact CG2-CD1 3.9Å; V356-L383 HydrophobicContact CG2-CG 4.41Å
357	P	83.5	Confident	92.6	Very high	87 Å²	87	35.5 Å²	35.5	57%	0.565	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	cis	-102.8	11.1	11.6	36.3	-22.4	0	0	0	113.7	F330 G359	F330-P357 VanDerWaalsContact O-CD 3.25Å; F330-P357 WeakPolarHBondContact O-CD 3.5Å; P357-G359 VanDerWaalsContact C-N 3.32Å; P357-G359 PolarHBondContact O-N 2.95Å
358	Q	82.1	Confident	92.6	Very high	102 Å²	102	40.8 Å²	40.8	48%	0.477	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	3.3	-173.5	-69.9	-168.8	-28.7	0	0	114.5	G355 V360	G355-Q358 CarbonylContact O-C 3.5Å; G355-Q358 PolarHBondContact O-N 3.14Å; Q358-V360 PolarHBondContact O-N 3.25Å
359	G	90.7	Very high	92.1	Very high	2 Å²	2	42.4 Å²	42.4	2%	0.021	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	52.5	-126.7	-175.6	0	0	0	0	0	113.7	V354 G355 P357 T380 D381	V354-G359 CarbonylContact C-O 3.58Å; V354-G359 WeakPolarHBondContact CA-O 3.43Å; G355-G359 PolarHBondContact N-O 3.01Å; G355-G359 PolarHBondContact O-N 3.11Å; P357-G359 VanDerWaalsContact C-N 3.32Å; P357-G359 PolarHBondContact O-N 2.95Å; G359-T380 CarbonylContact C-O 3.58Å; G359-T380 VanDerWaalsContact CA-O 3.29Å; G359-T380 WeakPolarHBondContact CA-O 3.49Å; G359-D381 VanDerWaalsContact CA-O 3.22Å; G359-D381 WeakPolarHBondContact CA-O 3.45Å
360	V	94.3	Very high	91.7	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	125.6	-179.3	-174.9	0	0	0	0	110	S353 V354 Q358 L379 T380 A387 I388 A391	S353-V360 WeakPolarHBondContact O-CA 3.06Å; V354-V360 HydrophobicContact CG1-CG2 4.42Å; V354-V360 HydrophobicContact CG2-CG1 4.45Å; Q358-V360 PolarHBondContact O-N 3.25Å; V360-L379 HydrophobicContact CG1-CD1 4.18Å; V360-L379 WeakPolarHBondContact O-CB 3.47Å; V360-L379 PolarHBondContact O-N 2.89Å; V360-T380 HydrophobicContact CB-CG2 3.92Å; V360-T380 HydrophobicContact CG2-CG2 4.05Å; V360-T380 PolarHBondContact N-O 2.95Å; V360-T380 PolarHBondContact O-N 2.78Å; V360-A387 HydrophobicContact CB-CB 4.18Å; V360-A387 HydrophobicContact CG1-CB 4.16Å; V360-A387 HydrophobicContact CG2-CB 4.31Å; V360-I388 HydrophobicContact CG1-CG1 4.12Å; V360-I388 HydrophobicContact CG2-CD1 4.42Å; V360-I388 HydrophobicContact CG2-CG1 3.76Å; V360-A391 HydrophobicContact CG1-CB 4.43Å
361	S	93.9	Very high	91.5	Very high	13 Å²	13	47.1 Å²	47.1	9%	0.091	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	143.1	174.5	55.6	0	0	0	0	112.7	S353 I377	S353-S361 WeakPolarHBondContact CB-OG 3.2Å; S353-S361 PolarHBondContact N-O 2.86Å; S353-S361 PolarHBondContact O-N 3.36Å; S361-I377 CarbonylContact C-O 3.58Å; S361-I377 VanDerWaalsContact CA-O 3.26Å; S361-I377 WeakPolarHBondContact CA-O 3.18Å; S361-I377 WeakPolarHBondContact CB-O 3.48Å
362	L	95.1	Very high	91.4	Very high	15 Å²	15	47.9 Å²	47.9	8%	0.079	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	119.6	174.6	170.6	62.3	0	0	0	109.4	A350 V352 I364 I377 L379 A391 P395	A350-L362 HydrophobicContact CB-CD1 4.49Å; V352-L362 HydrophobicContact CG2-CD1 4.15Å; L362-I364 HydrophobicContact CD1-CG1 4.41Å; L362-I364 HydrophobicContact CD2-CD1 4.24Å; L362-I364 HydrophobicContact CD2-CG1 4.31Å; L362-I364 HydrophobicContact CG-CG1 4.1Å; L362-I377 HydrophobicContact CB-CB 4.37Å; L362-I377 HydrophobicContact CD2-CD1 4.19Å; L362-I377 HydrophobicContact CG-CD1 4.49Å; L362-I377 PolarHBondContact N-O 3.07Å; L362-I377 WeakPolarHBondContact O-CB 3.17Å; L362-I377 PolarHBondContact O-N 3.23Å; L362-L379 HydrophobicContact CB-CD1 4.32Å; L362-A391 HydrophobicContact CB-CB 4.34Å; L362-P395 HydrophobicContact CD1-CG 3.87Å; L362-P395 HydrophobicContact CD2-CG 3.57Å; L362-P395 HydrophobicContact CG-CG 4.38Å
363	K	94.9	Very high	91.3	Very high	41 Å²	41	50.4 Å²	50.4	18%	0.178	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	107.9	179.4	-61.8	171	-171.4	172.6	0	109.2	E335 A350 T351 F374 P376	E335-K363 IonicContact OE1-NZ 2.81Å; E335-K363 PolarHBondContact OE1-NZ 3.47Å; A350-K363 WeakPolarHBondContact CA-O 3.34Å; T351-K363 PolarHBondContact N-O 2.69Å; T351-K363 WeakPolarHBondContact O-CB 3.26Å; T351-K363 PolarHBondContact O-N 2.88Å; K363-F374 HydrophobicContact CB-CE2 3.91Å; K363-F374 HydrophobicContact CB-CZ 4.11Å; K363-F374 HydrophobicContact CD-CZ 4.12Å; K363-F374 HydrophobicContact CG-CE2 4.36Å; K363-F374 HydrophobicContact CG-CZ 4.05Å; K363-P376 HydrophobicContact CG-CB 4.44Å
364	I	95	Very high	91.3	Very high	56 Å²	56	53 Å²	53	29%	0.287	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	128.8	173.4	-55.9	176.9	0	0	0	108.9	G349 L362 F375 I377	G349-I364 WeakPolarHBondContact O-CA 3.32Å; L362-I364 HydrophobicContact CD1-CG1 4.41Å; L362-I364 HydrophobicContact CD2-CD1 4.24Å; L362-I364 HydrophobicContact CD2-CG1 4.31Å; L362-I364 HydrophobicContact CG-CG1 4.1Å; I364-F375 HydrophobicContact CB-CB 4.32Å; I364-F375 PolarHBondContact N-O 3.47Å; I364-F375 PolarHBondContact O-N 3.27Å; I364-I377 HydrophobicContact CD1-CD1 3.9Å; I364-I377 HydrophobicContact CG1-CD1 4.44Å
365	K	94.8	Very high	91.3	Very high	72 Å²	72	55 Å²	55	31%	0.313	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	127	-178.8	-173.7	174.5	-179.2	177.2	0	110.3	V348 G349 N367 T372 Y373 F374	V348-K365 CarbonylContact C-O 3.55Å; V348-K365 WeakPolarHBondContact CA-O 3.27Å; G349-K365 PolarHBondContact N-O 3.05Å; G349-K365 PolarHBondContact O-N 2.99Å; K365-N367 WeakPolarHBondContact CE-OD1 3.3Å; K365-T372 HydrophobicContact CG-CG2 4.32Å; K365-Y373 CarbonylContact C-O 3.57Å; K365-Y373 WeakPolarHBondContact CA-O 3.23Å; K365-F374 HydrophobicContact CB-CD2 4.28Å; K365-F374 HydrophobicContact CG-CD2 4.46Å
366	L	93.9	Very high	91.4	Very high	53 Å²	53	55.4 Å²	55.4	28%	0.277	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	111.5	171.9	168.8	69.1	0	0	0	108.8	V347 V348 Y373	V347-L366 WeakPolarHBondContact O-CA 3.24Å; V348-L366 HydrophobicContact CG2-CD1 3.48Å; V348-L366 VanDerWaalsContact CG2-CD1 3.48Å; L366-Y373 HydrophobicContact CD2-CD2 4.34Å; L366-Y373 HydrophobicContact CG-CD2 4.47Å; L366-Y373 PolarHBondContact N-O 2.79Å; L366-Y373 PolarHBondContact O-N 2.89Å
367	N	91.8	Very high	91.7	Very high	37 Å²	37	52.9 Å²	52.9	20%	0.198	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	116.7	169.9	-55.6	-39.8	0	0	0	107.9	S346 V347 K365 T372	S346-N367 CarbonylContact C-O 3.58Å; S346-N367 VanDerWaalsContact CA-O 3.27Å; S346-N367 WeakPolarHBondContact CA-O 3.2Å; V347-N367 HydrophobicContact CB-CB 4.34Å; V347-N367 PolarHBondContact N-O 3.07Å; V347-N367 PolarHBondContact O-N 3.12Å; K365-N367 WeakPolarHBondContact CE-OD1 3.3Å; N367-T372 WeakPolarHBondContact OD1-CG2 3.21Å; N367-T372 PolarHBondContact OD1-OG1 2.88Å
368	R	90.4	Very high	92.2	Very high	154 Å²	154	50.9 Å²	50.9	58%	0.581	26%	0.255	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.8	110.5	174.7	-172.3	176.4	-177.7	-140.4	0.8	109.2	H345 S370 Q371	H345-R368 CarbonylContact O-C 3.53Å; H345-R368 WeakPolarHBondContact O-CA 3.14Å; R368-S370 PolarHBondContact O-N 2.82Å; R368-Q371 PolarHBondContact N-O 3.35Å; R368-Q371 PolarHBondContact O-N 2.77Å
369	A	84.4	Confident	92.6	Very high	80 Å²	80	46.7 Å²	46.7	66%	0.661	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.7	-116.4	-173.2	0	0	0	0	0	111.7	H345	H345-A369 PolarHBondContact O-N 2.99Å
370	S	85	Confident	92.7	Very high	46 Å²	46	46.6 Å²	46.6	32%	0.322	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	6.5	179	64.4	0	0	0	0	114.2	P125 K126 G127 R368	P125-S370 WeakPolarHBondContact O-CB 3.3Å; P125-S370 PolarHBondContact O-OG 3.38Å; K126-S370 WeakPolarHBondContact CA-O 3.49Å; G127-S370 PolarHBondContact N-O 3.24Å; G127-S370 VanDerWaalsContact N-O 3.12Å; R368-S370 PolarHBondContact O-N 2.82Å
371	Q	89.6	Confident	92.4	Very high	87 Å²	87	51.2 Å²	51.2	41%	0.407	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	136.2	178.6	-63.9	-179.5	2.1	0	0	111.4	G127 R368 Y373	G127-Q371 CarbonylContact O-C 3.56Å; G127-Q371 VanDerWaalsContact O-CA 3.3Å; G127-Q371 WeakPolarHBondContact O-CA 3.24Å; R368-Q371 PolarHBondContact N-O 3.35Å; R368-Q371 PolarHBondContact O-N 2.77Å; Q371-Y373 HydrophobicContact CB-CE2 3.92Å; Q371-Y373 PolarHBondContact OE1-OH 2.9Å
372	T	93.8	Very high	92.2	Very high	40 Å²	40	56.2 Å²	56.2	25%	0.245	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	122.9	174.1	-59.3	0	0	0	0	109.4	G127 S128 I129 K365 N367	G127-T372 PolarHBondContact O-N 2.77Å; S128-T372 CarbonylContact C-O 3.57Å; S128-T372 VanDerWaalsContact CA-O 3.26Å; S128-T372 WeakPolarHBondContact CA-O 3.48Å; I129-T372 PolarHBondContact N-O 2.81Å; K365-T372 HydrophobicContact CG-CG2 4.32Å; N367-T372 WeakPolarHBondContact OD1-CG2 3.21Å; N367-T372 PolarHBondContact OD1-OG1 2.88Å
373	Y	95	Very high	91.8	Very high	59 Å²	59	59.9 Å²	59.9	23%	0.231	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	128.6	170.8	-61.8	-96.1	0	0	0	108.3	I129 K365 L366 Q371	I129-Y373 HydrophobicContact CB-CD1 4.15Å; I129-Y373 HydrophobicContact CB-CE1 4.47Å; I129-Y373 HydrophobicContact CD1-CD1 4.32Å; I129-Y373 HydrophobicContact CD1-CE1 3.77Å; I129-Y373 CarbonylContact O-C 3.54Å; I129-Y373 WeakPolarHBondContact O-CA 3.45Å; K365-Y373 CarbonylContact C-O 3.57Å; K365-Y373 WeakPolarHBondContact CA-O 3.23Å; L366-Y373 HydrophobicContact CD2-CD2 4.34Å; L366-Y373 HydrophobicContact CG-CD2 4.47Å; L366-Y373 PolarHBondContact N-O 2.79Å; L366-Y373 PolarHBondContact O-N 2.89Å; Q371-Y373 HydrophobicContact CB-CE2 3.92Å; Q371-Y373 PolarHBondContact OE1-OH 2.9Å
374	F	94.6	Very high	91.5	Very high	57 Å²	57	60 Å²	60	25%	0.25	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	119.8	-173.9	-174.8	-116.8	0	0	0	110.4	I129 S130 V131 K363 K365 P376	I129-F374 PolarHBondContact O-N 3.12Å; S130-F374 CarbonylContact C-O 3.55Å; S130-F374 WeakPolarHBondContact CA-O 3.13Å; V131-F374 PolarHBondContact N-O 3.48Å; K363-F374 HydrophobicContact CB-CE2 3.91Å; K363-F374 HydrophobicContact CB-CZ 4.11Å; K363-F374 HydrophobicContact CD-CZ 4.12Å; K363-F374 HydrophobicContact CG-CE2 4.36Å; K363-F374 HydrophobicContact CG-CZ 4.05Å; K365-F374 HydrophobicContact CB-CD2 4.28Å; K365-F374 HydrophobicContact CG-CD2 4.46Å; F374-P376 HydrophobicContact CD1-CG 3.99Å; F374-P376 HydrophobicContact CE1-CB 3.91Å; F374-P376 HydrophobicContact CE1-CG 3.66Å; F374-P376 HydrophobicContact CZ-CB 4.17Å; F374-P376 HydrophobicContact CZ-CG 4.4Å; F374-P376 VanDerWaalsContact O-CD 3.32Å; F374-P376 WeakPolarHBondContact O-CD 3.36Å
375	F	95	Very high	91.3	Very high	64 Å²	64	62.2 Å²	62.2	28%	0.281	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	84.6	-177.2	-53.9	-84.6	0	0	0	108.7	V131 I364 I377	V131-F375 HydrophobicContact CB-CD1 3.93Å; V131-F375 HydrophobicContact CB-CE1 4.16Å; V131-F375 HydrophobicContact CG2-CD1 4.4Å; V131-F375 HydrophobicContact CG2-CE1 4.13Å; V131-F375 WeakPolarHBondContact O-CA 3.49Å; I364-F375 HydrophobicContact CB-CB 4.32Å; I364-F375 PolarHBondContact N-O 3.47Å; I364-F375 PolarHBondContact O-N 3.27Å; F375-I377 PolarHBondContact O-N 3.42Å
376	P	94.5	Very high	91.2	Very high	15 Å²	15	61.3 Å²	61.3	10%	0.097	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	113.4	169.3	28.2	-30	0	0	0	109	V131 G132 I133 K363 F374	V131-P376 WeakPolarHBondContact O-CD 3.32Å; G132-P376 WeakPolarHBondContact CA-O 3.27Å; I133-P376 PolarHBondContact N-O 3.08Å; K363-P376 HydrophobicContact CG-CB 4.44Å; F374-P376 HydrophobicContact CD1-CG 3.99Å; F374-P376 HydrophobicContact CE1-CB 3.91Å; F374-P376 HydrophobicContact CE1-CG 3.66Å; F374-P376 HydrophobicContact CZ-CB 4.17Å; F374-P376 HydrophobicContact CZ-CG 4.4Å; F374-P376 VanDerWaalsContact O-CD 3.32Å; F374-P376 WeakPolarHBondContact O-CD 3.36Å
377	I	94.3	Very high	91	Very high	30 Å²	30	58.8 Å²	58.8	15%	0.154	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	115.1	176.7	-54.1	167.4	0	0	0	107.2	I133 A135 S361 L362 I364 F375 L379	I133-I377 HydrophobicContact CB-CG1 4.22Å; I133-I377 HydrophobicContact CB-CG2 4.49Å; I133-I377 HydrophobicContact CD1-CG1 4.09Å; I133-I377 HydrophobicContact CG2-CG2 4.33Å; I133-I377 CarbonylContact O-C 3.53Å; I133-I377 WeakPolarHBondContact O-CA 3.49Å; A135-I377 HydrophobicContact CB-CG2 4.02Å; S361-I377 CarbonylContact C-O 3.58Å; S361-I377 VanDerWaalsContact CA-O 3.26Å; S361-I377 WeakPolarHBondContact CA-O 3.18Å; S361-I377 WeakPolarHBondContact CB-O 3.48Å; L362-I377 HydrophobicContact CB-CB 4.37Å; L362-I377 HydrophobicContact CD2-CD1 4.19Å; L362-I377 HydrophobicContact CG-CD1 4.49Å; L362-I377 PolarHBondContact N-O 3.07Å; L362-I377 WeakPolarHBondContact O-CB 3.17Å; L362-I377 PolarHBondContact O-N 3.23Å; I364-I377 HydrophobicContact CD1-CD1 3.9Å; I364-I377 HydrophobicContact CG1-CD1 4.44Å; F375-I377 PolarHBondContact O-N 3.42Å; I377-L379 HydrophobicContact CG2-CD2 3.81Å
378	H	92.7	Very high	91	Very high	45 Å²	45	59.2 Å²	59.2	21%	0.208	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	128	172.8	-170.3	-109.4	0	0	0	109	I133 D134 A135 T136 D381	I133-H378 PolarHBondContact O-N 2.89Å; D134-H378 IonicContact OD1-ND1 3.2Å; A135-H378 CarbonylContact C-O 3.26Å; A135-H378 WeakPolarHBondContact CA-O 3.49Å; A135-H378 WeakPolarHBondContact CB-O 3.3Å; A135-H378 PolarHBondContact N-O 3.23Å; T136-H378 PolarHBondContact OG1-ND1 2.82Å; H378-D381 IonicContact CE1-OD1 3.34Å; H378-D381 PolarHBondContact CE1-OD1 2.83Å; H378-D381 IonicContact NE2-OD1 3.98Å; H378-D381 PolarHBondContact NE2-OD1 2.94Å
379	L	92.1	Very high	91.2	Very high	14 Å²	14	57.2 Å²	57.2	7%	0.073	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	-36	-173.7	-61.1	172.9	0	0	0	113.1	A135 T136 F139 V360 L362 I377 A387 A391	A135-L379 HydrophobicContact CB-CD2 4.35Å; T136-L379 WeakPolarHBondContact CA-O 3.45Å; F139-L379 HydrophobicContact CD2-CB 4.06Å; F139-L379 VanDerWaalsContact CD2-O 3.29Å; F139-L379 WeakPolarHBondContact CD2-O 3.41Å; F139-L379 HydrophobicContact CE2-CB 4.09Å; F139-L379 HydrophobicContact CE2-CD2 3.91Å; F139-L379 HydrophobicContact CE2-CG 4.44Å; V360-L379 HydrophobicContact CG1-CD1 4.18Å; V360-L379 WeakPolarHBondContact O-CB 3.47Å; V360-L379 PolarHBondContact O-N 2.89Å; L362-L379 HydrophobicContact CB-CD1 4.32Å; I377-L379 HydrophobicContact CG2-CD2 3.81Å; L379-A387 HydrophobicContact CB-CB 4.43Å; L379-A391 HydrophobicContact CD1-CB 3.63Å
380	T	91.6	Very high	91.6	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.1	149.1	178	172	0	0	0	0	108.7	D140 G359 V360 Q382 L384 A387	D140-T380 PolarHBondContact OD1-OG1 2.96Å; D140-T380 WeakPolarHBondContact OD2-CB 3.34Å; D140-T380 PolarHBondContact OD2-OG1 3.39Å; G359-T380 CarbonylContact C-O 3.58Å; G359-T380 VanDerWaalsContact CA-O 3.29Å; G359-T380 WeakPolarHBondContact CA-O 3.49Å; V360-T380 HydrophobicContact CB-CG2 3.92Å; V360-T380 HydrophobicContact CG2-CG2 4.05Å; V360-T380 PolarHBondContact N-O 2.95Å; V360-T380 PolarHBondContact O-N 2.78Å; T380-Q382 VanDerWaalsContact C-N 3.29Å; T380-Q382 WeakPolarHBondContact CG2-O 3.49Å; T380-Q382 PolarHBondContact OG1-N 2.74Å; T380-L384 HydrophobicContact CG2-CB 4.27Å; T380-L384 HydrophobicContact CG2-CD1 4.16Å; T380-L384 HydrophobicContact CG2-CG 4.38Å; T380-A387 HydrophobicContact CG2-CB 3.62Å
381	D	88.6	Confident	91.9	Very high	98 Å²	98	58 Å²	58	52%	0.524	29%	0.289	S	S	.	.	S	Bend	trans	-77.1	-18.8	172.1	-71.7	-42.6	0	0	0	112.3	G359 H378	G359-D381 VanDerWaalsContact CA-O 3.22Å; G359-D381 WeakPolarHBondContact CA-O 3.45Å; H378-D381 IonicContact CE1-OD1 3.34Å; H378-D381 PolarHBondContact CE1-OD1 2.83Å; H378-D381 IonicContact NE2-OD1 3.98Å; H378-D381 PolarHBondContact NE2-OD1 2.94Å
382	Q	88.9	Confident	92	Very high	118 Å²	118	56 Å²	56	55%	0.551	28%	0.282	S	S	*	.	S	Bend	trans	-95.3	157.6	-178.5	-59.9	-168.2	10.9	0	0	112.3	T380 L384	T380-Q382 VanDerWaalsContact C-N 3.29Å; T380-Q382 WeakPolarHBondContact CG2-O 3.49Å; T380-Q382 PolarHBondContact OG1-N 2.74Å; Q382-L384 VanDerWaalsContact C-N 3.29Å; Q382-L384 HydrophobicContact CB-CG 4.2Å; Q382-L384 PolarHBondContact O-N 2.8Å
383	L	87.6	Confident	92	Very high	92 Å²	92	56.7 Å²	56.7	48%	0.482	29%	0.286	S	S	.	.			trans	-81.8	75.4	175.2	-65.8	177.8	0	0	0	110.5	V354 V356	V354-L383 HydrophobicContact CG1-CD2 3.57Å; V356-L383 HydrophobicContact CG2-CD1 3.9Å; V356-L383 HydrophobicContact CG2-CG 4.41Å
384	L	88.8	Confident	91.8	Very high	43 Å²	43	55.4 Å²	55.4	23%	0.225	29%	0.291	C	S	.	.			trans	-90.1	121.5	178.4	-65.7	175.7	0	0	0	111.8	F139 T380 Q382 S386 A387 I388	F139-L384 HydrophobicContact CB-CD1 4.19Å; T380-L384 HydrophobicContact CG2-CB 4.27Å; T380-L384 HydrophobicContact CG2-CD1 4.16Å; T380-L384 HydrophobicContact CG2-CG 4.38Å; Q382-L384 VanDerWaalsContact C-N 3.29Å; Q382-L384 HydrophobicContact CB-CG 4.2Å; Q382-L384 PolarHBondContact O-N 2.8Å; L384-S386 PolarHBondContact O-N 2.85Å; L384-A387 HydrophobicContact CB-CB 4.11Å; L384-A387 PolarHBondContact O-N 2.94Å; L384-I388 WeakPolarHBondContact O-CG1 3.45Å; L384-I388 PolarHBondContact O-N 2.81Å
385	P	90.9	Very high	91.6	Very high	102 Å²	102	54.1 Å²	54.1	66%	0.662	29%	0.288	S	S	*	.	H	α-helix	trans	-59.6	-32.9	176.9	-25.9	35.1	0	0	0	113.8	I388 F389	P385-I388 PolarHBondContact O-N 2.92Å; P385-F389 PolarHBondContact O-N 2.69Å
386	S	91.2	Very high	91.4	Very high	54 Å²	54	56.1 Å²	56.1	38%	0.378	30%	0.302	S	S	.	.	H	α-helix	trans	-62.2	-47.2	175.7	50.7	0	0	0	0	111.5	L384 I388 F389 Y390	L384-S386 PolarHBondContact O-N 2.85Å; S386-I388 VanDerWaalsContact C-N 3.31Å; S386-I388 PolarHBondContact O-N 3.23Å; S386-F389 WeakPolarHBondContact O-CB 3.36Å; S386-F389 PolarHBondContact O-N 3.05Å; S386-F389 VanDerWaalsContact O-N 3.15Å; S386-Y390 WeakPolarHBondContact O-CD2 3.27Å; S386-Y390 PolarHBondContact O-N 3.01Å
387	A	90.4	Very high	91.4	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-60.8	-40.9	176.7	0	0	0	0	0	111.5	F139 V360 L379 T380 L384 F389 Y390 A391	F139-A387 HydrophobicContact CD1-CB 4.04Å; F139-A387 HydrophobicContact CD2-CB 4.47Å; F139-A387 HydrophobicContact CE1-CB 4.17Å; F139-A387 HydrophobicContact CG-CB 4.2Å; F139-A387 HydrophobicContact CZ-CB 4.44Å; V360-A387 HydrophobicContact CB-CB 4.18Å; V360-A387 HydrophobicContact CG1-CB 4.16Å; V360-A387 HydrophobicContact CG2-CB 4.31Å; L379-A387 HydrophobicContact CB-CB 4.43Å; T380-A387 HydrophobicContact CG2-CB 3.62Å; L384-A387 HydrophobicContact CB-CB 4.11Å; L384-A387 PolarHBondContact O-N 2.94Å; A387-F389 PolarHBondContact O-N 3.21Å; A387-Y390 PolarHBondContact O-N 2.75Å; A387-A391 WeakPolarHBondContact O-CB 3.32Å; A387-A391 PolarHBondContact O-N 3.48Å
388	I	92.4	Very high	91.2	Very high	45 Å²	45	64.7 Å²	64.7	23%	0.231	34%	0.343	C	S	.	.	H	α-helix	trans	-62.2	-43.2	174.9	-60.1	172	0	0	0	111	Y336 V354 V360 L384 P385 S386 A391 T392	Y336-I388 WeakPolarHBondContact OH-CG2 3.42Å; V354-I388 HydrophobicContact CG1-CD1 3.8Å; V354-I388 HydrophobicContact CG1-CG1 4.34Å; V354-I388 HydrophobicContact CG2-CD1 4.18Å; V354-I388 HydrophobicContact CG2-CG1 3.98Å; V360-I388 HydrophobicContact CG1-CG1 4.12Å; V360-I388 HydrophobicContact CG2-CD1 4.42Å; V360-I388 HydrophobicContact CG2-CG1 3.76Å; L384-I388 WeakPolarHBondContact O-CG1 3.45Å; L384-I388 PolarHBondContact O-N 2.81Å; P385-I388 PolarHBondContact O-N 2.92Å; S386-I388 VanDerWaalsContact C-N 3.31Å; S386-I388 PolarHBondContact O-N 3.23Å; I388-A391 PolarHBondContact O-N 2.8Å; I388-T392 WeakPolarHBondContact O-CG2 3.38Å; I388-T392 PolarHBondContact O-N 2.78Å; I388-T392 VanDerWaalsContact O-N 3.12Å; I388-T392 PolarHBondContact O-OG1 2.82Å
389	F	93.8	Very high	90.9	Very high	113 Å²	113	65 Å²	65	50%	0.496	34%	0.343	S	S	.	.	H	α-helix	trans	-61.4	-48.7	177.5	177	-94.5	0	0	0	111.9	P385 S386 A387 T392 V393	P385-F389 PolarHBondContact O-N 2.69Å; S386-F389 WeakPolarHBondContact O-CB 3.36Å; S386-F389 PolarHBondContact O-N 3.05Å; S386-F389 VanDerWaalsContact O-N 3.15Å; A387-F389 PolarHBondContact O-N 3.21Å; F389-T392 PolarHBondContact O-N 2.79Å; F389-T392 PolarHBondContact O-OG1 2.79Å; F389-V393 HydrophobicContact CD2-CG2 3.89Å; F389-V393 HydrophobicContact CE1-CB 4.4Å; F389-V393 HydrophobicContact CE1-CG2 4.39Å; F389-V393 HydrophobicContact CE2-CB 4.45Å; F389-V393 HydrophobicContact CE2-CG2 3.61Å; F389-V393 HydrophobicContact CG-CG2 4.4Å; F389-V393 HydrophobicContact CZ-CB 4.25Å; F389-V393 HydrophobicContact CZ-CG1 4.31Å; F389-V393 HydrophobicContact CZ-CG2 3.88Å; F389-V393 WeakPolarHBondContact O-CB 3.07Å; F389-V393 WeakPolarHBondContact O-CG2 3.47Å; F389-V393 PolarHBondContact O-N 2.92Å
390	Y	92.3	Very high	90.8	Very high	141 Å²	141	68.7 Å²	68.7	55%	0.553	36%	0.362	S	S	*	.	H	α-helix	trans	-69.7	-35.8	179.1	-71	-68.2	0	0	0	112.8	F139 S386 A387 T392 G394	F139-Y390 AromaticContact CE1-CD2 3.74Å; F139-Y390 HydrophobicContact CE1-CD2 3.74Å; F139-Y390 HydrophobicContact CE1-CE2 4.4Å; F139-Y390 HydrophobicContact CZ-CD2 4.02Å; F139-Y390 HydrophobicContact CZ-CG 4.42Å; S386-Y390 WeakPolarHBondContact O-CD2 3.27Å; S386-Y390 PolarHBondContact O-N 3.01Å; A387-Y390 PolarHBondContact O-N 2.75Å; Y390-T392 PolarHBondContact O-N 2.8Å; Y390-G394 WeakPolarHBondContact O-CA 3.34Å; Y390-G394 PolarHBondContact O-N 2.9Å
391	A	91.7	Very high	90.9	Very high	2 Å²	2	70.7 Å²	70.7	2%	0.017	38%	0.379	C	S	.	.	H	α-helix	trans	-61.8	-28.7	174.5	0	0	0	0	0	112.8	V352 V360 L362 L379 A387 I388 P395	V352-A391 HydrophobicContact CG1-CB 3.84Å; V352-A391 HydrophobicContact CG2-CB 3.92Å; V352-A391 WeakPolarHBondContact CG2-O 3.2Å; V360-A391 HydrophobicContact CG1-CB 4.43Å; L362-A391 HydrophobicContact CB-CB 4.34Å; L379-A391 HydrophobicContact CD1-CB 3.63Å; A387-A391 WeakPolarHBondContact O-CB 3.32Å; A387-A391 PolarHBondContact O-N 3.48Å; I388-A391 PolarHBondContact O-N 2.8Å; A391-P395 VanDerWaalsContact O-CD 3.23Å; A391-P395 WeakPolarHBondContact O-CD 3.04Å; A391-P395 WeakPolarHBondContact O-CG 3.31Å
392	T	92.8	Very high	90.9	Very high	44 Å²	44	68.8 Å²	68.8	27%	0.27	37%	0.368	S	S	.	.	H	α-helix	trans	-93.1	-52.9	-179.4	47.7	0	0	0	0	113.4	Y336 V352 I388 F389 Y390	Y336-T392 HydrophobicContact CE2-CG2 3.38Å; Y336-T392 WeakPolarHBondContact OH-CG2 3.3Å; V352-T392 HydrophobicContact CG2-CG2 3.85Å; I388-T392 WeakPolarHBondContact O-CG2 3.38Å; I388-T392 PolarHBondContact O-N 2.78Å; I388-T392 VanDerWaalsContact O-N 3.12Å; I388-T392 PolarHBondContact O-OG1 2.82Å; F389-T392 PolarHBondContact O-N 2.79Å; F389-T392 PolarHBondContact O-OG1 2.79Å; Y390-T392 PolarHBondContact O-N 2.8Å
393	V	93.9	Very high	90.7	Very high	54 Å²	54	65 Å²	65	33%	0.327	35%	0.351	S	S	.	.	H	α-helix	trans	-75.9	-37.2	-174.4	178.8	0	0	0	0	110.8	F389 L396 V397	F389-V393 HydrophobicContact CD2-CG2 3.89Å; F389-V393 HydrophobicContact CE1-CB 4.4Å; F389-V393 HydrophobicContact CE1-CG2 4.39Å; F389-V393 HydrophobicContact CE2-CB 4.45Å; F389-V393 HydrophobicContact CE2-CG2 3.61Å; F389-V393 HydrophobicContact CG-CG2 4.4Å; F389-V393 HydrophobicContact CZ-CB 4.25Å; F389-V393 HydrophobicContact CZ-CG1 4.31Å; F389-V393 HydrophobicContact CZ-CG2 3.88Å; F389-V393 WeakPolarHBondContact O-CB 3.07Å; F389-V393 WeakPolarHBondContact O-CG2 3.47Å; F389-V393 PolarHBondContact O-N 2.92Å; V393-L396 PolarHBondContact O-N 2.79Å; V393-V397 HydrophobicContact CG1-CG2 3.76Å; V393-V397 WeakPolarHBondContact O-CG2 3.3Å; V393-V397 PolarHBondContact O-N 3.3Å
394	G	90.6	Very high	90.9	Very high	33 Å²	33	66.9 Å²	66.9	34%	0.34	36%	0.357	S	S	.	.	H	α-helix	trans	-54.9	-58	-178.3	0	0	0	0	0	113.2	Y390 L396 V397 F398	Y390-G394 WeakPolarHBondContact O-CA 3.34Å; Y390-G394 PolarHBondContact O-N 2.9Å; G394-L396 VanDerWaalsContact C-N 3.26Å; G394-L396 PolarHBondContact O-N 2.77Å; G394-V397 PolarHBondContact O-N 2.77Å; G394-F398 VanDerWaalsContact O-CB 3.25Å; G394-F398 WeakPolarHBondContact O-CB 3.26Å; G394-F398 PolarHBondContact O-N 2.76Å
395	P	90.7	Very high	91	Very high	29 Å²	29	71.2 Å²	71.2	19%	0.188	38%	0.379	C	S	.	.	H	α-helix	trans	-60.4	-33.1	178	-26.9	36.8	0	0	0	113.8	A350 L362 A391 Y399	A350-P395 HydrophobicContact CB-CB 4.21Å; L362-P395 HydrophobicContact CD1-CG 3.87Å; L362-P395 HydrophobicContact CD2-CG 3.57Å; L362-P395 HydrophobicContact CG-CG 4.38Å; A391-P395 VanDerWaalsContact O-CD 3.23Å; A391-P395 WeakPolarHBondContact O-CD 3.04Å; A391-P395 WeakPolarHBondContact O-CG 3.31Å; P395-Y399 VanDerWaalsContact O-CB 3.23Å; P395-Y399 WeakPolarHBondContact O-CB 3.47Å; P395-Y399 PolarHBondContact O-N 2.85Å
396	L	90.4	Very high	90.9	Very high	107 Å²	107	70.6 Å²	70.6	56%	0.56	37%	0.374	S	S	*	.	H	α-helix	trans	-72	-46.6	-179.3	-170.2	142.6	0	0	0	111.5	V393 G394 Y399 L400	V393-L396 PolarHBondContact O-N 2.79Å; G394-L396 VanDerWaalsContact C-N 3.26Å; G394-L396 PolarHBondContact O-N 2.77Å; L396-Y399 PolarHBondContact O-N 2.83Å; L396-L400 HydrophobicContact CD2-CD1 3.85Å; L396-L400 WeakPolarHBondContact O-CG 3.36Å; L396-L400 PolarHBondContact O-N 3.36Å
397	V	93	Very high	90.5	Very high	84 Å²	84	70.4 Å²	70.4	51%	0.509	37%	0.368	S	S	.	.	H	α-helix	trans	-63.8	-43.7	174.9	174	0	0	0	0	110.4	V393 G394 Y399 L400 A401	V393-V397 HydrophobicContact CG1-CG2 3.76Å; V393-V397 WeakPolarHBondContact O-CG2 3.3Å; V393-V397 PolarHBondContact O-N 3.3Å; G394-V397 PolarHBondContact O-N 2.77Å; V397-Y399 VanDerWaalsContact C-N 3.33Å; V397-Y399 PolarHBondContact O-N 3.05Å; V397-L400 PolarHBondContact O-N 2.96Å; V397-A401 WeakPolarHBondContact O-CB 3.34Å; V397-A401 PolarHBondContact O-N 3.41Å
398	F	90.1	Very high	90.3	Very high	140 Å²	140	76.4 Å²	76.4	61%	0.614	39%	0.39	S	S	*	.	H	α-helix	trans	-60.3	-42.9	176.5	-175.9	-108.2	0	0	0	112	G394 A401 I402	G394-F398 VanDerWaalsContact O-CB 3.25Å; G394-F398 WeakPolarHBondContact O-CB 3.26Å; G394-F398 PolarHBondContact O-N 2.76Å; F398-A401 PolarHBondContact O-N 2.85Å; F398-I402 HydrophobicContact CD1-CD1 3.75Å; F398-I402 HydrophobicContact CE1-CD1 3.21Å; F398-I402 HydrophobicContact CE1-CG1 4.32Å; F398-I402 HydrophobicContact CE2-CD1 4.04Å; F398-I402 HydrophobicContact CE2-CG1 4.48Å; F398-I402 HydrophobicContact CG-CD1 4.38Å; F398-I402 HydrophobicContact CZ-CD1 3.39Å; F398-I402 HydrophobicContact CZ-CG1 4.28Å; F398-I402 WeakPolarHBondContact O-CG1 3.18Å; F398-I402 PolarHBondContact O-N 2.81Å
399	Y	87.9	Confident	90.3	Very high	53 Å²	53	77.1 Å²	77.1	21%	0.208	40%	0.398	C	S	.	.	H	α-helix	trans	-62	-46.4	175.1	175.7	-98.1	0	0	0	112.2	R340 I342 P395 L396 V397 A401 I402 Q403	R340-Y399 WeakPolarHBondContact CD-OH 3.39Å; R340-Y399 PolarHBondContact NE-OH 3.09Å; R340-Y399 PolarHBondContact NH1-OH 3.05Å; I342-Y399 HydrophobicContact CD1-CE2 4.16Å; P395-Y399 VanDerWaalsContact O-CB 3.23Å; P395-Y399 WeakPolarHBondContact O-CB 3.47Å; P395-Y399 PolarHBondContact O-N 2.85Å; L396-Y399 PolarHBondContact O-N 2.83Å; V397-Y399 VanDerWaalsContact C-N 3.33Å; V397-Y399 PolarHBondContact O-N 3.05Å; Y399-A401 VanDerWaalsContact C-N 3.34Å; Y399-A401 PolarHBondContact O-N 2.97Å; Y399-I402 PolarHBondContact O-N 2.81Å; Y399-Q403 VanDerWaalsContact CE1-OE1 3.23Å; Y399-Q403 VanDerWaalsContact O-CB 3.27Å; Y399-Q403 WeakPolarHBondContact O-CB 3.02Å; Y399-Q403 PolarHBondContact O-N 2.84Å
400	L	90	Very high	89.8	Confident	90 Å²	90	78.8 Å²	78.8	47%	0.471	40%	0.402	S	S	.	.	H	α-helix	trans	-62.5	-41.4	177.6	-70.8	175.5	0	0	0	111.8	L396 V397 Q403 Q404	L396-L400 HydrophobicContact CD2-CD1 3.85Å; L396-L400 WeakPolarHBondContact O-CG 3.36Å; L396-L400 PolarHBondContact O-N 3.36Å; V397-L400 PolarHBondContact O-N 2.96Å; L400-Q403 PolarHBondContact O-N 3.05Å; L400-Q404 WeakPolarHBondContact O-CB 3.36Å; L400-Q404 PolarHBondContact O-N 2.57Å
401	A	92.8	Very high	89.4	Confident	43 Å²	43	75 Å²	75	36%	0.355	39%	0.394	S	S	.	.	H	α-helix	trans	-61.7	-49.1	176	0	0	0	0	0	111.6	V397 F398 Y399 Q403 Q404 L405	V397-A401 WeakPolarHBondContact O-CB 3.34Å; V397-A401 PolarHBondContact O-N 3.41Å; F398-A401 PolarHBondContact O-N 2.85Å; Y399-A401 VanDerWaalsContact C-N 3.34Å; Y399-A401 PolarHBondContact O-N 2.97Å; A401-Q403 VanDerWaalsContact C-N 3.31Å; A401-Q403 PolarHBondContact O-N 3.33Å; A401-Q404 PolarHBondContact O-N 3.48Å; A401-L405 VanDerWaalsContact O-CB 3.27Å; A401-L405 WeakPolarHBondContact O-CB 3.34Å; A401-L405 WeakPolarHBondContact O-CG 3.39Å; A401-L405 PolarHBondContact O-N 3.38Å
402	I	88.4	Confident	89	Confident	57 Å²	57	83 Å²	83	29%	0.292	42%	0.423	S	S	.	.	H	α-helix	trans	-60.6	-42.5	175.4	-74.3	179.4	0	0	0	111.1	F398 Y399 Q404 V406 I407	F398-I402 HydrophobicContact CD1-CD1 3.75Å; F398-I402 HydrophobicContact CE1-CD1 3.21Å; F398-I402 HydrophobicContact CE1-CG1 4.32Å; F398-I402 HydrophobicContact CE2-CD1 4.04Å; F398-I402 HydrophobicContact CE2-CG1 4.48Å; F398-I402 HydrophobicContact CG-CD1 4.38Å; F398-I402 HydrophobicContact CZ-CD1 3.39Å; F398-I402 HydrophobicContact CZ-CG1 4.28Å; F398-I402 WeakPolarHBondContact O-CG1 3.18Å; F398-I402 PolarHBondContact O-N 2.81Å; Y399-I402 PolarHBondContact O-N 2.81Å; I402-Q404 VanDerWaalsContact C-N 3.29Å; I402-Q404 PolarHBondContact O-N 2.84Å; I402-V406 HydrophobicContact CG2-CB 4.46Å; I402-V406 WeakPolarHBondContact O-CA 3.48Å; I402-V406 WeakPolarHBondContact O-CB 3.39Å; I402-V406 PolarHBondContact O-N 2.85Å; I402-I407 HydrophobicContact CG2-CD1 3.89Å; I402-I407 HydrophobicContact CG2-CG1 3.96Å; I402-I407 PolarHBondContact O-N 3.43Å
403	Q	86	Confident	88.7	Confident	39 Å²	39	82.8 Å²	82.8	18%	0.182	43%	0.427	C	S	.	.	I	π-helix	trans	-62.2	-40.2	-178.8	-171	173.7	11.9	0	0	111.5	Y399 L400 A401 R408	Y399-Q403 VanDerWaalsContact CE1-OE1 3.23Å; Y399-Q403 VanDerWaalsContact O-CB 3.27Å; Y399-Q403 WeakPolarHBondContact O-CB 3.02Å; Y399-Q403 PolarHBondContact O-N 2.84Å; L400-Q403 PolarHBondContact O-N 3.05Å; A401-Q403 VanDerWaalsContact C-N 3.31Å; A401-Q403 PolarHBondContact O-N 3.33Å; Q403-R408 WeakPolarHBondContact O-CB 3.39Å; Q403-R408 VanDerWaalsContact O-CG 3.32Å; Q403-R408 WeakPolarHBondContact O-CG 3.3Å; Q403-R408 PolarHBondContact O-N 2.79Å
404	Q	90.4	Very high	88.2	Confident	131 Å²	131	84.1 Å²	84.1	61%	0.612	43%	0.429	S	S	*	.	I	π-helix	trans	-83	-39.6	-177.2	-166.3	144.9	-15	0	0	113.4	L400 A401 I402 P409	L400-Q404 WeakPolarHBondContact O-CB 3.36Å; L400-Q404 PolarHBondContact O-N 2.57Å; A401-Q404 PolarHBondContact O-N 3.48Å; I402-Q404 VanDerWaalsContact C-N 3.29Å; I402-Q404 PolarHBondContact O-N 2.84Å; Q404-P409 WeakPolarHBondContact O-CD 3.34Å
405	L	92.1	Very high	87.7	Confident	134 Å²	134	89.2 Å²	89.2	70%	0.702	44%	0.442	S	S	*	.	I	π-helix	trans	-90.3	-25.1	-174.5	-63	175.7	0	0	0	114.2	A401 P409	A401-L405 VanDerWaalsContact O-CB 3.27Å; A401-L405 WeakPolarHBondContact O-CB 3.34Å; A401-L405 WeakPolarHBondContact O-CG 3.39Å; A401-L405 PolarHBondContact O-N 3.38Å; L405-P409 WeakPolarHBondContact O-CG 3.46Å
406	V	88.1	Confident	87.3	Confident	89 Å²	89	93.6 Å²	93.6	54%	0.539	46%	0.46	S	S	.	.	I	π-helix	trans	-120.8	-55.8	-173.7	-174.3	0	0	0	0	111.6	I402 P409 Y410	I402-V406 HydrophobicContact CG2-CB 4.46Å; I402-V406 WeakPolarHBondContact O-CA 3.48Å; I402-V406 WeakPolarHBondContact O-CB 3.39Å; I402-V406 PolarHBondContact O-N 2.85Å; V406-P409 WeakPolarHBondContact O-CD 3.17Å; V406-P409 WeakPolarHBondContact O-CG 3.22Å; V406-Y410 WeakPolarHBondContact O-CB 3.26Å; V406-Y410 PolarHBondContact O-N 2.84Å; V406-Y410 VanDerWaalsContact O-N 3.14Å
407	I	83.3	Confident	86.9	Confident	51 Å²	51	93.9 Å²	93.9	26%	0.262	46%	0.458	S	S	.	.	I	π-helix	trans	-69.4	-53.4	-170.3	-59.4	177.2	0	0	0	111.4	I342 I402 Y410 V411	I342-I407 HydrophobicContact CG2-CD1 4.28Å; I402-I407 HydrophobicContact CG2-CD1 3.89Å; I402-I407 HydrophobicContact CG2-CG1 3.96Å; I402-I407 PolarHBondContact O-N 3.43Å; I407-Y410 PolarHBondContact O-N 3.33Å; I407-V411 HydrophobicContact CG2-CG2 4.22Å; I407-V411 VanDerWaalsContact O-CG2 3.32Å; I407-V411 WeakPolarHBondContact O-CG2 3.34Å; I407-V411 PolarHBondContact O-N 2.67Å
408	R	86.1	Confident	86.3	Confident	125 Å²	125	95.8 Å²	95.8	47%	0.472	46%	0.462	S	S	.	.	H	α-helix	trans	-58.1	-48.8	179.9	-78.6	179.5	179.3	174.9	1.7	113.7	Q403 Y410 V411 R412	Q403-R408 WeakPolarHBondContact O-CB 3.39Å; Q403-R408 VanDerWaalsContact O-CG 3.32Å; Q403-R408 WeakPolarHBondContact O-CG 3.3Å; Q403-R408 PolarHBondContact O-N 2.79Å; R408-Y410 VanDerWaalsContact C-N 3.34Å; R408-Y410 PolarHBondContact O-N 2.86Å; R408-V411 PolarHBondContact O-N 2.83Å; R408-R412 WeakPolarHBondContact O-CG 3.5Å; R408-R412 PolarHBondContact O-N 3.23Å
409	P	90.9	Very high	85.6	Confident	61 Å²	61	91.1 Å²	91.1	40%	0.396	44%	0.443	S	S	.	.	H	α-helix	trans	-64.8	-38.4	178	21.6	-30	0	0	0	111.9	Q404 L405 V406 R412 A413	Q404-P409 WeakPolarHBondContact O-CD 3.34Å; L405-P409 WeakPolarHBondContact O-CG 3.46Å; V406-P409 WeakPolarHBondContact O-CD 3.17Å; V406-P409 WeakPolarHBondContact O-CG 3.22Å; P409-R412 PolarHBondContact O-N 3.48Å; P409-A413 WeakPolarHBondContact O-CB 3.39Å; P409-A413 PolarHBondContact O-N 2.7Å
410	Y	85.3	Confident	85.3	Confident	147 Å²	147	93.6 Å²	93.6	58%	0.576	46%	0.456	S	S	*	.	H	α-helix	trans	-63.2	-45.3	177.1	-176.8	-96.3	0	0	0	112.8	V406 I407 R408 R412 A413 Q414	V406-Y410 WeakPolarHBondContact O-CB 3.26Å; V406-Y410 PolarHBondContact O-N 2.84Å; V406-Y410 VanDerWaalsContact O-N 3.14Å; I407-Y410 PolarHBondContact O-N 3.33Å; R408-Y410 VanDerWaalsContact C-N 3.34Å; R408-Y410 PolarHBondContact O-N 2.86Å; Y410-R412 VanDerWaalsContact C-N 3.34Å; Y410-R412 PolarHBondContact O-N 2.95Å; Y410-A413 PolarHBondContact O-N 3.44Å; Y410-Q414 HydrophobicContact CD1-CG 4.43Å; Y410-Q414 HydrophobicContact CE1-CG 3.97Å; Y410-Q414 PolarHBondContact O-N 2.78Å; Y410-Q414 PolarHBondContact OH-NE2 3.19Å
411	V	82.3	Confident	84.8	Confident	62 Å²	62	96 Å²	96	38%	0.376	46%	0.463	S	S	.	.	H	α-helix	trans	-65.5	-37.8	178	172.9	0	0	0	0	111.3	I407 R408 Q414 K415	I407-V411 HydrophobicContact CG2-CG2 4.22Å; I407-V411 VanDerWaalsContact O-CG2 3.32Å; I407-V411 WeakPolarHBondContact O-CG2 3.34Å; I407-V411 PolarHBondContact O-N 2.67Å; R408-V411 PolarHBondContact O-N 2.83Å; V411-Q414 PolarHBondContact O-N 3.35Å; V411-K415 WeakPolarHBondContact O-CG 3.3Å; V411-K415 PolarHBondContact O-N 3.4Å
412	R	83.9	Confident	83.8	Confident	169 Å²	169	99.1 Å²	99.1	64%	0.638	47%	0.47	S	S	*	.	H	α-helix	trans	-64	-47.4	174.1	-74.6	178.5	-177.4	-179.2	-1.1	111.6	R408 P409 Y410 Q414 K415 E416	R408-R412 WeakPolarHBondContact O-CG 3.5Å; R408-R412 PolarHBondContact O-N 3.23Å; P409-R412 PolarHBondContact O-N 3.48Å; Y410-R412 VanDerWaalsContact C-N 3.34Å; Y410-R412 PolarHBondContact O-N 2.95Å; R412-Q414 VanDerWaalsContact C-N 3.29Å; R412-Q414 PolarHBondContact O-N 2.8Å; R412-K415 PolarHBondContact O-N 2.85Å; R412-K415 VanDerWaalsContact O-N 3.14Å; R412-E416 WeakPolarHBondContact O-CG 3.32Å; R412-E416 PolarHBondContact O-N 3.45Å
413	A	86.5	Confident	83.1	Confident	41 Å²	41	100.1 Å²	100.1	34%	0.339	47%	0.47	S	S	.	.	H	α-helix	trans	-60.1	-38.2	176.6	0	0	0	0	0	112.2	P409 Y410 E416 Q417	P409-A413 WeakPolarHBondContact O-CB 3.39Å; P409-A413 PolarHBondContact O-N 2.7Å; Y410-A413 PolarHBondContact O-N 3.44Å; A413-E416 PolarHBondContact O-N 2.72Å; A413-Q417 WeakPolarHBondContact O-CG 3.37Å; A413-Q417 PolarHBondContact O-N 2.8Å
414	Q	82.6	Confident	82.7	Confident	81 Å²	81	105.5 Å²	105.5	38%	0.379	50%	0.495	S	S	.	.	H	α-helix	trans	-63.1	-46	173.2	-85.1	-166.3	-29.5	0	0	112.6	Y410 V411 R412 E416 Q417 E418	Y410-Q414 HydrophobicContact CD1-CG 4.43Å; Y410-Q414 HydrophobicContact CE1-CG 3.97Å; Y410-Q414 PolarHBondContact O-N 2.78Å; Y410-Q414 PolarHBondContact OH-NE2 3.19Å; V411-Q414 PolarHBondContact O-N 3.35Å; R412-Q414 VanDerWaalsContact C-N 3.29Å; R412-Q414 PolarHBondContact O-N 2.8Å; Q414-E416 VanDerWaalsContact C-N 3.28Å; Q414-E416 PolarHBondContact O-N 2.88Å; Q414-Q417 PolarHBondContact O-N 2.83Å; Q414-E418 WeakPolarHBondContact O-CG 3.46Å; Q414-E418 PolarHBondContact O-N 2.79Å
415	K	80.6	Confident	82	Confident	141 Å²	141	101.8 Å²	101.8	61%	0.613	48%	0.484	S	S	*	.	H	α-helix	trans	-61.5	-39.1	176.8	-73.8	-175.8	177.3	-167.4	0	111.8	V411 R412 E418 L419	V411-K415 WeakPolarHBondContact O-CG 3.3Å; V411-K415 PolarHBondContact O-N 3.4Å; R412-K415 PolarHBondContact O-N 2.85Å; R412-K415 VanDerWaalsContact O-N 3.14Å; K415-E418 PolarHBondContact O-N 2.98Å; K415-L419 WeakPolarHBondContact O-CB 3.39Å; K415-L419 PolarHBondContact O-N 2.63Å
416	E	82.9	Confident	81	Confident	121 Å²	121	96.7 Å²	96.7	57%	0.565	46%	0.459	S	S	*	.	H	α-helix	trans	-63.7	-45.1	175.4	-74.7	171.9	-174.6	0	0	111.6	R412 A413 Q414 E418 L419 E420	R412-E416 WeakPolarHBondContact O-CG 3.32Å; R412-E416 PolarHBondContact O-N 3.45Å; A413-E416 PolarHBondContact O-N 2.72Å; Q414-E416 VanDerWaalsContact C-N 3.28Å; Q414-E416 PolarHBondContact O-N 2.88Å; E416-E418 PolarHBondContact O-N 3.07Å; E416-L419 WeakPolarHBondContact O-CB 3.28Å; E416-L419 PolarHBondContact O-N 2.83Å; E416-E420 WeakPolarHBondContact O-CG 3.22Å; E416-E420 PolarHBondContact O-N 2.79Å
417	Q	82.5	Confident	80.6	Confident	112 Å²	112	94.9 Å²	94.9	52%	0.523	45%	0.454	S	S	.	.	H	α-helix	trans	-63.6	-38.7	175.6	-74.6	-179.9	-4.4	0	0	113.1	A413 Q414 E420 K421	A413-Q417 WeakPolarHBondContact O-CG 3.37Å; A413-Q417 PolarHBondContact O-N 2.8Å; Q414-Q417 PolarHBondContact O-N 2.83Å; Q417-E420 PolarHBondContact O-N 2.86Å; Q417-K421 WeakPolarHBondContact O-CG 3.38Å; Q417-K421 PolarHBondContact O-N 2.8Å
418	E	78.9	Confident	80.4	Confident	125 Å²	125	96.3 Å²	96.3	58%	0.584	47%	0.469	S	S	*	.	H	α-helix	trans	-64.1	-42.8	174.9	-75.7	179.5	172.5	0	0	111.1	Q414 K415 E416 K421 Q422	Q414-E418 WeakPolarHBondContact O-CG 3.46Å; Q414-E418 PolarHBondContact O-N 2.79Å; K415-E418 PolarHBondContact O-N 2.98Å; E416-E418 PolarHBondContact O-N 3.07Å; E418-K421 PolarHBondContact O-N 3.33Å; E418-Q422 WeakPolarHBondContact O-CG 3.25Å; E418-Q422 PolarHBondContact O-N 2.82Å
419	L	76.8	Confident	80.1	Confident	41 Å²	41	95.4 Å²	95.4	22%	0.215	47%	0.473	C	S	.	.	H	α-helix	trans	-63.8	-39.8	175.1	-174.2	67.7	0	0	0	111.7	K415 E416 Q422 R423	K415-L419 WeakPolarHBondContact O-CB 3.39Å; K415-L419 PolarHBondContact O-N 2.63Å; E416-L419 WeakPolarHBondContact O-CB 3.28Å; E416-L419 PolarHBondContact O-N 2.83Å; L419-Q422 PolarHBondContact O-N 3.41Å; L419-R423 VanDerWaalsContact O-CG 3.25Å; L419-R423 WeakPolarHBondContact O-CG 3.26Å; L419-R423 PolarHBondContact O-N 2.63Å
420	E	81.1	Confident	79.7	Confident	105 Å²	105	94.5 Å²	94.5	49%	0.491	46%	0.464	S	S	.	.	H	α-helix	trans	-62.5	-45.6	175	-77	177.9	171.4	0	0	112.3	E416 Q417 Q422 R423 E424	E416-E420 WeakPolarHBondContact O-CG 3.22Å; E416-E420 PolarHBondContact O-N 2.79Å; Q417-E420 PolarHBondContact O-N 2.86Å; E420-Q422 VanDerWaalsContact C-N 3.33Å; E420-Q422 PolarHBondContact O-N 3.35Å; E420-R423 WeakPolarHBondContact O-CA 3.29Å; E420-R423 WeakPolarHBondContact O-CB 3.22Å; E420-R423 PolarHBondContact O-N 2.8Å; E420-R423 VanDerWaalsContact O-N 3.08Å; E420-E424 PolarHBondContact O-N 2.77Å
421	K	80.2	Confident	79.6	Confident	142 Å²	142	90 Å²	90	62%	0.617	46%	0.457	S	S	*	.	H	α-helix	trans	-61.8	-41.3	175.7	-74	177.9	-179.4	-179	0	112.4	Q417 E418 R423 E424 S425	Q417-K421 WeakPolarHBondContact O-CG 3.38Å; Q417-K421 PolarHBondContact O-N 2.8Å; E418-K421 PolarHBondContact O-N 3.33Å; K421-R423 VanDerWaalsContact C-N 3.26Å; K421-R423 PolarHBondContact O-N 3.44Å; K421-E424 PolarHBondContact O-N 2.94Å; K421-S425 PolarHBondContact O-N 2.91Å; K421-S425 PolarHBondContact O-OG 3.36Å
422	Q	71.7	Confident	79.7	Confident	107 Å²	107	93.1 Å²	93.1	50%	0.5	47%	0.466	S	S	.	.	H	α-helix	trans	-62.3	-35.6	174	-76.4	-178.2	-11.5	0	0	112.1	E418 L419 E420 S425 S426	E418-Q422 WeakPolarHBondContact O-CG 3.25Å; E418-Q422 PolarHBondContact O-N 2.82Å; L419-Q422 PolarHBondContact O-N 3.41Å; E420-Q422 VanDerWaalsContact C-N 3.33Å; E420-Q422 PolarHBondContact O-N 3.35Å; Q422-S425 PolarHBondContact O-OG 2.89Å; Q422-S425 VanDerWaalsContact O-OG 3.09Å; Q422-S426 WeakPolarHBondContact O-CB 3.26Å; Q422-S426 PolarHBondContact O-N 2.92Å; Q422-S426 PolarHBondContact O-OG 3.08Å
423	R	73.1	Confident	79.7	Confident	79 Å²	79	88.5 Å²	88.5	30%	0.298	45%	0.45	S	S	.	.	H	α-helix	trans	-67.1	-44.2	174.5	-71.9	166.3	178.4	173.4	2.5	111.6	L419 E420 K421 S426 A427 E520	L419-R423 VanDerWaalsContact O-CG 3.25Å; L419-R423 WeakPolarHBondContact O-CG 3.26Å; L419-R423 PolarHBondContact O-N 2.63Å; E420-R423 WeakPolarHBondContact O-CA 3.29Å; E420-R423 WeakPolarHBondContact O-CB 3.22Å; E420-R423 PolarHBondContact O-N 2.8Å; E420-R423 VanDerWaalsContact O-N 3.08Å; K421-R423 VanDerWaalsContact C-N 3.26Å; K421-R423 PolarHBondContact O-N 3.44Å; R423-S426 PolarHBondContact O-N 3.16Å; R423-A427 WeakPolarHBondContact O-CB 3.41Å; R423-A427 PolarHBondContact O-N 2.94Å; R423-E520 VanDerWaalsContact NH2-CD 3.33Å; R423-E520 IonicContact NH2-OE1 3.05Å; R423-E520 PolarHBondContact NH2-OE1 3.2Å; R423-E520 IonicContact NH2-OE2 3.93Å
424	E	78.6	Confident	79.7	Confident	151 Å²	151	90.6 Å²	90.6	71%	0.706	45%	0.452	S	S	*	.	H	α-helix	trans	-62	-45.7	177.6	-71.9	-179.7	171.8	0	0	111.7	E420 K421 S426 A427	E420-E424 PolarHBondContact O-N 2.77Å; K421-E424 PolarHBondContact O-N 2.94Å; E424-S426 VanDerWaalsContact C-N 3.29Å; E424-S426 PolarHBondContact O-N 2.8Å; E424-A427 WeakPolarHBondContact O-CB 3.42Å; E424-A427 PolarHBondContact O-N 2.74Å
425	S	74.4	Confident	79.9	Confident	54 Å²	54	93.2 Å²	93.2	38%	0.378	46%	0.464	S	S	.	.	H	α-helix	trans	-66.4	-32.7	177.9	68.7	0	0	0	0	112.6	K421 Q422	K421-S425 PolarHBondContact O-N 2.91Å; K421-S425 PolarHBondContact O-OG 3.36Å; Q422-S425 PolarHBondContact O-OG 2.89Å; Q422-S425 VanDerWaalsContact O-OG 3.09Å
426	S	71.6	Confident	80.1	Confident	26 Å²	26	90.6 Å²	90.6	18%	0.182	45%	0.454	C	S	.	.	H	α-helix	trans	-85.7	-12.4	179.4	-57.2	0	0	0	0	113.8	Q422 R423 E424 S428 N429 I430	Q422-S426 WeakPolarHBondContact O-CB 3.26Å; Q422-S426 PolarHBondContact O-N 2.92Å; Q422-S426 PolarHBondContact O-OG 3.08Å; R423-S426 PolarHBondContact O-N 3.16Å; E424-S426 VanDerWaalsContact C-N 3.29Å; E424-S426 PolarHBondContact O-N 2.8Å; S426-S428 PolarHBondContact O-N 2.68Å; S426-N429 PolarHBondContact O-N 2.83Å; S426-N429 VanDerWaalsContact O-N 3.1Å; S426-I430 VanDerWaalsContact O-CG1 3.31Å; S426-I430 WeakPolarHBondContact O-CG1 3.16Å; S426-I430 PolarHBondContact O-N 2.83Å
427	A	79.1	Confident	80.3	Confident	51 Å²	51	85 Å²	85	42%	0.421	43%	0.429	S	S	.	.	H	α-helix	trans	-60.1	-40.7	-172.1	0	0	0	0	0	113.3	R423 E424 N429 I430 A431	R423-A427 WeakPolarHBondContact O-CB 3.41Å; R423-A427 PolarHBondContact O-N 2.94Å; E424-A427 WeakPolarHBondContact O-CB 3.42Å; E424-A427 PolarHBondContact O-N 2.74Å; A427-N429 VanDerWaalsContact C-N 3.33Å; A427-N429 PolarHBondContact O-N 3.17Å; A427-I430 PolarHBondContact O-N 3.33Å; A427-A431 WeakPolarHBondContact O-CB 3.44Å; A427-A431 PolarHBondContact O-N 3.18Å
428	S	80	Confident	80.6	Confident	82 Å²	82	84.4 Å²	84.4	57%	0.573	43%	0.426	S	S	*	.	H	α-helix	trans	-64.5	-39.2	177.1	59.9	0	0	0	0	112	S426 A431 K432	S426-S428 PolarHBondContact O-N 2.68Å; S428-A431 PolarHBondContact O-N 3.38Å; S428-K432 PolarHBondContact O-N 2.82Å; S428-K432 VanDerWaalsContact O-N 3.12Å
429	N	79	Confident	80.9	Confident	105 Å²	105	79 Å²	79	56%	0.561	40%	0.403	S	S	*	.	H	α-helix	trans	-70	-41.8	179	-66.5	-18.6	0	0	0	110.9	S426 A427 A431 K432 K433	S426-N429 PolarHBondContact O-N 2.83Å; S426-N429 VanDerWaalsContact O-N 3.1Å; A427-N429 VanDerWaalsContact C-N 3.33Å; A427-N429 PolarHBondContact O-N 3.17Å; N429-A431 VanDerWaalsContact C-N 3.33Å; N429-A431 PolarHBondContact O-N 2.81Å; N429-K432 PolarHBondContact O-N 2.77Å; N429-K433 WeakPolarHBondContact O-CB 3.34Å; N429-K433 WeakPolarHBondContact O-CG 3.41Å; N429-K433 PolarHBondContact O-N 3.36Å
430	I	82.1	Confident	81.4	Confident	42 Å²	42	77.1 Å²	77.1	22%	0.215	39%	0.394	C	S	.	.	H	α-helix	trans	-60.7	-43.6	174.9	-65.2	165.1	0	0	0	110.3	S426 A427 K432 K433 K434 Y514 V518	S426-I430 VanDerWaalsContact O-CG1 3.31Å; S426-I430 WeakPolarHBondContact O-CG1 3.16Å; S426-I430 PolarHBondContact O-N 2.83Å; A427-I430 PolarHBondContact O-N 3.33Å; I430-K432 PolarHBondContact O-N 2.78Å; I430-K433 PolarHBondContact O-N 2.89Å; I430-K434 VanDerWaalsContact O-CB 3.24Å; I430-K434 WeakPolarHBondContact O-CB 3.41Å; I430-K434 PolarHBondContact O-N 2.78Å; I430-Y514 HydrophobicContact CG2-CD2 4.3Å; I430-Y514 HydrophobicContact CG2-CE2 4.26Å; I430-V518 HydrophobicContact CD1-CG2 3.72Å; I430-V518 HydrophobicContact CG1-CG2 3.99Å
431	A	83.6	Confident	81.7	Confident	52 Å²	52	73.6 Å²	73.6	43%	0.43	38%	0.379	S	S	.	.	H	α-helix	trans	-61.8	-42.7	178.3	0	0	0	0	0	112.4	A427 S428 N429 Q435	A427-A431 WeakPolarHBondContact O-CB 3.44Å; A427-A431 PolarHBondContact O-N 3.18Å; S428-A431 PolarHBondContact O-N 3.38Å; N429-A431 VanDerWaalsContact C-N 3.33Å; N429-A431 PolarHBondContact O-N 2.81Å; A431-Q435 WeakPolarHBondContact O-CG 3.45Å; A431-Q435 PolarHBondContact O-N 2.83Å
432	K	84.6	Confident	82.1	Confident	129 Å²	129	71.2 Å²	71.2	56%	0.561	37%	0.372	S	S	*	.	H	α-helix	trans	-64.3	-48.6	175.7	-172.8	-176.8	176.3	-169.3	0	111.7	S428 N429 I430 K434 Q435 E436	S428-K432 PolarHBondContact O-N 2.82Å; S428-K432 VanDerWaalsContact O-N 3.12Å; N429-K432 PolarHBondContact O-N 2.77Å; I430-K432 PolarHBondContact O-N 2.78Å; K432-K434 VanDerWaalsContact C-N 3.29Å; K432-K434 PolarHBondContact O-N 3Å; K432-Q435 WeakPolarHBondContact O-CB 3.29Å; K432-Q435 PolarHBondContact O-N 2.79Å; K432-Q435 VanDerWaalsContact O-N 3.13Å; K432-E436 VanDerWaalsContact CE-OE1 3.28Å; K432-E436 WeakPolarHBondContact CE-OE1 3.34Å; K432-E436 PolarHBondContact O-N 3.11Å
433	K	82.9	Confident	82.7	Confident	71 Å²	71	66.2 Å²	66.2	31%	0.309	35%	0.349	S	S	.	.	H	α-helix	trans	-63.8	-34.5	178.8	-75	-74.6	-179.2	-177.3	0	112.4	D13 N429 I430 E436 A437	D13-K433 IonicContact OD1-NZ 3.31Å; D13-K433 PolarHBondContact OD1-NZ 2.94Å; N429-K433 WeakPolarHBondContact O-CB 3.34Å; N429-K433 WeakPolarHBondContact O-CG 3.41Å; N429-K433 PolarHBondContact O-N 3.36Å; I430-K433 PolarHBondContact O-N 2.89Å; K433-E436 WeakPolarHBondContact CD-OE2 3.38Å; K433-E436 IonicContact NZ-OE2 3.33Å; K433-E436 PolarHBondContact O-N 3.43Å; K433-A437 WeakPolarHBondContact O-CB 3.39Å; K433-A437 PolarHBondContact O-N 2.79Å
434	K	87.8	Confident	83.4	Confident	86 Å²	86	62.7 Å²	62.7	37%	0.374	34%	0.336	S	S	.	.	H	α-helix	trans	-59.6	-45.8	171.9	175.9	178	174.6	-179.2	0	111.7	I430 K432 A437 E438 Y514	I430-K434 VanDerWaalsContact O-CB 3.24Å; I430-K434 WeakPolarHBondContact O-CB 3.41Å; I430-K434 PolarHBondContact O-N 2.78Å; K432-K434 VanDerWaalsContact C-N 3.29Å; K432-K434 PolarHBondContact O-N 3Å; K434-A437 PolarHBondContact O-N 3.15Å; K434-E438 WeakPolarHBondContact CE-OE1 3.41Å; K434-E438 IonicContact NZ-OE1 3.79Å; K434-E438 WeakPolarHBondContact O-CB 3.34Å; K434-E438 WeakPolarHBondContact O-CG 3.44Å; K434-E438 PolarHBondContact O-N 2.77Å; K434-Y514 HydrophobicContact CB-CD1 4.35Å; K434-Y514 HydrophobicContact CB-CD2 4.23Å; K434-Y514 HydrophobicContact CB-CE1 4.06Å; K434-Y514 HydrophobicContact CB-CE2 3.95Å; K434-Y514 HydrophobicContact CB-CG 4.42Å; K434-Y514 HydrophobicContact CD-CE2 4.48Å; K434-Y514 HydrophobicContact CG-CE1 3.85Å; K434-Y514 HydrophobicContact CG-CE2 4.25Å
435	Q	86.9	Confident	83.8	Confident	136 Å²	136	59.2 Å²	59.2	64%	0.636	32%	0.32	S	S	*	.	H	α-helix	trans	-63.4	-41.8	176.6	-70.1	176.8	-9.8	0	0	111.8	A431 K432 A437 E438 A439	A431-Q435 WeakPolarHBondContact O-CG 3.45Å; A431-Q435 PolarHBondContact O-N 2.83Å; K432-Q435 WeakPolarHBondContact O-CB 3.29Å; K432-Q435 PolarHBondContact O-N 2.79Å; K432-Q435 VanDerWaalsContact O-N 3.13Å; Q435-A437 VanDerWaalsContact C-N 3.35Å; Q435-A437 PolarHBondContact O-N 2.85Å; Q435-E438 PolarHBondContact O-N 2.8Å; Q435-A439 VanDerWaalsContact O-CB 3.31Å; Q435-A439 WeakPolarHBondContact O-CB 3.38Å; Q435-A439 PolarHBondContact O-N 2.93Å
436	E	84.3	Confident	84.3	Confident	85 Å²	85	62.1 Å²	62.1	40%	0.397	33%	0.328	S	S	.	.	H	α-helix	trans	-61.3	-41.7	175.4	-69.7	172.4	-168	0	0	111.9	K432 K433 A440	K432-E436 VanDerWaalsContact CE-OE1 3.28Å; K432-E436 WeakPolarHBondContact CE-OE1 3.34Å; K432-E436 PolarHBondContact O-N 3.11Å; K433-E436 WeakPolarHBondContact CD-OE2 3.38Å; K433-E436 IonicContact NZ-OE2 3.33Å; K433-E436 PolarHBondContact O-N 3.43Å; E436-A440 PolarHBondContact O-N 2.82Å
437	A	87.3	Confident	84.9	Confident	5 Å²	5	62 Å²	62	4%	0.041	33%	0.327	C	S	.	.	H	α-helix	trans	-67.4	-45.7	177.1	0	0	0	0	0	112.4	K433 K434 Q435 A439 A440 V441 Y514	K433-A437 WeakPolarHBondContact O-CB 3.39Å; K433-A437 PolarHBondContact O-N 2.79Å; K434-A437 PolarHBondContact O-N 3.15Å; Q435-A437 VanDerWaalsContact C-N 3.35Å; Q435-A437 PolarHBondContact O-N 2.85Å; A437-A439 VanDerWaalsContact C-N 3.32Å; A437-A439 PolarHBondContact O-N 2.82Å; A437-A440 PolarHBondContact O-N 2.88Å; A437-V441 VanDerWaalsContact O-CG2 3.28Å; A437-V441 WeakPolarHBondContact O-CG2 3.31Å; A437-V441 PolarHBondContact O-N 3.25Å; A437-Y514 HydrophobicContact CB-CD1 3.69Å; A437-Y514 HydrophobicContact CB-CG 4.45Å
438	E	88.7	Confident	85.3	Confident	98 Å²	98	60 Å²	60	46%	0.458	31%	0.309	S	S	.	.	H	α-helix	trans	-60.9	-41.5	177	-74.3	173.9	177.3	0	0	111.5	K434 Q435 V441 L442	K434-E438 WeakPolarHBondContact CE-OE1 3.41Å; K434-E438 IonicContact NZ-OE1 3.79Å; K434-E438 WeakPolarHBondContact O-CB 3.34Å; K434-E438 WeakPolarHBondContact O-CG 3.44Å; K434-E438 PolarHBondContact O-N 2.77Å; Q435-E438 PolarHBondContact O-N 2.8Å; E438-V441 PolarHBondContact O-N 3.16Å; E438-L442 WeakPolarHBondContact O-CG 3.42Å; E438-L442 PolarHBondContact O-N 2.97Å
439	A	86.3	Confident	85.8	Confident	12 Å²	12	64 Å²	64	10%	0.099	31%	0.312	C	S	.	.	H	α-helix	trans	-58.8	-48.5	172.2	0	0	0	0	0	112.4	Q54 Q435 A437 V441 L442 L443	Q54-A439 HydrophobicContact CG-CB 4.18Å; Q435-A439 VanDerWaalsContact O-CB 3.31Å; Q435-A439 WeakPolarHBondContact O-CB 3.38Å; Q435-A439 PolarHBondContact O-N 2.93Å; A437-A439 VanDerWaalsContact C-N 3.32Å; A437-A439 PolarHBondContact O-N 2.82Å; A439-V441 VanDerWaalsContact C-N 3.34Å; A439-V441 PolarHBondContact O-N 3.24Å; A439-L442 PolarHBondContact O-N 2.8Å; A439-L443 WeakPolarHBondContact O-CG 3.4Å; A439-L443 PolarHBondContact O-N 3.12Å
440	A	85.9	Confident	86.2	Confident	2 Å²	2	66.3 Å²	66.3	2%	0.017	31%	0.313	C	S	.	.	H	α-helix	trans	-61.3	-41.4	177.6	0	0	0	0	0	112.2	L58 E436 A437 L442 L443 M444	L58-A440 HydrophobicContact CD1-CB 3.86Å; E436-A440 PolarHBondContact O-N 2.82Å; A437-A440 PolarHBondContact O-N 2.88Å; A440-L442 VanDerWaalsContact C-N 3.34Å; A440-L442 PolarHBondContact O-N 2.82Å; A440-L443 PolarHBondContact O-N 2.84Å; A440-M444 VanDerWaalsContact O-CG 3.31Å; A440-M444 WeakPolarHBondContact O-CG 3.05Å; A440-M444 PolarHBondContact O-N 2.85Å
441	V	88.8	Confident	86.4	Confident	30 Å²	30	66.2 Å²	66.2	18%	0.182	31%	0.312	C	S	.	.	H	α-helix	trans	-59.3	-44.6	176.3	170	0	0	0	0	111.1	A437 E438 A439 L443 M444 Q445 V489 P490	A437-V441 VanDerWaalsContact O-CG2 3.28Å; A437-V441 WeakPolarHBondContact O-CG2 3.31Å; A437-V441 PolarHBondContact O-N 3.25Å; E438-V441 PolarHBondContact O-N 3.16Å; A439-V441 VanDerWaalsContact C-N 3.34Å; A439-V441 PolarHBondContact O-N 3.24Å; V441-L443 VanDerWaalsContact C-N 3.34Å; V441-L443 PolarHBondContact O-N 3.17Å; V441-M444 PolarHBondContact O-N 2.9Å; V441-Q445 WeakPolarHBondContact O-CG 3.29Å; V441-Q445 PolarHBondContact O-N 3.47Å; V441-V489 HydrophobicContact CG1-CB 4.08Å; V441-V489 HydrophobicContact CG1-CG1 4.18Å; V441-V489 HydrophobicContact CG1-CG2 4.46Å; V441-P490 HydrophobicContact CG2-CG 3.66Å
442	L	87.9	Confident	86.7	Confident	92 Å²	92	66 Å²	66	48%	0.482	30%	0.303	S	S	.	.	H	α-helix	trans	-60.8	-42.2	178.7	-73	170.5	0	0	0	112	L51 E438 A439 A440 M444 Q445	L51-L442 HydrophobicContact CD2-CB 4.16Å; E438-L442 WeakPolarHBondContact O-CG 3.42Å; E438-L442 PolarHBondContact O-N 2.97Å; A439-L442 PolarHBondContact O-N 2.8Å; A440-L442 VanDerWaalsContact C-N 3.34Å; A440-L442 PolarHBondContact O-N 2.82Å; L442-M444 VanDerWaalsContact C-N 3.27Å; L442-M444 PolarHBondContact O-N 2.82Å; L442-Q445 PolarHBondContact O-N 2.77Å
443	L	84.7	Confident	87	Confident	3 Å²	3	65.9 Å²	65.9	2%	0.016	30%	0.304	C	S	.	.	H	α-helix	trans	-63.8	-32.3	178.2	-66.7	171.2	0	0	0	113	L51 Q54 A55 L58 A439 A440 V441	L51-L443 HydrophobicContact CB-CD2 3.72Å; L51-L443 HydrophobicContact CD2-CD2 3.77Å; L51-L443 HydrophobicContact CD2-CG 4.28Å; L51-L443 HydrophobicContact CG-CD2 4.27Å; L51-L443 WeakPolarHBondContact O-CD2 3.41Å; Q54-L443 HydrophobicContact CB-CD1 3.92Å; A55-L443 HydrophobicContact CB-CD1 4.17Å; A55-L443 HydrophobicContact CB-CD2 4.12Å; L58-L443 HydrophobicContact CD1-CD1 3.79Å; A439-L443 WeakPolarHBondContact O-CG 3.4Å; A439-L443 PolarHBondContact O-N 3.12Å; A440-L443 PolarHBondContact O-N 2.84Å; V441-L443 VanDerWaalsContact C-N 3.34Å; V441-L443 PolarHBondContact O-N 3.17Å
444	M	86.1	Confident	87.3	Confident	5 Å²	5	64.8 Å²	64.8	3%	0.025	31%	0.309	C	S	.	.	H	α-helix	trans	-78.3	-21	-178	-67.6	171.3	-175.8	0	0	113.9	L40 Y41 A440 V441 L442 E446 S447 V448 V489 P490 C493 P511	L40-M444 HydrophobicContact CD2-CG 4.29Å; Y41-M444 HydrophobicContact CE1-CE 4.1Å; Y41-M444 HydrophobicContact CE1-CG 4.37Å; Y41-M444 WeakPolarHBondContact OH-CE 2.78Å; A440-M444 VanDerWaalsContact O-CG 3.31Å; A440-M444 WeakPolarHBondContact O-CG 3.05Å; A440-M444 PolarHBondContact O-N 2.85Å; V441-M444 PolarHBondContact O-N 2.9Å; L442-M444 VanDerWaalsContact C-N 3.27Å; L442-M444 PolarHBondContact O-N 2.82Å; M444-E446 PolarHBondContact O-N 3.24Å; M444-S447 PolarHBondContact O-N 2.69Å; M444-S447 VanDerWaalsContact O-N 3.07Å; M444-V448 HydrophobicContact CB-CG2 4.2Å; M444-V448 VanDerWaalsContact O-CG2 3.31Å; M444-V448 WeakPolarHBondContact O-CG2 3.35Å; M444-V448 PolarHBondContact O-N 3.28Å; M444-V489 HydrophobicContact CB-CG1 3.94Å; M444-P490 HydrophobicContact SD-CB 4.26Å; M444-P490 HydrophobicContact SD-CG 4.31Å; M444-C493 HydrophobicContact CG-CB 4.48Å; M444-C493 HydrophobicContact SD-CB 4.16Å; M444-P511 HydrophobicContact CE-CB 3.7Å
445	Q	87.1	Confident	87.4	Confident	78 Å²	78	61.4 Å²	61.4	36%	0.364	29%	0.294	S	S	.	.	H	α-helix	trans	-55.4	-45.1	-167.9	-68.8	-171.1	-10.5	0	0	113.6	V441 L442 S447 V448 R449 V489	V441-Q445 WeakPolarHBondContact O-CG 3.29Å; V441-Q445 PolarHBondContact O-N 3.47Å; L442-Q445 PolarHBondContact O-N 2.77Å; Q445-S447 PolarHBondContact O-N 3.39Å; Q445-V448 PolarHBondContact O-N 2.78Å; Q445-R449 WeakPolarHBondContact O-CG 3.34Å; Q445-R449 PolarHBondContact O-N 3.38Å; Q445-V489 HydrophobicContact CG-CG1 4.44Å
446	E	84.8	Confident	87.5	Confident	115 Å²	115	60.4 Å²	60.4	54%	0.537	29%	0.29	S	S	.	.	H	α-helix	trans	-66.1	-38.7	-179.8	-68.3	-169.5	172.1	0	0	112.5	M444 R450	M444-E446 PolarHBondContact O-N 3.24Å; E446-R450 PolarHBondContact O-N 3.45Å
447	S	85.1	Confident	87.7	Confident	24 Å²	24	60.9 Å²	60.9	17%	0.168	30%	0.302	C	S	.	.	H	α-helix	trans	-71	-39.7	178.7	-65.3	0	0	0	0	111	L40 M444 Q445 R449 R450 I451	L40-S447 WeakPolarHBondContact CD1-OG 3.42Å; M444-S447 PolarHBondContact O-N 2.69Å; M444-S447 VanDerWaalsContact O-N 3.07Å; Q445-S447 PolarHBondContact O-N 3.39Å; S447-R449 PolarHBondContact O-N 2.78Å; S447-R450 PolarHBondContact O-N 2.85Å; S447-I451 WeakPolarHBondContact O-CG1 3.27Å; S447-I451 PolarHBondContact O-N 2.91Å
448	V	88.3	Confident	87.8	Confident	8 Å²	8	69.5 Å²	69.5	5%	0.048	33%	0.334	C	S	.	.	H	α-helix	trans	-61.8	-42.1	175.7	168.4	0	0	0	0	111.5	M444 Q445 R450 I451 I452 V489 Q492 C493	M444-V448 HydrophobicContact CB-CG2 4.2Å; M444-V448 VanDerWaalsContact O-CG2 3.31Å; M444-V448 WeakPolarHBondContact O-CG2 3.35Å; M444-V448 PolarHBondContact O-N 3.28Å; Q445-V448 PolarHBondContact O-N 2.78Å; V448-R450 VanDerWaalsContact C-N 3.31Å; V448-R450 PolarHBondContact O-N 3.43Å; V448-I451 PolarHBondContact O-N 2.81Å; V448-I451 VanDerWaalsContact O-N 3.12Å; V448-I452 HydrophobicContact CG1-CD1 3.72Å; V448-I452 HydrophobicContact CG1-CG1 4.24Å; V448-I452 WeakPolarHBondContact O-CG1 3.33Å; V448-I452 PolarHBondContact O-N 3.2Å; V448-V489 HydrophobicContact CB-CG1 4.36Å; V448-V489 HydrophobicContact CG2-CG1 3.8Å; V448-V489 WeakPolarHBondContact CG2-O 3.31Å; V448-Q492 HydrophobicContact CG1-CB 3.89Å; V448-Q492 HydrophobicContact CG1-CG 3.66Å; V448-C493 HydrophobicContact CG2-CB 3.65Å
449	R	88.9	Confident	87.8	Confident	165 Å²	165	71 Å²	71	62%	0.623	34%	0.342	S	S	*	.	H	α-helix	trans	-55.8	-45.7	174.9	-75	179.6	-175.2	177.1	3.7	112.1	Q445 S447 I451 I452 E453	Q445-R449 WeakPolarHBondContact O-CG 3.34Å; Q445-R449 PolarHBondContact O-N 3.38Å; S447-R449 PolarHBondContact O-N 2.78Å; R449-I451 VanDerWaalsContact C-N 3.34Å; R449-I451 PolarHBondContact O-N 2.78Å; R449-I452 PolarHBondContact O-N 3.47Å; R449-E453 WeakPolarHBondContact O-CG 3.25Å; R449-E453 PolarHBondContact O-N 2.99Å
450	R	87.4	Confident	87.9	Confident	155 Å²	155	70.5 Å²	70.5	59%	0.585	34%	0.339	S	S	*	.	H	α-helix	trans	-64.8	-37.2	177.1	-63.7	177.9	-170.8	174.8	6.9	112.7	E446 S447 V448 A454	E446-R450 PolarHBondContact O-N 3.45Å; S447-R450 PolarHBondContact O-N 2.85Å; V448-R450 VanDerWaalsContact C-N 3.31Å; V448-R450 PolarHBondContact O-N 3.43Å; R450-A454 WeakPolarHBondContact O-CB 3.49Å; R450-A454 PolarHBondContact O-N 2.82Å
451	I	87.3	Confident	88.2	Confident	40 Å²	40	70.4 Å²	70.4	21%	0.205	34%	0.338	C	S	.	.	H	α-helix	trans	-66.3	-43.6	176.3	-66.6	164.9	0	0	0	110.1	S447 V448 R449 A454 E455	S447-I451 WeakPolarHBondContact O-CG1 3.27Å; S447-I451 PolarHBondContact O-N 2.91Å; V448-I451 PolarHBondContact O-N 2.81Å; V448-I451 VanDerWaalsContact O-N 3.12Å; R449-I451 VanDerWaalsContact C-N 3.34Å; R449-I451 PolarHBondContact O-N 2.78Å; I451-A454 PolarHBondContact O-N 2.88Å; I451-E455 HydrophobicContact CG2-CG 4.21Å; I451-E455 WeakPolarHBondContact O-CB 3.15Å; I451-E455 WeakPolarHBondContact O-CG 3.34Å; I451-E455 PolarHBondContact O-N 3.46Å
452	I	89.6	Confident	88.3	Confident	46 Å²	46	70 Å²	70	24%	0.236	33%	0.334	C	S	.	.	H	α-helix	trans	-60.3	-50.3	176.9	-67.9	167.6	0	0	0	110	V448 R449 A454 E455 E456 Q492	V448-I452 HydrophobicContact CG1-CD1 3.72Å; V448-I452 HydrophobicContact CG1-CG1 4.24Å; V448-I452 WeakPolarHBondContact O-CG1 3.33Å; V448-I452 PolarHBondContact O-N 3.2Å; R449-I452 PolarHBondContact O-N 3.47Å; I452-A454 VanDerWaalsContact C-N 3.3Å; I452-A454 PolarHBondContact O-N 2.77Å; I452-E455 PolarHBondContact O-N 2.87Å; I452-E456 HydrophobicContact CG2-CG 4.16Å; I452-E456 WeakPolarHBondContact O-CB 3.37Å; I452-E456 WeakPolarHBondContact O-CG 3.37Å; I452-E456 PolarHBondContact O-N 3.3Å; I452-Q492 HydrophobicContact CD1-CG 4.24Å; I452-Q492 HydrophobicContact CG1-CG 3.85Å
453	E	90.8	Very high	88.6	Confident	127 Å²	127	66 Å²	66	59%	0.593	31%	0.313	S	S	*	.	H	α-helix	trans	-57.4	-41.9	177.6	-71.4	169.9	-172.3	0	0	112.3	R449 S457	R449-E453 WeakPolarHBondContact O-CG 3.25Å; R449-E453 PolarHBondContact O-N 2.99Å; E453-S457 PolarHBondContact O-N 2.99Å
454	A	88.9	Confident	88.8	Confident	48 Å²	48	69 Å²	69	40%	0.397	33%	0.329	S	S	.	.	H	α-helix	trans	-67.8	-41.7	178.1	0	0	0	0	0	112.7	R450 I451 I452 S457	R450-A454 WeakPolarHBondContact O-CB 3.49Å; R450-A454 PolarHBondContact O-N 2.82Å; I451-A454 PolarHBondContact O-N 2.88Å; I452-A454 VanDerWaalsContact C-N 3.3Å; I452-A454 PolarHBondContact O-N 2.77Å; A454-S457 PolarHBondContact O-OG 3.42Å
455	E	90	Very high	89.1	Confident	15 Å²	15	71.6 Å²	71.6	7%	0.07	34%	0.343	C	S	.	.	H	α-helix	trans	-73.1	-36.1	178.4	-70.1	-72.9	155.9	0	0	111.6	I451 I452 S457 R458 M459 G460 L461 I462 V495 S498	I451-E455 HydrophobicContact CG2-CG 4.21Å; I451-E455 WeakPolarHBondContact O-CB 3.15Å; I451-E455 WeakPolarHBondContact O-CG 3.34Å; I451-E455 PolarHBondContact O-N 3.46Å; I452-E455 PolarHBondContact O-N 2.87Å; E455-S457 PolarHBondContact O-N 2.81Å; E455-R458 CarbonylContact O-C 3.47Å; E455-R458 PolarHBondContact O-N 2.87Å; E455-R458 VanDerWaalsContact O-N 3.11Å; E455-M459 PolarHBondContact O-N 2.87Å; E455-G460 PolarHBondContact O-N 2.77Å; E455-G460 WeakPolarHBondContact OE2-CA 3.42Å; E455-L461 PolarHBondContact OE2-N 2.85Å; E455-I462 HydrophobicContact CB-CG1 4.37Å; E455-V495 HydrophobicContact CG-CG1 4.43Å; E455-S498 PolarHBondContact OE1-N 3.2Å; E455-S498 VanDerWaalsContact OE1-N 3.09Å; E455-S498 VanDerWaalsContact OE2-CA 3.23Å; E455-S498 WeakPolarHBondContact OE2-CA 3.42Å; E455-S498 VanDerWaalsContact OE2-CB 3.26Å; E455-S498 WeakPolarHBondContact OE2-CB 3.24Å; E455-S498 PolarHBondContact OE2-N 3.06Å; E455-S498 PolarHBondContact OE2-OG 3.45Å
456	E	89.5	Confident	89.3	Confident	116 Å²	116	67.9 Å²	67.9	54%	0.542	33%	0.326	S	S	.	.	H	α-helix	trans	-58.4	-46.1	173.2	-81.6	-177.2	175	0	0	111.3	I452 R458 M459 I462	I452-E456 HydrophobicContact CG2-CG 4.16Å; I452-E456 WeakPolarHBondContact O-CB 3.37Å; I452-E456 WeakPolarHBondContact O-CG 3.37Å; I452-E456 PolarHBondContact O-N 3.3Å; E456-R458 PolarHBondContact O-N 2.93Å; E456-M459 PolarHBondContact O-N 3.21Å; E456-M459 VanDerWaalsContact O-N 3.09Å; E456-I462 HydrophobicContact CB-CD1 4.44Å; E456-I462 HydrophobicContact CG-CD1 3.43Å; E456-I462 VanDerWaalsContact CG-CD1 3.43Å
457	S	89.3	Confident	89.7	Confident	94 Å²	94	66.2 Å²	66.2	66%	0.657	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-21.1	178.3	76.4	0	0	0	0	113.8	E453 A454 E455	E453-S457 PolarHBondContact O-N 2.99Å; A454-S457 PolarHBondContact O-OG 3.42Å; E455-S457 PolarHBondContact O-N 2.81Å
458	R	89.1	Confident	89.9	Confident	186 Å²	186	65 Å²	65	70%	0.702	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.9	6.8	-178.2	-63	178	-177.8	-177.9	0.4	113.1	E455 E456 G460	E455-R458 CarbonylContact O-C 3.47Å; E455-R458 PolarHBondContact O-N 2.87Å; E455-R458 VanDerWaalsContact O-N 3.11Å; E456-R458 PolarHBondContact O-N 2.93Å; R458-G460 PolarHBondContact O-N 2.8Å
459	M	87.3	Confident	89.9	Confident	130 Å²	130	64.7 Å²	64.7	64%	0.64	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.4	42.7	-170.4	-62.3	-158.8	-67	0	0	112.6	E455 E456 R531	E455-M459 PolarHBondContact O-N 2.87Å; E456-M459 PolarHBondContact O-N 3.21Å; E456-M459 VanDerWaalsContact O-N 3.09Å; M459-R531 WeakPolarHBondContact O-CA 3.23Å; M459-R531 WeakPolarHBondContact O-CG 3.11Å; M459-R531 PolarHBondContact O-N 2.78Å; M459-R531 VanDerWaalsContact O-N 3.13Å
460	G	88.6	Confident	89.8	Confident	2 Å²	2	60.4 Å²	60.4	2%	0.021	29%	0.29	C	S	.	.			trans	-83	-150.6	-174.1	0	0	0	0	0	113.8	E455 R458 S498 F530	E455-G460 PolarHBondContact O-N 2.77Å; E455-G460 WeakPolarHBondContact OE2-CA 3.42Å; R458-G460 PolarHBondContact O-N 2.8Å; G460-S498 VanDerWaalsContact CA-OG 3.25Å; G460-S498 WeakPolarHBondContact CA-OG 3.43Å; G460-F530 WeakPolarHBondContact O-CA 3.4Å
461	L	91.6	Very high	89.3	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	119.7	-175.8	177.7	68.9	0	0	0	110.6	E455 Q492 V495 S498 L500 Y528 F530 I547	E455-L461 PolarHBondContact OE2-N 2.85Å; L461-Q492 PolarHBondContact O-NE2 2.83Å; L461-V495 HydrophobicContact CB-CG1 4.05Å; L461-V495 HydrophobicContact CD2-CG1 4.08Å; L461-V495 HydrophobicContact CD2-CG2 4.07Å; L461-V495 HydrophobicContact CG-CG1 4.32Å; L461-V495 HydrophobicContact CG-CG2 4.45Å; L461-S498 WeakPolarHBondContact CB-O 3.43Å; L461-L500 HydrophobicContact CD2-CB 3.9Å; L461-Y528 HydrophobicContact CD1-CD2 3.22Å; L461-Y528 HydrophobicContact CD1-CE2 3.8Å; L461-Y528 HydrophobicContact CD1-CG 3.84Å; L461-F530 HydrophobicContact CB-CD2 4.17Å; L461-F530 HydrophobicContact CD1-CB 4.29Å; L461-I547 HydrophobicContact CD1-CD1 4.45Å; L461-I547 HydrophobicContact CD2-CD1 4.16Å; L461-I547 HydrophobicContact CD2-CG1 3.98Å
462	I	92.3	Very high	88.3	Confident	21 Å²	21	57.9 Å²	57.9	11%	0.108	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	122.1	178.3	-58.5	166	0	0	0	109.2	E455 E456 Y528 Q529	E455-I462 HydrophobicContact CB-CG1 4.37Å; E456-I462 HydrophobicContact CB-CD1 4.44Å; E456-I462 HydrophobicContact CG-CD1 3.43Å; E456-I462 VanDerWaalsContact CG-CD1 3.43Å; I462-Y528 CarbonylContact O-C 3.56Å; I462-Y528 VanDerWaalsContact O-CA 3.22Å; I462-Y528 WeakPolarHBondContact O-CA 3.41Å; I462-Y528 WeakPolarHBondContact O-CB 3.44Å; I462-Q529 PolarHBondContact N-O 2.77Å; I462-Q529 PolarHBondContact O-N 2.77Å
463	I	93	Very high	86.6	Confident	8 Å²	8	62.1 Å²	62.1	4%	0.041	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	120.7	175.6	-56.5	179	0	0	0	108	A466 T488 L491 Q492 V495 L500 V526	I463-A466 HydrophobicContact CG2-CB 4.09Å; I463-T488 HydrophobicContact CG2-CG2 4.2Å; I463-L491 HydrophobicContact CD1-CB 3.5Å; I463-Q492 VanDerWaalsContact CB-OE1 3.3Å; I463-V495 HydrophobicContact CD1-CG2 4.03Å; I463-V495 HydrophobicContact CG1-CG2 4.35Å; I463-L500 HydrophobicContact CD1-CD2 4.05Å; I463-V526 HydrophobicContact CG2-CG1 3.89Å
464	L	90.4	Very high	84.2	Confident	65 Å²	65	61.5 Å²	61.5	34%	0.34	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	-48.7	-178.6	-67	173.5	0	0	0	111	T488 L527 Q529 M534	L464-T488 WeakPolarHBondContact O-CG2 3.4Å; L464-L527 HydrophobicContact CB-CD2 4.26Å; L464-L527 HydrophobicContact CB-CG 4.45Å; L464-L527 HydrophobicContact CD1-CD2 4.47Å; L464-L527 PolarHBondContact N-O 2.95Å; L464-Q529 HydrophobicContact CD1-CB 4.32Å; L464-M534 HydrophobicContact CD1-CE 3.28Å; L464-M534 HydrophobicContact CD1-SD 3.35Å; L464-M534 WeakPolarHBondContact CD1-SD 3.37Å
465	N	91.4	Very high	82	Confident	61 Å²	61	65.2 Å²	65.2	33%	0.326	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	135.8	179.2	-64.7	78.8	0	0	0	109.5	W467 L527	N465-W467 HydrophobicContact CB-CE3 4.36Å; N465-W467 HydrophobicContact CB-CH2 3.44Å; N465-W467 VanDerWaalsContact CB-CH2 3.44Å; N465-W467 HydrophobicContact CB-CZ2 3.61Å; N465-W467 HydrophobicContact CB-CZ3 3.84Å; N465-L527 HydrophobicContact CB-CB 4.18Å; N465-L527 HydrophobicContact CB-CD2 4.42Å; N465-L527 PolarHBondContact N-O 3.21Å; N465-L527 PolarHBondContact O-N 3.08Å
466	A	91.7	Very high	79.8	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	137.1	170.1	0	0	0	0	0	111.7	I463 V487 T488 L491 K525 V526	I463-A466 HydrophobicContact CG2-CB 4.09Å; A466-V487 HydrophobicContact CB-CG2 3.94Å; A466-V487 PolarHBondContact O-N 2.78Å; A466-T488 PolarHBondContact N-OG1 2.79Å; A466-L491 HydrophobicContact CB-CD1 3.42Å; A466-L491 VanDerWaalsContact CB-CD1 3.42Å; A466-K525 CarbonylContact C-O 3.57Å; A466-K525 VanDerWaalsContact CA-O 3.27Å; A466-K525 WeakPolarHBondContact CA-O 3.37Å; A466-V526 HydrophobicContact CB-CG1 4.32Å; A466-V526 HydrophobicContact CB-CG2 4.34Å
467	W	92.2	Very high	77.3	Confident	79 Å²	79	73.6 Å²	73.6	30%	0.299	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	128.3	-169	-69.7	-60.2	0	0	0	109.5	N465 F471 V484 I485 L524 K525	N465-W467 HydrophobicContact CB-CE3 4.36Å; N465-W467 HydrophobicContact CB-CH2 3.44Å; N465-W467 VanDerWaalsContact CB-CH2 3.44Å; N465-W467 HydrophobicContact CB-CZ2 3.61Å; N465-W467 HydrophobicContact CB-CZ3 3.84Å; W467-F471 HydrophobicContact CB-CE1 4.05Å; W467-F471 HydrophobicContact CB-CZ 3.58Å; W467-F471 VanDerWaalsContact O-CZ 3.32Å; W467-F471 WeakPolarHBondContact O-CZ 3.13Å; W467-V484 HydrophobicContact CB-CG1 3.43Å; W467-V484 VanDerWaalsContact CB-CG1 3.43Å; W467-V484 HydrophobicContact CG-CG1 3.92Å; W467-I485 CarbonylContact C-O 3.59Å; W467-I485 VanDerWaalsContact CA-O 3.31Å; W467-I485 WeakPolarHBondContact CA-O 3.27Å; W467-L524 CarbonylContact O-C 3.53Å; W467-L524 WeakPolarHBondContact O-CA 3.28Å; W467-K525 HydrophobicContact CB-CB 4.43Å; W467-K525 HydrophobicContact CE3-CB 4.36Å; W467-K525 HydrophobicContact CE3-CD 3.91Å; W467-K525 HydrophobicContact CE3-CG 4.06Å; W467-K525 HydrophobicContact CZ3-CD 4.23Å; W467-K525 PolarHBondContact N-O 2.81Å; W467-K525 PolarHBondContact O-N 2.78Å
468	Y	90.6	Very high	74.9	Confident	0 Å²	0	79.2 Å²	79.2	0%	0	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	131.2	-179.7	176.8	-103.4	0	0	0	111.2	V484 I485 K507 S508 F513 K522 S523 L524 D541	Y468-V484 CarbonylContact O-C 3.58Å; Y468-V484 VanDerWaalsContact O-CA 3.29Å; Y468-V484 WeakPolarHBondContact O-CA 3.31Å; Y468-I485 HydrophobicContact CD1-CD1 3.92Å; Y468-I485 HydrophobicContact CD1-CG1 3.97Å; Y468-I485 HydrophobicContact CG-CG1 4.43Å; Y468-I485 PolarHBondContact N-O 2.79Å; Y468-I485 VanDerWaalsContact O-CG1 3.31Å; Y468-I485 WeakPolarHBondContact O-CG1 3.25Å; Y468-I485 PolarHBondContact O-N 2.75Å; Y468-K507 HydrophobicContact CD2-CB 4.31Å; Y468-K507 HydrophobicContact CE2-CB 3.77Å; Y468-S508 WeakPolarHBondContact OH-CB 3.4Å; Y468-S508 PolarHBondContact OH-N 2.89Å; Y468-F513 HydrophobicContact CD1-CD1 4.08Å; Y468-F513 HydrophobicContact CD2-CD1 4.44Å; Y468-F513 HydrophobicContact CD2-CE1 4.38Å; Y468-F513 HydrophobicContact CG-CD1 4.01Å; Y468-F513 HydrophobicContact CG-CE1 4.16Å; Y468-K522 HydrophobicContact CE1-CD 4.32Å; Y468-K522 HydrophobicContact CE2-CB 4.34Å; Y468-S523 WeakPolarHBondContact CA-O 3.32Å; Y468-L524 HydrophobicContact CD2-CB 4.1Å; Y468-L524 HydrophobicContact CD2-CD1 4.44Å; Y468-D541 VanDerWaalsContact CE2-OD1 3.31Å; Y468-D541 WeakPolarHBondContact CE2-OD1 3.32Å; Y468-D541 VanDerWaalsContact CZ-OD1 3.31Å; Y468-D541 PolarHBondContact OH-OD1 2.82Å; Y468-D541 PolarHBondContact OH-OD2 2.78Å
469	G	88.3	Confident	72.5	Confident	0 Å²	0	78.6 Å²	78.6	0%	0	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	149.9	-156.9	178.8	0	0	0	0	0	112.8	F471 K483 S523	G469-F471 PolarHBondContact O-N 3.38Å; G469-K483 WeakPolarHBondContact CA-O 3.36Å; G469-S523 PolarHBondContact N-O 3.26Å; G469-S523 PolarHBondContact O-N 3.11Å
470	K	86.1	Confident	70.5	Confident	75 Å²	75	79.8 Å²	79.8	33%	0.326	40%	0.402	S	S	.	.			trans	-85.2	112.1	178.9	-173.5	177.8	-174.9	-176.1	0	110.4	K483 E520	K470-K483 PolarHBondContact N-O 3.25Å; K470-E520 HydrophobicContact CD-CB 4.28Å; K470-E520 WeakPolarHBondContact CD-OE2 3.27Å; K470-E520 VanDerWaalsContact NZ-CD 3.34Å; K470-E520 IonicContact NZ-OE1 3.56Å; K470-E520 PolarHBondContact NZ-OE1 3.18Å; K470-E520 IonicContact NZ-OE2 3.83Å
471	F	76.8	Confident	68.6	Low	51 Å²	51	91.1 Å²	91.1	22%	0.224	44%	0.444	C	S	.	.			trans	-94.1	121.9	170.5	-64.3	-80.6	0	0	0	109.7	W467 G469 T473 V484 S523 K525 L538	W467-F471 HydrophobicContact CB-CE1 4.05Å; W467-F471 HydrophobicContact CB-CZ 3.58Å; W467-F471 VanDerWaalsContact O-CZ 3.32Å; W467-F471 WeakPolarHBondContact O-CZ 3.13Å; G469-F471 PolarHBondContact O-N 3.38Å; F471-T473 PolarHBondContact O-N 3.42Å; F471-V484 HydrophobicContact CD1-CG2 4.31Å; F471-V484 HydrophobicContact CE1-CG1 4.29Å; F471-V484 HydrophobicContact CE1-CG2 3.96Å; F471-V484 HydrophobicContact CZ-CG1 4.2Å; F471-V484 HydrophobicContact CZ-CG2 4.24Å; F471-S523 WeakPolarHBondContact CD2-OG 3.45Å; F471-S523 VanDerWaalsContact CE2-O 3.28Å; F471-S523 WeakPolarHBondContact CE2-O 3.46Å; F471-K525 HydrophobicContact CE1-CB 4.05Å; F471-K525 HydrophobicContact CE1-CD 4.2Å; F471-K525 HydrophobicContact CE2-CB 3.84Å; F471-K525 HydrophobicContact CZ-CB 3.46Å; F471-K525 VanDerWaalsContact CZ-CB 3.46Å; F471-K525 HydrophobicContact CZ-CD 4.46Å; F471-L538 HydrophobicContact CD2-CD1 3.91Å; F471-L538 HydrophobicContact CE2-CD1 4.14Å; F471-L538 HydrophobicContact CG-CD1 4.45Å
472	V	66.1	Low	66.8	Low	92 Å²	92	94.1 Å²	94.1	56%	0.558	47%	0.469	S	S	*	.			trans	-81.6	115.8	172	-177.5	0	0	0	0	107.4	D474	V472-D474 PolarHBondContact O-N 3.04Å
473	T	54.6	Low	65.9	Low	134 Å²	134	97.6 Å²	97.6	82%	0.822	48%	0.483	S	S	*	.			trans	-79.6	13.2	-178.1	36.4	0	0	0	0	114.1	F471	F471-T473 PolarHBondContact O-N 3.42Å
474	D	40.4	Very low	65.5	Low	115 Å²	115	99 Å²	99	62%	0.615	49%	0.493	S	S	*	.	S	Bend	trans	-131.7	141.5	-174.3	-142.2	-14	0	0	0	115	V472 S476	V472-D474 PolarHBondContact O-N 3.04Å; D474-S476 PolarHBondContact O-N 3.28Å
475	S	42.2	Very low	65.4	Low	126 Å²	126	96.6 Å²	96.6	88%	0.881	48%	0.48	S	S	*	.	S	Bend	trans	-62.6	26.2	-175	53.1	0	0	0	0	115.8
476	S	43.6	Very low	65.4	Low	86 Å²	86	98.4 Å²	98.4	60%	0.601	49%	0.489	S	S	*	.			trans	-125.8	117.6	-175.8	-160.9	0	0	0	0	111.8	D474	D474-S476 PolarHBondContact O-N 3.28Å
477	R	37.2	Very low	65.3	Low	220 Å²	220	98.4 Å²	98.4	83%	0.83	49%	0.489	S	S	*	.			trans	83.6	94.3	166.3	-58.8	-175.8	174.2	-171.7	-2.2	117.6	H479	R477-H479 PolarHBondContact O-N 3.37Å
478	K	39.3	Very low	65.3	Low	212 Å²	212	95.6 Å²	95.6	92%	0.922	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.2	11.4	160.1	-88.5	177.7	170.4	177.1	0	118.4
479	H	38	Very low	65.4	Low	174 Å²	174	97.4 Å²	97.4	81%	0.806	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.7	-4.2	-171.3	-80.6	85.6	0	0	0	117.4	R477 R481	R477-H479 PolarHBondContact O-N 3.37Å; H479-R481 PolarHBondContact O-N 2.79Å
480	E	45.8	Very low	65.6	Low	155 Å²	155	97.5 Å²	97.5	72%	0.724	49%	0.493	S	S	*	.	S	Bend	trans	-81.3	101	162	-75.5	-174.5	-178.4	0	0	107.3	A482	E480-A482 PolarHBondContact O-N 2.93Å
481	R	48	Very low	65.8	Low	239 Å²	239	94 Å²	94	90%	0.902	48%	0.477	S	S	*	.			trans	-50.6	109.5	166.2	-74	179.8	170.7	177.7	-3.1	106.2	H479 K483	H479-R481 PolarHBondContact O-N 2.79Å; R481-K483 PolarHBondContact O-N 3.08Å
482	A	55.6	Low	66.5	Low	64 Å²	64	91.6 Å²	91.6	53%	0.529	47%	0.467	S	S	.	.			trans	-49.2	119.9	-179.7	0	0	0	0	0	107.5	E480 V484	E480-A482 PolarHBondContact O-N 2.93Å; A482-V484 HydrophobicContact CB-CB 4.23Å; A482-V484 HydrophobicContact CB-CG2 3.61Å; A482-V484 PolarHBondContact O-N 3.49Å
483	K	73.3	Confident	67.6	Low	93 Å²	93	88 Å²	88	40%	0.404	45%	0.446	S	S	.	.			trans	-72.7	73.1	-179.3	-67.2	-179.6	-172.6	172.3	0	108.2	G469 K470 R481 P516 C517 E520	G469-K483 WeakPolarHBondContact CA-O 3.36Å; K470-K483 PolarHBondContact N-O 3.25Å; R481-K483 PolarHBondContact O-N 3.08Å; K483-P516 WeakPolarHBondContact O-CG 3.32Å; K483-C517 HydrophobicContact CD-CB 4.42Å; K483-E520 IonicContact NZ-OE2 2.88Å
484	V	83.8	Confident	69.2	Low	39 Å²	39	83 Å²	83	24%	0.236	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	136.6	-164.3	172	0	0	0	0	107.6	W467 Y468 F471 A482	W467-V484 HydrophobicContact CB-CG1 3.43Å; W467-V484 VanDerWaalsContact CB-CG1 3.43Å; W467-V484 HydrophobicContact CG-CG1 3.92Å; Y468-V484 CarbonylContact O-C 3.58Å; Y468-V484 VanDerWaalsContact O-CA 3.29Å; Y468-V484 WeakPolarHBondContact O-CA 3.31Å; F471-V484 HydrophobicContact CD1-CG2 4.31Å; F471-V484 HydrophobicContact CE1-CG1 4.29Å; F471-V484 HydrophobicContact CE1-CG2 3.96Å; F471-V484 HydrophobicContact CZ-CG1 4.2Å; F471-V484 HydrophobicContact CZ-CG2 4.24Å; A482-V484 HydrophobicContact CB-CB 4.23Å; A482-V484 HydrophobicContact CB-CG2 3.61Å; A482-V484 PolarHBondContact O-N 3.49Å
485	I	88.9	Confident	71.6	Confident	13 Å²	13	78 Å²	78	7%	0.067	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	145.4	176.7	62.9	159.9	0	0	0	109.2	W467 Y468 V487 Y514 P516	W467-I485 CarbonylContact C-O 3.59Å; W467-I485 VanDerWaalsContact CA-O 3.31Å; W467-I485 WeakPolarHBondContact CA-O 3.27Å; Y468-I485 HydrophobicContact CD1-CD1 3.92Å; Y468-I485 HydrophobicContact CD1-CG1 3.97Å; Y468-I485 HydrophobicContact CG-CG1 4.43Å; Y468-I485 PolarHBondContact N-O 2.79Å; Y468-I485 VanDerWaalsContact O-CG1 3.31Å; Y468-I485 WeakPolarHBondContact O-CG1 3.25Å; Y468-I485 PolarHBondContact O-N 2.75Å; I485-V487 HydrophobicContact CD1-CG1 3.49Å; I485-V487 VanDerWaalsContact CD1-CG1 3.49Å; I485-V487 HydrophobicContact CG1-CG1 3.77Å; I485-Y514 HydrophobicContact CB-CE1 4.17Å; I485-Y514 HydrophobicContact CD1-CD1 3.92Å; I485-Y514 HydrophobicContact CD1-CE1 4.12Å; I485-Y514 HydrophobicContact CD1-CG 4.49Å; I485-Y514 WeakPolarHBondContact CD1-O 3.43Å; I485-Y514 HydrophobicContact CG2-CD1 4.29Å; I485-Y514 HydrophobicContact CG2-CE1 3.5Å; I485-Y514 HydrophobicContact CG2-CE2 3.95Å; I485-Y514 VanDerWaalsContact CG2-OH 3.28Å; I485-Y514 WeakPolarHBondContact CG2-OH 3.18Å; I485-P516 HydrophobicContact CG2-CB 4.01Å; I485-P516 HydrophobicContact CG2-CG 4.17Å
486	D	90.2	Very high	73.7	Confident	99 Å²	99	77.3 Å²	77.3	53%	0.529	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	119.3	172.4	-170.2	-20	0	0	0	109	T488	D486-T488 WeakPolarHBondContact OD1-CB 3.29Å; D486-T488 PolarHBondContact OD1-N 2.8Å; D486-T488 PolarHBondContact OD1-OG1 3.37Å
487	V	91.3	Very high	75.7	Confident	0 Å²	0	78.3 Å²	78.3	0%	0	37%	0.367	C	S	.	.			trans	-121.3	22.2	-177.9	-68	0	0	0	0	111.7	A466 I485 V489 P490 L491 F513 L524	A466-V487 HydrophobicContact CB-CG2 3.94Å; A466-V487 PolarHBondContact O-N 2.78Å; I485-V487 HydrophobicContact CD1-CG1 3.49Å; I485-V487 VanDerWaalsContact CD1-CG1 3.49Å; I485-V487 HydrophobicContact CG1-CG1 3.77Å; V487-V489 PolarHBondContact O-N 2.8Å; V487-P490 WeakPolarHBondContact O-CD 3.46Å; V487-L491 HydrophobicContact CG2-CD1 3.95Å; V487-L491 WeakPolarHBondContact O-CB 3.29Å; V487-L491 WeakPolarHBondContact O-CG 3.27Å; V487-L491 PolarHBondContact O-N 2.87Å; V487-L491 VanDerWaalsContact O-N 3.14Å; V487-F513 HydrophobicContact CB-CD1 4.3Å; V487-F513 HydrophobicContact CB-CD2 4.34Å; V487-F513 HydrophobicContact CB-CE1 3.78Å; V487-F513 HydrophobicContact CB-CE2 3.83Å; V487-F513 HydrophobicContact CB-CZ 3.51Å; V487-F513 HydrophobicContact CG1-CD1 3.69Å; V487-F513 HydrophobicContact CG1-CD2 4.03Å; V487-F513 HydrophobicContact CG1-CE1 3.67Å; V487-F513 HydrophobicContact CG1-CE2 4.02Å; V487-F513 HydrophobicContact CG1-CG 3.87Å; V487-F513 HydrophobicContact CG1-CZ 3.83Å; V487-F513 HydrophobicContact CG2-CE1 3.77Å; V487-F513 HydrophobicContact CG2-CZ 3.73Å; V487-L524 HydrophobicContact CG2-CD1 3.54Å
488	T	91.9	Very high	78.2	Confident	21 Å²	21	69 Å²	69	13%	0.129	34%	0.335	C	S	.	.	H	α-helix	trans	-58.9	-49	-179.6	-54.5	0	0	0	0	111.6	I463 L464 A466 D486 L491 Q492	I463-T488 HydrophobicContact CG2-CG2 4.2Å; L464-T488 WeakPolarHBondContact O-CG2 3.4Å; A466-T488 PolarHBondContact N-OG1 2.79Å; D486-T488 WeakPolarHBondContact OD1-CB 3.29Å; D486-T488 PolarHBondContact OD1-N 2.8Å; D486-T488 PolarHBondContact OD1-OG1 3.37Å; T488-L491 PolarHBondContact O-N 3.06Å; T488-Q492 WeakPolarHBondContact O-CB 3.5Å; T488-Q492 PolarHBondContact O-N 2.99Å
489	V	92.2	Very high	80.6	Confident	38 Å²	38	65.2 Å²	65.2	23%	0.23	32%	0.319	C	S	.	.	H	α-helix	trans	-66.6	-50.9	-177.3	174.9	0	0	0	0	111.8	V441 M444 Q445 V448 V487 L491 Q492 C493	V441-V489 HydrophobicContact CG1-CB 4.08Å; V441-V489 HydrophobicContact CG1-CG1 4.18Å; V441-V489 HydrophobicContact CG1-CG2 4.46Å; M444-V489 HydrophobicContact CB-CG1 3.94Å; Q445-V489 HydrophobicContact CG-CG1 4.44Å; V448-V489 HydrophobicContact CB-CG1 4.36Å; V448-V489 HydrophobicContact CG2-CG1 3.8Å; V448-V489 WeakPolarHBondContact CG2-O 3.31Å; V487-V489 PolarHBondContact O-N 2.8Å; V489-L491 VanDerWaalsContact C-N 3.32Å; V489-L491 PolarHBondContact O-N 3.29Å; V489-Q492 PolarHBondContact O-N 3.02Å; V489-C493 PolarHBondContact O-N 2.85Å; V489-C493 VanDerWaalsContact O-N 3.08Å
490	P	91.3	Very high	83.1	Confident	2 Å²	2	57 Å²	57	1%	0.013	28%	0.281	C	S	.	.	H	α-helix	trans	-53.6	-44.7	174.4	-31.7	38.3	0	0	0	114.1	V441 M444 V487 C493 L494 F513	V441-P490 HydrophobicContact CG2-CG 3.66Å; M444-P490 HydrophobicContact SD-CB 4.26Å; M444-P490 HydrophobicContact SD-CG 4.31Å; V487-P490 WeakPolarHBondContact O-CD 3.46Å; P490-C493 WeakPolarHBondContact O-CB 3.26Å; P490-C493 PolarHBondContact O-N 2.79Å; P490-L494 PolarHBondContact O-N 2.93Å; P490-F513 HydrophobicContact CB-CD2 4Å; P490-F513 HydrophobicContact CB-CE2 3.66Å; P490-F513 HydrophobicContact CG-CE2 4.5Å
491	L	91.6	Very high	85.3	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-69.8	-39.2	-179.3	-73.2	172	0	0	0	112.6	I463 A466 V487 T488 V489 C493 L494 L500 L502 F513 L524 V526	I463-L491 HydrophobicContact CD1-CB 3.5Å; A466-L491 HydrophobicContact CB-CD1 3.42Å; A466-L491 VanDerWaalsContact CB-CD1 3.42Å; V487-L491 HydrophobicContact CG2-CD1 3.95Å; V487-L491 WeakPolarHBondContact O-CB 3.29Å; V487-L491 WeakPolarHBondContact O-CG 3.27Å; V487-L491 PolarHBondContact O-N 2.87Å; V487-L491 VanDerWaalsContact O-N 3.14Å; T488-L491 PolarHBondContact O-N 3.06Å; V489-L491 VanDerWaalsContact C-N 3.32Å; V489-L491 PolarHBondContact O-N 3.29Å; L491-C493 PolarHBondContact O-N 2.82Å; L491-L494 PolarHBondContact O-N 2.79Å; L491-L494 VanDerWaalsContact O-N 3.07Å; L491-L500 HydrophobicContact CD2-CD2 4.18Å; L491-L502 HydrophobicContact CD2-CD1 3.87Å; L491-L502 HydrophobicContact CD2-CD2 4.01Å; L491-L502 HydrophobicContact CD2-CG 4.48Å; L491-F513 HydrophobicContact CD1-CZ 4.16Å; L491-F513 HydrophobicContact CD2-CE2 4.3Å; L491-F513 HydrophobicContact CD2-CZ 3.8Å; L491-F513 HydrophobicContact CG-CE2 4.2Å; L491-F513 HydrophobicContact CG-CZ 3.75Å; L491-L524 HydrophobicContact CD1-CD1 3.89Å; L491-L524 HydrophobicContact CD1-CD2 3.97Å; L491-L524 HydrophobicContact CD1-CG 4.45Å; L491-L524 HydrophobicContact CD2-CD2 4.38Å; L491-V526 HydrophobicContact CD1-CG2 4.08Å
492	Q	91.4	Very high	87.2	Confident	2 Å²	2	42.3 Å²	42.3	1%	0.009	23%	0.225	C	C	.	.	H	α-helix	trans	-63	-33.6	177	-173.8	60.9	31.8	0	0	110.7	V448 I452 L461 I463 T488 V489 L494 V495	V448-Q492 HydrophobicContact CG1-CB 3.89Å; V448-Q492 HydrophobicContact CG1-CG 3.66Å; I452-Q492 HydrophobicContact CD1-CG 4.24Å; I452-Q492 HydrophobicContact CG1-CG 3.85Å; L461-Q492 PolarHBondContact O-NE2 2.83Å; I463-Q492 VanDerWaalsContact CB-OE1 3.3Å; T488-Q492 WeakPolarHBondContact O-CB 3.5Å; T488-Q492 PolarHBondContact O-N 2.99Å; V489-Q492 PolarHBondContact O-N 3.02Å; Q492-L494 PolarHBondContact O-N 2.86Å; Q492-V495 WeakPolarHBondContact O-CB 3.1Å; Q492-V495 PolarHBondContact O-N 3.31Å
493	C	88.6	Confident	88.7	Confident	16 Å²	16	39.9 Å²	39.9	11%	0.108	20%	0.203	C	C	.	.	H	α-helix	trans	-66	-21.1	177.2	-149.3	0	0	0	0	113.6	L40 M444 V448 V489 P490 L491	L40-C493 VanDerWaalsContact CD1-SG 3.59Å; L40-C493 VanDerWaalsContact CD2-SG 3.53Å; M444-C493 HydrophobicContact CG-CB 4.48Å; M444-C493 HydrophobicContact SD-CB 4.16Å; V448-C493 HydrophobicContact CG2-CB 3.65Å; V489-C493 PolarHBondContact O-N 2.85Å; V489-C493 VanDerWaalsContact O-N 3.08Å; P490-C493 WeakPolarHBondContact O-CB 3.26Å; P490-C493 PolarHBondContact O-N 2.79Å; L491-C493 PolarHBondContact O-N 2.82Å
494	L	88.6	Confident	89.1	Confident	30 Å²	30	41.6 Å²	41.6	16%	0.157	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-7.5	177.7	-66	174	0	0	0	113.4	P490 L491 Q492 L500 L502 L510	P490-L494 PolarHBondContact O-N 2.93Å; L491-L494 PolarHBondContact O-N 2.79Å; L491-L494 VanDerWaalsContact O-N 3.07Å; Q492-L494 PolarHBondContact O-N 2.86Å; L494-L500 HydrophobicContact CB-CD1 3.41Å; L494-L500 VanDerWaalsContact CB-CD1 3.41Å; L494-L502 HydrophobicContact CD1-CD2 3.92Å; L494-L510 HydrophobicContact CD1-CD2 4.25Å
495	V	90.6	Very high	88.9	Confident	10 Å²	10	40.6 Å²	40.6	6%	0.061	21%	0.209	C	C	.	.			trans	-68.6	130.9	177.6	177.8	0	0	0	0	110.1	E455 L461 I463 Q492 L500	E455-V495 HydrophobicContact CG-CG1 4.43Å; L461-V495 HydrophobicContact CB-CG1 4.05Å; L461-V495 HydrophobicContact CD2-CG1 4.08Å; L461-V495 HydrophobicContact CD2-CG2 4.07Å; L461-V495 HydrophobicContact CG-CG1 4.32Å; L461-V495 HydrophobicContact CG-CG2 4.45Å; I463-V495 HydrophobicContact CD1-CG2 4.03Å; I463-V495 HydrophobicContact CG1-CG2 4.35Å; Q492-V495 WeakPolarHBondContact O-CB 3.1Å; Q492-V495 PolarHBondContact O-N 3.31Å; V495-L500 HydrophobicContact CG2-CB 4.31Å
496	K	85.7	Confident	88.7	Confident	110 Å²	110	40.2 Å²	40.2	48%	0.478	21%	0.207	S	C	.	.	B	Isolated β-bridge	trans	-143	135.1	175.5	-168.7	-168.5	172.5	-165.9	0	110.5	S498 K499	K496-S498 PolarHBondContact O-N 3.27Å; K496-K499 PolarHBondContact N-O 3.03Å; K496-K499 PolarHBondContact O-N 3.14Å; K496-K499 VanDerWaalsContact O-O 3.07Å
497	D	85.9	Confident	88.5	Confident	108 Å²	108	35.6 Å²	35.6	58%	0.578	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.1	43.1	178.1	-54.7	-46.3	0	0	0	111.4	K499	D497-K499 PolarHBondContact O-N 3.16Å
498	S	89.6	Confident	88.3	Confident	23 Å²	23	35.9 Å²	35.9	16%	0.161	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.9	29.4	-175.4	-44.6	0	0	0	0	115.7	E455 G460 L461 K496 P548	E455-S498 PolarHBondContact OE1-N 3.2Å; E455-S498 VanDerWaalsContact OE1-N 3.09Å; E455-S498 VanDerWaalsContact OE2-CA 3.23Å; E455-S498 WeakPolarHBondContact OE2-CA 3.42Å; E455-S498 VanDerWaalsContact OE2-CB 3.26Å; E455-S498 WeakPolarHBondContact OE2-CB 3.24Å; E455-S498 PolarHBondContact OE2-N 3.06Å; E455-S498 PolarHBondContact OE2-OG 3.45Å; G460-S498 VanDerWaalsContact CA-OG 3.25Å; G460-S498 WeakPolarHBondContact CA-OG 3.43Å; L461-S498 WeakPolarHBondContact CB-O 3.43Å; K496-S498 PolarHBondContact O-N 3.27Å; S498-P548 WeakPolarHBondContact O-CD 3.37Å
499	K	90.8	Very high	87.8	Confident	134 Å²	134	35.2 Å²	35.2	58%	0.583	18%	0.181	S	C	*	.	B	Isolated β-bridge	trans	-135	147.8	175.8	-64	176.6	-174.8	173.2	0	111.2	K496 D497 I547	K496-K499 PolarHBondContact N-O 3.03Å; K496-K499 PolarHBondContact O-N 3.14Å; K496-K499 VanDerWaalsContact O-O 3.07Å; D497-K499 PolarHBondContact O-N 3.16Å; K499-I547 WeakPolarHBondContact CA-O 3.32Å
500	L	90.9	Very high	87.5	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	131.8	168.8	173.9	77.6	0	0	0	109	L461 I463 L491 L494 V495 L502 R546 I547	L461-L500 HydrophobicContact CD2-CB 3.9Å; I463-L500 HydrophobicContact CD1-CD2 4.05Å; L491-L500 HydrophobicContact CD2-CD2 4.18Å; L494-L500 HydrophobicContact CB-CD1 3.41Å; L494-L500 VanDerWaalsContact CB-CD1 3.41Å; V495-L500 HydrophobicContact CG2-CB 4.31Å; L500-L502 HydrophobicContact CD1-CD2 4.24Å; L500-L502 HydrophobicContact CD2-CG 4.5Å; L500-R546 WeakPolarHBondContact O-CA 3.45Å; L500-I547 HydrophobicContact CB-CD1 4.06Å; L500-I547 HydrophobicContact CB-CG1 3.61Å; L500-I547 HydrophobicContact CD2-CD1 3.68Å; L500-I547 HydrophobicContact CD2-CG1 3.97Å; L500-I547 HydrophobicContact CG-CD1 4.46Å; L500-I547 HydrophobicContact CG-CG1 4.27Å; L500-I547 PolarHBondContact N-O 2.89Å; L500-I547 PolarHBondContact O-N 2.99Å
501	I	90.3	Very high	87.2	Confident	84 Å²	84	34.7 Å²	34.7	43%	0.431	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	116.3	178	-57.8	175.3	0	0	0	107.3	N20 L545 R546	N20-I501 PolarHBondContact ND2-O 2.78Å; I501-L545 CarbonylContact C-O 3.45Å; I501-L545 WeakPolarHBondContact CA-O 3.24Å; I501-R546 HydrophobicContact CG1-CG 4.26Å; I501-R546 HydrophobicContact CG2-CG 4.1Å
502	L	89.1	Confident	86.9	Confident	3 Å²	3	35 Å²	35	2%	0.016	18%	0.182	C	C	.	.			trans	-103.3	140.6	166.9	-55	-179.5	0	0	0	108.5	L491 L494 L500 K507 L510 L524 L545	L491-L502 HydrophobicContact CD2-CD1 3.87Å; L491-L502 HydrophobicContact CD2-CD2 4.01Å; L491-L502 HydrophobicContact CD2-CG 4.48Å; L494-L502 HydrophobicContact CD1-CD2 3.92Å; L500-L502 HydrophobicContact CD1-CD2 4.24Å; L500-L502 HydrophobicContact CD2-CG 4.5Å; L502-K507 HydrophobicContact CD1-CD 4.48Å; L502-L510 HydrophobicContact CD2-CD1 4.09Å; L502-L524 HydrophobicContact CD1-CD2 3.73Å; L502-L545 HydrophobicContact CB-CB 4.04Å; L502-L545 HydrophobicContact CD1-CB 4.02Å; L502-L545 HydrophobicContact CD1-CD2 4.06Å; L502-L545 HydrophobicContact CG-CB 4.21Å; L502-L545 PolarHBondContact N-O 2.78Å; L502-L545 PolarHBondContact O-N 2.85Å
503	T	86.1	Confident	86.8	Confident	13 Å²	13	35.5 Å²	35.5	8%	0.08	18%	0.184	C	C	.	.			trans	-87.1	-177.2	179.6	60.4	0	0	0	0	111.6	V21 R22 A505	V21-T503 PolarHBondContact O-OG1 2.81Å; R22-T503 HydrophobicContact CG-CG2 3.77Å; T503-A505 PolarHBondContact O-N 2.81Å
504	E	82.1	Confident	86.8	Confident	128 Å²	128	36.3 Å²	36.3	60%	0.598	19%	0.185	S	C	*	.	S	Bend	trans	-76.8	-1.7	180	-65.8	169.8	-165.7	0	0	112.8	T542 P544	E504-T542 CarbonylContact C-O 3.58Å; E504-T542 VanDerWaalsContact CA-O 3.3Å; E504-T542 WeakPolarHBondContact CA-O 3.47Å; E504-P544 HydrophobicContact CG-CB 3.87Å; E504-P544 HydrophobicContact CG-CG 3.75Å
505	A	80.4	Confident	86.7	Confident	19 Å²	19	35.9 Å²	35.9	16%	0.157	18%	0.183	C	C	.	.	S	Bend	trans	-70.5	152.4	175.9	0	0	0	0	0	110.9	T503 K507	T503-A505 PolarHBondContact O-N 2.81Å; A505-K507 PolarHBondContact O-N 2.77Å
506	S	84.2	Confident	86.3	Confident	4 Å²	4	36.6 Å²	36.6	3%	0.028	19%	0.188	C	C	.	.			trans	-55.8	131.1	177.4	177.1	0	0	0	0	110.8	S508 G509 D541	S506-S508 PolarHBondContact O-N 3.41Å; S506-S508 PolarHBondContact OG-N 3.09Å; S506-S508 PolarHBondContact OG-OG 3.4Å; S506-G509 PolarHBondContact O-N 2.81Å; S506-D541 PolarHBondContact OG-OD1 3.09Å; S506-D541 PolarHBondContact OG-OD2 3.14Å
507	K	86.4	Confident	86	Confident	2 Å²	2	31.6 Å²	31.6	1%	0.009	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-69.4	-22.2	-179	-70.9	160.2	-170.3	170.8	0	111.7	Y468 L502 A505 G509 L510 F513 L524 S539 G540 D541 E543	Y468-K507 HydrophobicContact CD2-CB 4.31Å; Y468-K507 HydrophobicContact CE2-CB 3.77Å; L502-K507 HydrophobicContact CD1-CD 4.48Å; A505-K507 PolarHBondContact O-N 2.77Å; K507-G509 PolarHBondContact O-N 2.8Å; K507-L510 HydrophobicContact CB-CD1 4.34Å; K507-L510 HydrophobicContact CG-CD1 4.44Å; K507-L510 WeakPolarHBondContact O-CB 3.3Å; K507-L510 PolarHBondContact O-N 3.4Å; K507-F513 HydrophobicContact CB-CD1 4.35Å; K507-F513 HydrophobicContact CB-CE1 4.25Å; K507-F513 VanDerWaalsContact O-CB 3.27Å; K507-F513 WeakPolarHBondContact O-CB 3.5Å; K507-F513 WeakPolarHBondContact O-CD1 3.26Å; K507-F513 WeakPolarHBondContact O-CG 3.46Å; K507-L524 HydrophobicContact CD-CB 3.96Å; K507-L524 HydrophobicContact CD-CD2 4.01Å; K507-S539 PolarHBondContact NZ-OG 3.13Å; K507-G540 WeakPolarHBondContact CE-O 3.32Å; K507-G540 PolarHBondContact NZ-O 3.34Å; K507-D541 WeakPolarHBondContact CB-OD1 3.43Å; K507-D541 VanDerWaalsContact CD-O 3.24Å; K507-D541 WeakPolarHBondContact CD-O 3.35Å; K507-D541 WeakPolarHBondContact CE-O 3.46Å; K507-D541 VanDerWaalsContact CG-O 3.25Å; K507-D541 WeakPolarHBondContact CG-O 3.3Å; K507-D541 PolarHBondContact N-O 3.47Å; K507-D541 PolarHBondContact N-OD1 2.92Å; K507-E543 VanDerWaalsContact CE-O 3.26Å; K507-E543 WeakPolarHBondContact CE-O 3.3Å; K507-E543 PolarHBondContact NZ-O 2.9Å
508	S	85.7	Confident	85.5	Confident	6 Å²	6	28.7 Å²	28.7	4%	0.042	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-68.1	-15.1	176.1	54	0	0	0	0	114.2	N12 Y468 S506	N12-S508 VanDerWaalsContact CG-OG 3.24Å; N12-S508 VanDerWaalsContact ND2-CB 3.33Å; N12-S508 WeakPolarHBondContact ND2-CB 3.41Å; N12-S508 PolarHBondContact ND2-OG 3.16Å; N12-S508 VanDerWaalsContact OD1-CB 3.25Å; N12-S508 WeakPolarHBondContact OD1-CB 3.36Å; N12-S508 PolarHBondContact OD1-O 3.05Å; N12-S508 PolarHBondContact OD1-OG 2.89Å; Y468-S508 WeakPolarHBondContact OH-CB 3.4Å; Y468-S508 PolarHBondContact OH-N 2.89Å; S506-S508 PolarHBondContact O-N 3.41Å; S506-S508 PolarHBondContact OG-N 3.09Å; S506-S508 PolarHBondContact OG-OG 3.4Å
509	G	82.3	Confident	84.7	Confident	7 Å²	7	30.5 Å²	30.5	7%	0.072	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-85.5	-6.5	176.7	0	0	0	0	0	114	N12 S506 K507	N12-G509 WeakPolarHBondContact OD1-CA 3.35Å; N12-G509 PolarHBondContact OD1-N 3.03Å; S506-G509 PolarHBondContact O-N 2.81Å; K507-G509 PolarHBondContact O-N 2.8Å
510	L	86.3	Confident	84.1	Confident	10 Å²	10	25.5 Å²	25.5	5%	0.052	15%	0.153	C	C	.	.	S	Bend	trans	-69.5	142.1	176.6	-67.9	168.8	0	0	0	110.6	S17 N20 L494 L502 K507 G512 F513	S17-L510 WeakPolarHBondContact O-CD2 3.47Å; N20-L510 HydrophobicContact CB-CD2 4.07Å; L494-L510 HydrophobicContact CD1-CD2 4.25Å; L502-L510 HydrophobicContact CD2-CD1 4.09Å; K507-L510 HydrophobicContact CB-CD1 4.34Å; K507-L510 HydrophobicContact CG-CD1 4.44Å; K507-L510 WeakPolarHBondContact O-CB 3.3Å; K507-L510 PolarHBondContact O-N 3.4Å; L510-G512 PolarHBondContact O-N 2.86Å; L510-F513 HydrophobicContact CB-CB 4.29Å; L510-F513 HydrophobicContact CB-CD2 3.5Å; L510-F513 HydrophobicContact CB-CE2 3.93Å; L510-F513 HydrophobicContact CB-CG 3.95Å; L510-F513 HydrophobicContact CD1-CD2 4.27Å; L510-F513 HydrophobicContact CD1-CE1 4.38Å; L510-F513 HydrophobicContact CD1-CE2 3.92Å; L510-F513 HydrophobicContact CD1-CZ 4Å; L510-F513 WeakPolarHBondContact O-CB 3.35Å; L510-F513 PolarHBondContact O-N 2.88Å
511	P	85	Confident	83.7	Confident	19 Å²	19	34.1 Å²	34.1	12%	0.123	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	129	173.2	-26.5	34.5	0	0	0	111.8	L18 Y41 M444 F513	L18-P511 HydrophobicContact CD1-CG 3.9Å; Y41-P511 WeakPolarHBondContact OH-CB 3.26Å; M444-P511 HydrophobicContact CE-CB 3.7Å; P511-F513 VanDerWaalsContact C-N 3.32Å
512	G	84.4	Confident	83.5	Confident	7 Å²	7	31.7 Å²	31.7	7%	0.072	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.7	0.5	-176	0	0	0	0	0	114.9	L510	L510-G512 PolarHBondContact O-N 2.86Å
513	F	90.1	Very high	83.6	Confident	12 Å²	12	32.6 Å²	32.6	5%	0.053	19%	0.187	C	C	.	.			trans	-100.9	155.3	168.3	-72.2	-120.7	0	0	0	110.6	Y468 V487 P490 L491 K507 L510 P511 L524	Y468-F513 HydrophobicContact CD1-CD1 4.08Å; Y468-F513 HydrophobicContact CD2-CD1 4.44Å; Y468-F513 HydrophobicContact CD2-CE1 4.38Å; Y468-F513 HydrophobicContact CG-CD1 4.01Å; Y468-F513 HydrophobicContact CG-CE1 4.16Å; V487-F513 HydrophobicContact CB-CD1 4.3Å; V487-F513 HydrophobicContact CB-CD2 4.34Å; V487-F513 HydrophobicContact CB-CE1 3.78Å; V487-F513 HydrophobicContact CB-CE2 3.83Å; V487-F513 HydrophobicContact CB-CZ 3.51Å; V487-F513 HydrophobicContact CG1-CD1 3.69Å; V487-F513 HydrophobicContact CG1-CD2 4.03Å; V487-F513 HydrophobicContact CG1-CE1 3.67Å; V487-F513 HydrophobicContact CG1-CE2 4.02Å; V487-F513 HydrophobicContact CG1-CG 3.87Å; V487-F513 HydrophobicContact CG1-CZ 3.83Å; V487-F513 HydrophobicContact CG2-CE1 3.77Å; V487-F513 HydrophobicContact CG2-CZ 3.73Å; P490-F513 HydrophobicContact CB-CD2 4Å; P490-F513 HydrophobicContact CB-CE2 3.66Å; P490-F513 HydrophobicContact CG-CE2 4.5Å; L491-F513 HydrophobicContact CD1-CZ 4.16Å; L491-F513 HydrophobicContact CD2-CE2 4.3Å; L491-F513 HydrophobicContact CD2-CZ 3.8Å; L491-F513 HydrophobicContact CG-CE2 4.2Å; L491-F513 HydrophobicContact CG-CZ 3.75Å; K507-F513 HydrophobicContact CB-CD1 4.35Å; K507-F513 HydrophobicContact CB-CE1 4.25Å; K507-F513 VanDerWaalsContact O-CB 3.27Å; K507-F513 WeakPolarHBondContact O-CB 3.5Å; K507-F513 WeakPolarHBondContact O-CD1 3.26Å; K507-F513 WeakPolarHBondContact O-CG 3.46Å; L510-F513 HydrophobicContact CB-CB 4.29Å; L510-F513 HydrophobicContact CB-CD2 3.5Å; L510-F513 HydrophobicContact CB-CE2 3.93Å; L510-F513 HydrophobicContact CB-CG 3.95Å; L510-F513 HydrophobicContact CD1-CD2 4.27Å; L510-F513 HydrophobicContact CD1-CE1 4.38Å; L510-F513 HydrophobicContact CD1-CE2 3.92Å; L510-F513 HydrophobicContact CD1-CZ 4Å; L510-F513 WeakPolarHBondContact O-CB 3.35Å; L510-F513 PolarHBondContact O-N 2.88Å; P511-F513 VanDerWaalsContact C-N 3.32Å; F513-L524 HydrophobicContact CE1-CD1 4.26Å
514	Y	87.5	Confident	83.8	Confident	34 Å²	34	32 Å²	32	13%	0.133	18%	0.183	C	C	.	.			trans	-150	166.3	163.5	68.9	-83.8	0	0	0	108.7	I430 K434 A437 I485 P516	I430-Y514 HydrophobicContact CG2-CD2 4.3Å; I430-Y514 HydrophobicContact CG2-CE2 4.26Å; K434-Y514 HydrophobicContact CB-CD1 4.35Å; K434-Y514 HydrophobicContact CB-CD2 4.23Å; K434-Y514 HydrophobicContact CB-CE1 4.06Å; K434-Y514 HydrophobicContact CB-CE2 3.95Å; K434-Y514 HydrophobicContact CB-CG 4.42Å; K434-Y514 HydrophobicContact CD-CE2 4.48Å; K434-Y514 HydrophobicContact CG-CE1 3.85Å; K434-Y514 HydrophobicContact CG-CE2 4.25Å; A437-Y514 HydrophobicContact CB-CD1 3.69Å; A437-Y514 HydrophobicContact CB-CG 4.45Å; I485-Y514 HydrophobicContact CB-CE1 4.17Å; I485-Y514 HydrophobicContact CD1-CD1 3.92Å; I485-Y514 HydrophobicContact CD1-CE1 4.12Å; I485-Y514 HydrophobicContact CD1-CG 4.49Å; I485-Y514 WeakPolarHBondContact CD1-O 3.43Å; I485-Y514 HydrophobicContact CG2-CD1 4.29Å; I485-Y514 HydrophobicContact CG2-CE1 3.5Å; I485-Y514 HydrophobicContact CG2-CE2 3.95Å; I485-Y514 VanDerWaalsContact CG2-OH 3.28Å; I485-Y514 WeakPolarHBondContact CG2-OH 3.18Å; Y514-P516 HydrophobicContact CE2-CB 4.34Å; Y514-P516 WeakPolarHBondContact O-CD 3.45Å
515	D	87	Confident	84.3	Confident	20 Å²	20	28.8 Å²	28.8	11%	0.107	17%	0.167	C	C	.	.			trans	-87.8	110.3	178.1	-177	-5.6	0	0	0	111.5	C517 V518 K522	D515-C517 WeakPolarHBondContact OD1-CA 3.19Å; D515-C517 PolarHBondContact OD1-N 2.78Å; D515-V518 HydrophobicContact CB-CG2 4.31Å; D515-V518 PolarHBondContact OD1-N 2.83Å; D515-V518 WeakPolarHBondContact OD2-CA 3.22Å; D515-K522 VanDerWaalsContact CG-CE 3.48Å; D515-K522 WeakPolarHBondContact OD1-CD 3.09Å; D515-K522 WeakPolarHBondContact OD1-CE 3.33Å; D515-K522 IonicContact OD1-NZ 3.91Å; D515-K522 PolarHBondContact OD1-NZ 2.8Å; D515-K522 VanDerWaalsContact OD2-CE 3.27Å; D515-K522 WeakPolarHBondContact OD2-CE 3.4Å; D515-K522 IonicContact OD2-NZ 3.65Å; D515-K522 PolarHBondContact OD2-NZ 2.79Å
516	P	82.7	Confident	84.8	Confident	26 Å²	26	27.9 Å²	27.9	17%	0.169	16%	0.159	C	C	.	.	S	Bend	trans	-82.8	-10	176.9	34.2	-35.9	0	0	0	114	K483 I485 Y514	K483-P516 WeakPolarHBondContact O-CG 3.32Å; I485-P516 HydrophobicContact CG2-CB 4.01Å; I485-P516 HydrophobicContact CG2-CG 4.17Å; Y514-P516 HydrophobicContact CE2-CB 4.34Å; Y514-P516 WeakPolarHBondContact O-CD 3.45Å
517	C	78.4	Confident	85.3	Confident	5 Å²	5	29 Å²	29	3%	0.034	17%	0.165	C	C	.	.	S	Bend	trans	-146.3	69.9	-174.3	51.3	0	0	0	0	111.5	K483 D515 G519 E520 K522	K483-C517 HydrophobicContact CD-CB 4.42Å; D515-C517 WeakPolarHBondContact OD1-CA 3.19Å; D515-C517 PolarHBondContact OD1-N 2.78Å; C517-G519 PolarHBondContact O-N 2.79Å; C517-E520 HydrophobicContact CB-CB 4.16Å; C517-E520 HydrophobicContact CB-CG 4.45Å; C517-E520 WeakPolarHBondContact CB-OE2 3.27Å; C517-E520 PolarHBondContact O-N 2.79Å; C517-E520 VanDerWaalsContact O-N 3.1Å; C517-K522 WeakPolarHBondContact O-CE 3.47Å; C517-K522 WeakPolarHBondContact SG-CG 3.22Å
518	V	76.4	Confident	85.6	Confident	47 Å²	47	28.9 Å²	28.9	29%	0.285	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	128.9	177.2	-177.9	0	0	0	0	110.5	I430 D515 E520	I430-V518 HydrophobicContact CD1-CG2 3.72Å; I430-V518 HydrophobicContact CG1-CG2 3.99Å; D515-V518 HydrophobicContact CB-CG2 4.31Å; D515-V518 PolarHBondContact OD1-N 2.83Å; D515-V518 WeakPolarHBondContact OD2-CA 3.22Å; V518-E520 VanDerWaalsContact C-N 3.3Å; V518-E520 PolarHBondContact O-N 2.92Å
519	G	72.4	Confident	85.9	Confident	61 Å²	61	31.6 Å²	31.6	63%	0.629	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.7	4	-179.6	0	0	0	0	0	115.1	C517	C517-G519 PolarHBondContact O-N 2.79Å
520	E	78.5	Confident	86.4	Confident	28 Å²	28	33.3 Å²	33.3	13%	0.131	18%	0.182	C	C	.	.	S	Bend	trans	-113.3	156.9	173.3	-54.1	-169.9	125.7	0	0	111.5	R423 K470 K483 C517 V518 K522	R423-E520 VanDerWaalsContact NH2-CD 3.33Å; R423-E520 IonicContact NH2-OE1 3.05Å; R423-E520 PolarHBondContact NH2-OE1 3.2Å; R423-E520 IonicContact NH2-OE2 3.93Å; K470-E520 HydrophobicContact CD-CB 4.28Å; K470-E520 WeakPolarHBondContact CD-OE2 3.27Å; K470-E520 VanDerWaalsContact NZ-CD 3.34Å; K470-E520 IonicContact NZ-OE1 3.56Å; K470-E520 PolarHBondContact NZ-OE1 3.18Å; K470-E520 IonicContact NZ-OE2 3.83Å; K483-E520 IonicContact NZ-OE2 2.88Å; C517-E520 HydrophobicContact CB-CB 4.16Å; C517-E520 HydrophobicContact CB-CG 4.45Å; C517-E520 WeakPolarHBondContact CB-OE2 3.27Å; C517-E520 PolarHBondContact O-N 2.79Å; C517-E520 VanDerWaalsContact O-N 3.1Å; V518-E520 VanDerWaalsContact C-N 3.3Å; V518-E520 PolarHBondContact O-N 2.92Å; E520-K522 VanDerWaalsContact O-CE 3.3Å; E520-K522 WeakPolarHBondContact O-CE 3.31Å; E520-K522 PolarHBondContact O-N 3.46Å
521	E	82.3	Confident	86.5	Confident	181 Å²	181	41.3 Å²	41.3	85%	0.846	21%	0.212	S	C	*	.			trans	-64.5	131.2	174.3	-69.9	-178	-177.5	0	0	111.4
522	K	86.7	Confident	86.5	Confident	34 Å²	34	42.8 Å²	42.8	15%	0.148	23%	0.23	C	C	.	.			trans	-120.4	144.7	-176.3	-77.6	165	-99.6	152.7	0	110.9	Y468 D515 C517 E520 D541	Y468-K522 HydrophobicContact CE1-CD 4.32Å; Y468-K522 HydrophobicContact CE2-CB 4.34Å; D515-K522 VanDerWaalsContact CG-CE 3.48Å; D515-K522 WeakPolarHBondContact OD1-CD 3.09Å; D515-K522 WeakPolarHBondContact OD1-CE 3.33Å; D515-K522 IonicContact OD1-NZ 3.91Å; D515-K522 PolarHBondContact OD1-NZ 2.8Å; D515-K522 VanDerWaalsContact OD2-CE 3.27Å; D515-K522 WeakPolarHBondContact OD2-CE 3.4Å; D515-K522 IonicContact OD2-NZ 3.65Å; D515-K522 PolarHBondContact OD2-NZ 2.79Å; C517-K522 WeakPolarHBondContact O-CE 3.47Å; C517-K522 WeakPolarHBondContact SG-CG 3.22Å; E520-K522 VanDerWaalsContact O-CE 3.3Å; E520-K522 WeakPolarHBondContact O-CE 3.31Å; E520-K522 PolarHBondContact O-N 3.46Å; K522-D541 HydrophobicContact CB-CB 4.22Å; K522-D541 PolarHBondContact O-N 2.83Å; K522-D541 VanDerWaalsContact O-N 3.1Å
523	S	90.2	Very high	86.8	Confident	22 Å²	22	44.8 Å²	44.8	15%	0.154	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	162.1	171.5	35	0	0	0	0	111.5	Y468 G469 F471 S539	Y468-S523 WeakPolarHBondContact CA-O 3.32Å; G469-S523 PolarHBondContact N-O 3.26Å; G469-S523 PolarHBondContact O-N 3.11Å; F471-S523 WeakPolarHBondContact CD2-OG 3.45Å; F471-S523 VanDerWaalsContact CE2-O 3.28Å; F471-S523 WeakPolarHBondContact CE2-O 3.46Å; S523-S539 CarbonylContact C-O 3.56Å; S523-S539 VanDerWaalsContact CA-O 3.29Å; S523-S539 WeakPolarHBondContact CA-O 3.41Å; S523-S539 VanDerWaalsContact CB-O 3.3Å; S523-S539 WeakPolarHBondContact CB-O 3.34Å
524	L	90.9	Very high	86.8	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	120.7	175.3	176.9	67	0	0	0	108.7	W467 Y468 V487 L491 L502 K507 F513 V526 L538 S539 L545	W467-L524 CarbonylContact O-C 3.53Å; W467-L524 WeakPolarHBondContact O-CA 3.28Å; Y468-L524 HydrophobicContact CD2-CB 4.1Å; Y468-L524 HydrophobicContact CD2-CD1 4.44Å; V487-L524 HydrophobicContact CG2-CD1 3.54Å; L491-L524 HydrophobicContact CD1-CD1 3.89Å; L491-L524 HydrophobicContact CD1-CD2 3.97Å; L491-L524 HydrophobicContact CD1-CG 4.45Å; L491-L524 HydrophobicContact CD2-CD2 4.38Å; L502-L524 HydrophobicContact CD1-CD2 3.73Å; K507-L524 HydrophobicContact CD-CB 3.96Å; K507-L524 HydrophobicContact CD-CD2 4.01Å; F513-L524 HydrophobicContact CE1-CD1 4.26Å; L524-V526 HydrophobicContact CD1-CG2 4.18Å; L524-V526 HydrophobicContact CD2-CG2 3.74Å; L524-V526 HydrophobicContact CG-CG2 3.65Å; L524-L538 CarbonylContact O-C 3.35Å; L524-L538 WeakPolarHBondContact O-CA 3.32Å; L524-S539 PolarHBondContact N-O 3Å; L524-S539 PolarHBondContact O-N 2.77Å; L524-L545 HydrophobicContact CD2-CD2 4.16Å
525	K	91.9	Very high	87.1	Confident	60 Å²	60	46.6 Å²	46.6	26%	0.261	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	123.3	171.5	-177	177.2	175.5	176.1	0	109	A466 W467 F471 Q536 V537 L538	A466-K525 CarbonylContact C-O 3.57Å; A466-K525 VanDerWaalsContact CA-O 3.27Å; A466-K525 WeakPolarHBondContact CA-O 3.37Å; W467-K525 HydrophobicContact CB-CB 4.43Å; W467-K525 HydrophobicContact CE3-CB 4.36Å; W467-K525 HydrophobicContact CE3-CD 3.91Å; W467-K525 HydrophobicContact CE3-CG 4.06Å; W467-K525 HydrophobicContact CZ3-CD 4.23Å; W467-K525 PolarHBondContact N-O 2.81Å; W467-K525 PolarHBondContact O-N 2.78Å; F471-K525 HydrophobicContact CE1-CB 4.05Å; F471-K525 HydrophobicContact CE1-CD 4.2Å; F471-K525 HydrophobicContact CE2-CB 3.84Å; F471-K525 HydrophobicContact CZ-CB 3.46Å; F471-K525 VanDerWaalsContact CZ-CB 3.46Å; F471-K525 HydrophobicContact CZ-CD 4.46Å; K525-Q536 VanDerWaalsContact CE-NE2 3.27Å; K525-V537 CarbonylContact C-O 3.52Å; K525-V537 WeakPolarHBondContact CA-O 3.28Å; K525-L538 HydrophobicContact CB-CD1 3.88Å; K525-L538 HydrophobicContact CG-CD1 4.5Å
526	V	92.4	Very high	87.3	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	128.2	-179.6	-169.6	0	0	0	0	109.8	I463 A466 L491 L524 Y528 Q536 V537 L545 I547	I463-V526 HydrophobicContact CG2-CG1 3.89Å; A466-V526 HydrophobicContact CB-CG1 4.32Å; A466-V526 HydrophobicContact CB-CG2 4.34Å; L491-V526 HydrophobicContact CD1-CG2 4.08Å; L524-V526 HydrophobicContact CD1-CG2 4.18Å; L524-V526 HydrophobicContact CD2-CG2 3.74Å; L524-V526 HydrophobicContact CG-CG2 3.65Å; V526-Y528 HydrophobicContact CG1-CD1 4.14Å; V526-Q536 WeakPolarHBondContact O-CA 3.37Å; V526-V537 HydrophobicContact CB-CG1 3.87Å; V526-V537 HydrophobicContact CG2-CG1 4.38Å; V526-V537 PolarHBondContact N-O 2.83Å; V526-V537 PolarHBondContact O-N 2.8Å; V526-L545 HydrophobicContact CG2-CD2 4.02Å; V526-I547 HydrophobicContact CG1-CD1 4.33Å
527	L	93.1	Very high	87.7	Confident	27 Å²	27	49.2 Å²	49.2	14%	0.141	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	122.1	169.5	-174.7	75.9	0	0	0	108	L464 N465 M534 H535 Q536 I554	L464-L527 HydrophobicContact CB-CD2 4.26Å; L464-L527 HydrophobicContact CB-CG 4.45Å; L464-L527 HydrophobicContact CD1-CD2 4.47Å; L464-L527 PolarHBondContact N-O 2.95Å; N465-L527 HydrophobicContact CB-CB 4.18Å; N465-L527 HydrophobicContact CB-CD2 4.42Å; N465-L527 PolarHBondContact N-O 3.21Å; N465-L527 PolarHBondContact O-N 3.08Å; L527-M534 HydrophobicContact CD1-CE 4.33Å; L527-M534 HydrophobicContact CD2-CE 4.09Å; L527-M534 HydrophobicContact CG-CE 4.26Å; L527-H535 WeakPolarHBondContact CA-O 3.5Å; L527-Q536 HydrophobicContact CD1-CB 4.14Å; L527-I554 HydrophobicContact CD1-CD1 3.54Å
528	Y	93.5	Very high	88.3	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	154.8	-176.4	66.7	-92.7	0	0	0	112	L461 I462 V526 F530 H535 V537 I547 P548 K549 H552	L461-Y528 HydrophobicContact CD1-CD2 3.22Å; L461-Y528 HydrophobicContact CD1-CE2 3.8Å; L461-Y528 HydrophobicContact CD1-CG 3.84Å; I462-Y528 CarbonylContact O-C 3.56Å; I462-Y528 VanDerWaalsContact O-CA 3.22Å; I462-Y528 WeakPolarHBondContact O-CA 3.41Å; I462-Y528 WeakPolarHBondContact O-CB 3.44Å; V526-Y528 HydrophobicContact CG1-CD1 4.14Å; Y528-F530 HydrophobicContact CD2-CB 4.45Å; Y528-F530 HydrophobicContact CE2-CB 4.43Å; Y528-H535 HydrophobicContact CD1-CB 4.1Å; Y528-H535 HydrophobicContact CD2-CB 3.79Å; Y528-H535 HydrophobicContact CE1-CB 3.66Å; Y528-H535 HydrophobicContact CE2-CB 3.32Å; Y528-H535 AromaticContact CE2-CG 3.54Å; Y528-H535 AromaticContact CE2-ND1 3.88Å; Y528-H535 HydrophobicContact CG-CB 4.17Å; Y528-H535 AromaticContact CZ-CG 3.78Å; Y528-H535 PolarHBondContact N-O 2.82Å; Y528-H535 PolarHBondContact O-N 3.31Å; Y528-V537 HydrophobicContact CE1-CG1 4.23Å; Y528-I547 HydrophobicContact CD1-CD1 3.71Å; Y528-I547 HydrophobicContact CE1-CB 3.91Å; Y528-I547 HydrophobicContact CE1-CD1 3.89Å; Y528-I547 HydrophobicContact CE1-CG1 4.49Å; Y528-I547 HydrophobicContact CE1-CG2 3.68Å; Y528-I547 HydrophobicContact CE2-CB 4.39Å; Y528-I547 HydrophobicContact CG-CD1 4.1Å; Y528-P548 HydrophobicContact CE2-CB 3.85Å; Y528-K549 PolarHBondContact OH-N 2.76Å; Y528-H552 HydrophobicContact CE1-CB 4.4Å; Y528-H552 WeakPolarHBondContact OH-CB 3.47Å; Y528-H552 PolarHBondContact OH-ND1 2.96Å; Y528-H552 VanDerWaalsContact OH-ND1 3.09Å
529	Q	92.6	Very high	89	Confident	64 Å²	64	51.2 Å²	51.2	30%	0.299	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	135.3	173.6	-166.7	177.4	19.1	0	0	109.3	I462 L464 G532 V533 M534	I462-Q529 PolarHBondContact N-O 2.77Å; I462-Q529 PolarHBondContact O-N 2.77Å; L464-Q529 HydrophobicContact CD1-CB 4.32Å; Q529-G532 PolarHBondContact NE2-O 2.94Å; Q529-V533 WeakPolarHBondContact CA-O 3.47Å; Q529-M534 HydrophobicContact CB-SD 4.26Å; Q529-M534 HydrophobicContact CG-SD 4.36Å
530	F	91.8	Very high	89.8	Confident	42 Å²	42	49.6 Å²	49.6	18%	0.184	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	125.6	173.2	179.1	-109.7	0	0	0	109.3	G460 L461 Y528 G532 V533 P548	G460-F530 WeakPolarHBondContact O-CA 3.4Å; L461-F530 HydrophobicContact CB-CD2 4.17Å; L461-F530 HydrophobicContact CD1-CB 4.29Å; Y528-F530 HydrophobicContact CD2-CB 4.45Å; Y528-F530 HydrophobicContact CE2-CB 4.43Å; F530-G532 PolarHBondContact O-N 2.76Å; F530-V533 PolarHBondContact N-O 2.86Å; F530-V533 PolarHBondContact O-N 2.87Å; F530-P548 HydrophobicContact CB-CB 4.06Å; F530-P548 HydrophobicContact CD1-CB 3.8Å; F530-P548 HydrophobicContact CD1-CG 3.72Å; F530-P548 HydrophobicContact CD2-CB 4.29Å; F530-P548 HydrophobicContact CD2-CG 3.82Å; F530-P548 HydrophobicContact CE1-CB 4.31Å; F530-P548 HydrophobicContact CE1-CG 3.75Å; F530-P548 HydrophobicContact CE2-CG 3.86Å; F530-P548 HydrophobicContact CG-CB 3.79Å; F530-P548 HydrophobicContact CG-CG 3.75Å; F530-P548 HydrophobicContact CZ-CG 3.82Å
531	R	89.1	Confident	90.2	Very high	179 Å²	179	49.5 Å²	49.5	68%	0.675	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	39.4	-175.8	-61.6	-179.1	174.3	-172.2	-2.5	113.7	M459 V533	M459-R531 WeakPolarHBondContact O-CA 3.23Å; M459-R531 WeakPolarHBondContact O-CG 3.11Å; M459-R531 PolarHBondContact O-N 2.78Å; M459-R531 VanDerWaalsContact O-N 3.13Å; R531-V533 VanDerWaalsContact C-N 3.28Å; R531-V533 PolarHBondContact O-N 3.27Å
532	G	84.4	Confident	90.4	Very high	50 Å²	50	44.1 Å²	44.1	52%	0.515	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.5	-9.1	-179.5	0	0	0	0	0	115.5	Q529 F530	Q529-G532 PolarHBondContact NE2-O 2.94Å; F530-G532 PolarHBondContact O-N 2.76Å
533	V	90.3	Very high	90.4	Very high	49 Å²	49	47.3 Å²	47.3	30%	0.297	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	136.7	-176.2	-177.8	0	0	0	0	111.6	Q529 F530 R531 H535 R553	Q529-V533 WeakPolarHBondContact CA-O 3.47Å; F530-V533 PolarHBondContact N-O 2.86Å; F530-V533 PolarHBondContact O-N 2.87Å; R531-V533 VanDerWaalsContact C-N 3.28Å; R531-V533 PolarHBondContact O-N 3.27Å; V533-H535 PolarHBondContact O-CE1 2.9Å; V533-H535 PolarHBondContact O-ND1 2.86Å; V533-R553 HydrophobicContact CG1-CG 3.72Å
534	M	91.4	Very high	90.4	Very high	70 Å²	70	48.6 Å²	48.6	35%	0.345	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	140.9	179.8	-62.8	-71.3	-81.5	0	0	112	L464 L527 Q529 I554	L464-M534 HydrophobicContact CD1-CE 3.28Å; L464-M534 HydrophobicContact CD1-SD 3.35Å; L464-M534 WeakPolarHBondContact CD1-SD 3.37Å; L527-M534 HydrophobicContact CD1-CE 4.33Å; L527-M534 HydrophobicContact CD2-CE 4.09Å; L527-M534 HydrophobicContact CG-CE 4.26Å; Q529-M534 HydrophobicContact CB-SD 4.26Å; Q529-M534 HydrophobicContact CG-SD 4.36Å; M534-I554 HydrophobicContact CB-CB 4.39Å; M534-I554 HydrophobicContact CB-CD1 4.19Å; M534-I554 PolarHBondContact O-N 3.03Å
535	H	92.3	Very high	90.4	Very high	13 Å²	13	49 Å²	49	6%	0.06	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	146.5	179.4	-62.6	74.7	0	0	0	110.9	L527 Y528 V533 K549 H552 R553	L527-H535 WeakPolarHBondContact CA-O 3.5Å; Y528-H535 HydrophobicContact CD1-CB 4.1Å; Y528-H535 HydrophobicContact CD2-CB 3.79Å; Y528-H535 HydrophobicContact CE1-CB 3.66Å; Y528-H535 HydrophobicContact CE2-CB 3.32Å; Y528-H535 AromaticContact CE2-CG 3.54Å; Y528-H535 AromaticContact CE2-ND1 3.88Å; Y528-H535 HydrophobicContact CG-CB 4.17Å; Y528-H535 AromaticContact CZ-CG 3.78Å; Y528-H535 PolarHBondContact N-O 2.82Å; Y528-H535 PolarHBondContact O-N 3.31Å; V533-H535 PolarHBondContact O-CE1 2.9Å; V533-H535 PolarHBondContact O-ND1 2.86Å; H535-K549 PolarHBondContact CD2-O 2.79Å; H535-H552 CarbonylContact C-O 3.48Å; H535-H552 WeakPolarHBondContact CA-O 3.28Å; H535-H552 HydrophobicContact CB-CB 4Å; H535-H552 VanDerWaalsContact CB-O 3.29Å; H535-H552 WeakPolarHBondContact CB-O 3.43Å; H535-R553 WeakPolarHBondContact CD2-CA 3.31Å; H535-R553 PolarHBondContact CD2-N 2.84Å; H535-R553 VanDerWaalsContact CD2-N 3.32Å
536	Q	91.6	Very high	90.4	Very high	86 Å²	86	52 Å²	52	40%	0.402	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	140.2	175.7	-179.3	-179.7	-38.9	0	0	111.2	K525 V526 L527 H552 I554	K525-Q536 VanDerWaalsContact CE-NE2 3.27Å; V526-Q536 WeakPolarHBondContact O-CA 3.37Å; L527-Q536 HydrophobicContact CD1-CB 4.14Å; Q536-H552 PolarHBondContact N-O 2.77Å; Q536-H552 WeakPolarHBondContact O-CB 3.39Å; Q536-I554 HydrophobicContact CB-CD1 3.74Å; Q536-I554 HydrophobicContact CB-CG1 3.95Å
537	V	91.9	Very high	90.3	Very high	15 Å²	15	52.2 Å²	52.2	9%	0.091	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	143.8	174.8	61.1	0	0	0	0	110.9	K525 V526 Y528 L545 I547	K525-V537 CarbonylContact C-O 3.52Å; K525-V537 WeakPolarHBondContact CA-O 3.28Å; V526-V537 HydrophobicContact CB-CG1 3.87Å; V526-V537 HydrophobicContact CG2-CG1 4.38Å; V526-V537 PolarHBondContact N-O 2.83Å; V526-V537 PolarHBondContact O-N 2.8Å; Y528-V537 HydrophobicContact CE1-CG1 4.23Å; V537-L545 HydrophobicContact CG1-CD1 3.97Å; V537-L545 HydrophobicContact CG1-CD2 4.29Å; V537-L545 HydrophobicContact CG2-CD1 3.8Å; V537-I547 HydrophobicContact CG1-CG2 4.26Å
538	L	90.8	Very high	90.1	Very high	92 Å²	92	52.7 Å²	52.7	48%	0.482	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	132.4	167.7	-174.7	73.9	0	0	0	107.6	F471 L524 K525	F471-L538 HydrophobicContact CD2-CD1 3.91Å; F471-L538 HydrophobicContact CE2-CD1 4.14Å; F471-L538 HydrophobicContact CG-CD1 4.45Å; L524-L538 CarbonylContact O-C 3.35Å; L524-L538 WeakPolarHBondContact O-CA 3.32Å; K525-L538 HydrophobicContact CB-CD1 3.88Å; K525-L538 HydrophobicContact CG-CD1 4.5Å
539	S	90.3	Very high	89.9	Confident	3 Å²	3	57.6 Å²	57.6	2%	0.021	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	137.7	-178	179.4	0	0	0	0	111.3	K507 S523 L524 E543	K507-S539 PolarHBondContact NZ-OG 3.13Å; S523-S539 CarbonylContact C-O 3.56Å; S523-S539 VanDerWaalsContact CA-O 3.29Å; S523-S539 WeakPolarHBondContact CA-O 3.41Å; S523-S539 VanDerWaalsContact CB-O 3.3Å; S523-S539 WeakPolarHBondContact CB-O 3.34Å; L524-S539 PolarHBondContact N-O 3Å; L524-S539 PolarHBondContact O-N 2.77Å; S539-E543 VanDerWaalsContact CA-OE2 3.26Å; S539-E543 WeakPolarHBondContact CA-OE2 3.48Å; S539-E543 PolarHBondContact OG-O 3.31Å; S539-E543 PolarHBondContact OG-OE2 3.21Å
540	G	89.1	Confident	89.5	Confident	27 Å²	27	63.2 Å²	63.2	28%	0.278	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	162.7	178.9	0	0	0	0	0	113.1	K507 T542 E543	K507-G540 WeakPolarHBondContact CE-O 3.32Å; K507-G540 PolarHBondContact NZ-O 3.34Å; G540-T542 PolarHBondContact O-N 2.91Å; G540-E543 PolarHBondContact N-OE2 3.1Å; G540-E543 PolarHBondContact O-N 2.83Å; G540-E543 VanDerWaalsContact O-N 3.16Å
541	D	87.6	Confident	89.3	Confident	25 Å²	25	65.9 Å²	65.9	13%	0.134	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-47.8	-174.2	-171.1	34.3	0	0	0	114.5	Y468 S506 K507 K522	Y468-D541 VanDerWaalsContact CE2-OD1 3.31Å; Y468-D541 WeakPolarHBondContact CE2-OD1 3.32Å; Y468-D541 VanDerWaalsContact CZ-OD1 3.31Å; Y468-D541 PolarHBondContact OH-OD1 2.82Å; Y468-D541 PolarHBondContact OH-OD2 2.78Å; S506-D541 PolarHBondContact OG-OD1 3.09Å; S506-D541 PolarHBondContact OG-OD2 3.14Å; K507-D541 WeakPolarHBondContact CB-OD1 3.43Å; K507-D541 VanDerWaalsContact CD-O 3.24Å; K507-D541 WeakPolarHBondContact CD-O 3.35Å; K507-D541 WeakPolarHBondContact CE-O 3.46Å; K507-D541 VanDerWaalsContact CG-O 3.25Å; K507-D541 WeakPolarHBondContact CG-O 3.3Å; K507-D541 PolarHBondContact N-O 3.47Å; K507-D541 PolarHBondContact N-OD1 2.92Å; K522-D541 HydrophobicContact CB-CB 4.22Å; K522-D541 PolarHBondContact O-N 2.83Å; K522-D541 VanDerWaalsContact O-N 3.1Å
542	T	85.8	Confident	89.3	Confident	69 Å²	69	58.6 Å²	58.6	42%	0.423	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	1.2	-179	51.8	0	0	0	0	113.5	I10 E504 G540	I10-T542 HydrophobicContact CD1-CG2 3.96Å; E504-T542 CarbonylContact C-O 3.58Å; E504-T542 VanDerWaalsContact CA-O 3.3Å; E504-T542 WeakPolarHBondContact CA-O 3.47Å; G540-T542 PolarHBondContact O-N 2.91Å
543	E	88.6	Confident	89.5	Confident	101 Å²	101	63 Å²	63	47%	0.472	32%	0.321	S	S	.	.	S	Bend	trans	-80.3	128.7	-177.3	-171.9	-169.6	-172	0	0	110.9	K507 S539 G540 L545	K507-E543 VanDerWaalsContact CE-O 3.26Å; K507-E543 WeakPolarHBondContact CE-O 3.3Å; K507-E543 PolarHBondContact NZ-O 2.9Å; S539-E543 VanDerWaalsContact CA-OE2 3.26Å; S539-E543 WeakPolarHBondContact CA-OE2 3.48Å; S539-E543 PolarHBondContact OG-O 3.31Å; S539-E543 PolarHBondContact OG-OE2 3.21Å; G540-E543 PolarHBondContact N-OE2 3.1Å; G540-E543 PolarHBondContact O-N 2.83Å; G540-E543 VanDerWaalsContact O-N 3.16Å; E543-L545 PolarHBondContact O-N 2.84Å
544	P	88.8	Confident	89.3	Confident	49 Å²	49	63.8 Å²	63.8	32%	0.318	32%	0.322	S	S	.	.			trans	-71.7	128.4	-176.8	27.9	-31.5	0	0	0	110.8	E504	E504-P544 HydrophobicContact CG-CB 3.87Å; E504-P544 HydrophobicContact CG-CG 3.75Å
545	L	91.2	Very high	88.7	Confident	7 Å²	7	65.7 Å²	65.7	4%	0.037	33%	0.334	C	S	.	.			trans	-108.4	123.8	-177.9	-174.8	62.6	0	0	0	111	I501 L502 L524 V526 V537 E543 I547	I501-L545 CarbonylContact C-O 3.45Å; I501-L545 WeakPolarHBondContact CA-O 3.24Å; L502-L545 HydrophobicContact CB-CB 4.04Å; L502-L545 HydrophobicContact CD1-CB 4.02Å; L502-L545 HydrophobicContact CD1-CD2 4.06Å; L502-L545 HydrophobicContact CG-CB 4.21Å; L502-L545 PolarHBondContact N-O 2.78Å; L502-L545 PolarHBondContact O-N 2.85Å; L524-L545 HydrophobicContact CD2-CD2 4.16Å; V526-L545 HydrophobicContact CG2-CD2 4.02Å; V537-L545 HydrophobicContact CG1-CD1 3.97Å; V537-L545 HydrophobicContact CG1-CD2 4.29Å; V537-L545 HydrophobicContact CG2-CD1 3.8Å; E543-L545 PolarHBondContact O-N 2.84Å; L545-I547 HydrophobicContact CD1-CG2 3.94Å; L545-I547 HydrophobicContact CG-CG2 4.11Å
546	R	91.3	Very high	87.2	Confident	124 Å²	124	70.3 Å²	70.3	47%	0.468	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	117.5	171.4	-66.6	-177.9	176.2	-179	-4.7	109.4	L500 I501 K549	L500-R546 WeakPolarHBondContact O-CA 3.45Å; I501-R546 HydrophobicContact CG1-CG 4.26Å; I501-R546 HydrophobicContact CG2-CG 4.1Å; R546-K549 WeakPolarHBondContact O-CE 3.42Å; R546-K549 WeakPolarHBondContact O-CG 3.44Å
547	I	91.8	Very high	85.2	Confident	5 Å²	5	73.6 Å²	73.6	3%	0.026	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	148.9	177.4	61.3	172.5	0	0	0	110	L461 K499 L500 V526 Y528 V537 L545	L461-I547 HydrophobicContact CD1-CD1 4.45Å; L461-I547 HydrophobicContact CD2-CD1 4.16Å; L461-I547 HydrophobicContact CD2-CG1 3.98Å; K499-I547 WeakPolarHBondContact CA-O 3.32Å; L500-I547 HydrophobicContact CB-CD1 4.06Å; L500-I547 HydrophobicContact CB-CG1 3.61Å; L500-I547 HydrophobicContact CD2-CD1 3.68Å; L500-I547 HydrophobicContact CD2-CG1 3.97Å; L500-I547 HydrophobicContact CG-CD1 4.46Å; L500-I547 HydrophobicContact CG-CG1 4.27Å; L500-I547 PolarHBondContact N-O 2.89Å; L500-I547 PolarHBondContact O-N 2.99Å; V526-I547 HydrophobicContact CG1-CD1 4.33Å; Y528-I547 HydrophobicContact CD1-CD1 3.71Å; Y528-I547 HydrophobicContact CE1-CB 3.91Å; Y528-I547 HydrophobicContact CE1-CD1 3.89Å; Y528-I547 HydrophobicContact CE1-CG1 4.49Å; Y528-I547 HydrophobicContact CE1-CG2 3.68Å; Y528-I547 HydrophobicContact CE2-CB 4.39Å; Y528-I547 HydrophobicContact CG-CD1 4.1Å; V537-I547 HydrophobicContact CG1-CG2 4.26Å; L545-I547 HydrophobicContact CD1-CG2 3.94Å; L545-I547 HydrophobicContact CG-CG2 4.11Å
548	P	88.7	Confident	82.6	Confident	37 Å²	37	82.7 Å²	82.7	24%	0.24	44%	0.444	C	S	.	.			cis	-83.1	145.2	6.5	33	-35.5	0	0	0	114.3	S498 Y528 F530	S498-P548 WeakPolarHBondContact O-CD 3.37Å; Y528-P548 HydrophobicContact CE2-CB 3.85Å; F530-P548 HydrophobicContact CB-CB 4.06Å; F530-P548 HydrophobicContact CD1-CB 3.8Å; F530-P548 HydrophobicContact CD1-CG 3.72Å; F530-P548 HydrophobicContact CD2-CB 4.29Å; F530-P548 HydrophobicContact CD2-CG 3.82Å; F530-P548 HydrophobicContact CE1-CB 4.31Å; F530-P548 HydrophobicContact CE1-CG 3.75Å; F530-P548 HydrophobicContact CE2-CG 3.86Å; F530-P548 HydrophobicContact CG-CB 3.79Å; F530-P548 HydrophobicContact CG-CG 3.75Å; F530-P548 HydrophobicContact CZ-CG 3.82Å
549	K	89	Confident	82.2	Confident	102 Å²	102	82.2 Å²	82.2	44%	0.443	44%	0.442	S	S	.	.			trans	-125.8	146.5	168.1	-71.2	-178.2	-178.1	177.1	0	110.5	Y528 H535 R546 S551 H552	Y528-K549 PolarHBondContact OH-N 2.76Å; H535-K549 PolarHBondContact CD2-O 2.79Å; R546-K549 WeakPolarHBondContact O-CE 3.42Å; R546-K549 WeakPolarHBondContact O-CG 3.44Å; K549-S551 VanDerWaalsContact C-N 3.28Å; K549-S551 PolarHBondContact O-N 2.79Å; K549-H552 PolarHBondContact O-N 2.8Å
550	Q	84.9	Confident	81.8	Confident	183 Å²	183	86.4 Å²	86.4	86%	0.855	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-63	-32.8	176.7	-73.7	-175.1	-11.5	0	0	113	H552 R553	Q550-H552 PolarHBondContact O-N 2.79Å; Q550-H552 VanDerWaalsContact O-N 3.1Å; Q550-R553 WeakPolarHBondContact O-CB 3.49Å; Q550-R553 PolarHBondContact O-N 2.78Å; Q550-R553 VanDerWaalsContact O-N 3.12Å
551	S	87.6	Confident	81.4	Confident	98 Å²	98	89.7 Å²	89.7	69%	0.685	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-62.9	-15.5	178.9	55	0	0	0	0	114.3	K549	K549-S551 VanDerWaalsContact C-N 3.28Å; K549-S551 PolarHBondContact O-N 2.79Å
552	H	88	Confident	81	Confident	25 Å²	25	93.5 Å²	93.5	12%	0.116	50%	0.495	C	S	.	.	G	3₁₀ helix	trans	-94.4	-1.4	-179.5	-56.4	164.1	0	0	0	112.4	Y528 H535 Q536 K549 Q550 I554	Y528-H552 HydrophobicContact CE1-CB 4.4Å; Y528-H552 WeakPolarHBondContact OH-CB 3.47Å; Y528-H552 PolarHBondContact OH-ND1 2.96Å; Y528-H552 VanDerWaalsContact OH-ND1 3.09Å; H535-H552 CarbonylContact C-O 3.48Å; H535-H552 WeakPolarHBondContact CA-O 3.28Å; H535-H552 HydrophobicContact CB-CB 4Å; H535-H552 VanDerWaalsContact CB-O 3.29Å; H535-H552 WeakPolarHBondContact CB-O 3.43Å; Q536-H552 PolarHBondContact N-O 2.77Å; Q536-H552 WeakPolarHBondContact O-CB 3.39Å; K549-H552 PolarHBondContact O-N 2.8Å; Q550-H552 PolarHBondContact O-N 2.79Å; Q550-H552 VanDerWaalsContact O-N 3.1Å; H552-I554 PolarHBondContact O-N 3.34Å
553	R	88.4	Confident	80.7	Confident	143 Å²	143	95 Å²	95	54%	0.54	50%	0.499	S	S	.	.	B	Isolated β-bridge	trans	-61.9	134.4	-175.6	-177.4	175.5	177.1	178.9	-0.1	110.2	V533 H535 Q550 D555	V533-R553 HydrophobicContact CG1-CG 3.72Å; H535-R553 WeakPolarHBondContact CD2-CA 3.31Å; H535-R553 PolarHBondContact CD2-N 2.84Å; H535-R553 VanDerWaalsContact CD2-N 3.32Å; Q550-R553 WeakPolarHBondContact O-CB 3.49Å; Q550-R553 PolarHBondContact O-N 2.78Å; Q550-R553 VanDerWaalsContact O-N 3.12Å; R553-D555 IonicContact NE-OD1 2.92Å
554	I	86.7	Confident	80.2	Confident	65 Å²	65	94.6 Å²	94.6	33%	0.333	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-91.7	116.1	169.8	-53	173.6	0	0	0	106.2	L527 M534 Q536 H552	L527-I554 HydrophobicContact CD1-CD1 3.54Å; M534-I554 HydrophobicContact CB-CB 4.39Å; M534-I554 HydrophobicContact CB-CD1 4.19Å; M534-I554 PolarHBondContact O-N 3.03Å; Q536-I554 HydrophobicContact CB-CD1 3.74Å; Q536-I554 HydrophobicContact CB-CG1 3.95Å; H552-I554 PolarHBondContact O-N 3.34Å
555	D	79.6	Confident	79.6	Confident	111 Å²	111	97.9 Å²	97.9	59%	0.594	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-74.7	130.4	172.1	-67.7	-34.7	0	0	0	108.8	R553 D557	R553-D555 IonicContact NE-OD1 2.92Å; D555-D557 PolarHBondContact O-N 2.81Å
556	S	58.9	Low	78.7	Confident	110 Å²	110	104.8 Å²	104.8	77%	0.769	55%	0.551	S	S	*	*	S	Bend	trans	-80.2	12.6	-173.1	49.3	0	0	0	0	114.5
557	D	50.7	Low	77.7	Confident	154 Å²	154	103.3 Å²	103.3	82%	0.824	56%	0.557	S	S	*	*			trans	-103.6	35.8	-171.7	-82.3	-0	0	0	0	114.1	D555	D555-D557 PolarHBondContact O-N 2.81Å
558	T	38	Very low	76.4	Confident	206 Å²	206	112.2 Å²	112.2	100%	1.264	61%	0.606	S	S	*	*			trans	-134.7	0	168.2	53	0	0	0	0	112.8

Retrieved 558 of 558 residues in 247.9 ms (Link to these results)

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